*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   25-JUN-06   2HFQ              
*TITLE     NMR STRUCTURE OF PROTEIN NE1680 FROM NITROSOMONAS EUROPAEA:           
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET NET5                 
*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: NITROSOMONAS EUROPAEA;                          
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: NE1680;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: NOVAGEN BL21(DE3) GOLD;                    
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET15B DERIVATIVE                         
*KEYWDS    A/B PROTEIN, STRUCTURAL GENOMICS, PSI-2, PROTEIN STRUCTURE            
*KEYWDS   2 INITIATIVE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.R.CORT, A.A.YEE, V.YIM, J.LUKIN, M.A.KENNEDY, NORTHEAST             
*AUTHOR   2 STRUCTURAL GENOMICS CONSORTIUM (NESG)                                
*REVDAT   1   19-SEP-06 2HFQ    0                                                


REMARK noe distance restraints

assign (resid   1 and name HA   ) (resid   1 and name HE#  )  1.80  0.00  3.20
assign (resid   1 and name HA   ) (resid   2 and name HN   )  1.80  0.00  1.70 
assign (resid   1 and name HA   ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   1 and name HB#  ) (resid   2 and name HN   )  1.80  0.00  2.70
assign (resid   1 and name HB#  ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   1 and name HB#  ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   1 and name HG2  ) (resid   1 and name HE#  )  1.80  0.00  3.20
assign (resid   1 and name HG1  ) (resid   1 and name HE#  )  1.80  0.00  3.20
assign (resid   1 and name HG2  ) (resid   2 and name HN   )  1.80  0.00  3.20
assign (resid   1 and name HG1  ) (resid   2 and name HN   )  1.80  0.00  3.20
assign (resid   1 and name HG#  ) (resid   3 and name HG2# )  1.80  0.00  3.20
assign (resid   1 and name HG#  ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   1 and name HG#  ) (resid  68 and name HG2# )  1.80  0.00  3.20 
assign (resid   1 and name HG#  ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid   3 and name HG2# )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  25 and name HA   )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  25 and name HB2  )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  25 and name HB1  )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  68 and name HA   )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  68 and name HG2# )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  71 and name HB   )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid   1 and name HE#  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid   2 and name HA   ) (resid   3 and name HN   )  1.80  0.00  1.70
assign (resid   2 and name HA   ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid   2 and name HA   ) (resid  62 and name HA   )  1.80  0.00  3.20
assign (resid   2 and name HA   ) (resid  63 and name HN   )  1.80  0.00  3.20
assign (resid   2 and name HA   ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   2 and name HG#  ) (resid   3 and name HN   )  1.80  0.00  3.20
assign (resid   2 and name HG#  ) (resid  60 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HN   ) (resid   3 and name HG12 )  1.80  0.00  3.20
assign (resid   3 and name HN   ) (resid   3 and name HG11 )  1.80  0.00  3.20
assign (resid   3 and name HN   ) (resid   3 and name HD1# )  1.80  0.00  3.20 
assign (resid   3 and name HN   ) (resid  62 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HA   ) (resid   3 and name HB   )  1.80  0.00  1.10
assign (resid   3 and name HA   ) (resid   3 and name HD1# )  1.80  0.00  3.20 
assign (resid   3 and name HA   ) (resid   4 and name HN   )  1.80  0.00  1.70
assign (resid   3 and name HA   ) (resid   4 and name HD2  )  1.80  0.00  3.20
assign (resid   3 and name HA   ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HA   ) (resid  25 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HA   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid   3 and name HB   ) (resid   4 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HB   ) (resid  23 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HB   ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HB   ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HB   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid   3 and name HG12 ) (resid   3 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HG11 ) (resid   3 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HG1# ) (resid   5 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HG12 ) (resid  61 and name HG#  )  1.80  0.00  3.20
assign (resid   3 and name HG11 ) (resid  61 and name HG#  )  1.80  0.00  3.20
assign (resid   3 and name HG1# ) (resid  63 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HG12 ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HG11 ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HG1# ) (resid  64 and name HD#  )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid   4 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  23 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  25 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  25 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  63 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  63 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  68 and name HG1# )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   3 and name HG2# ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid   5 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid   5 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  23 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  23 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  23 and name HE#  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  61 and name HG2  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  61 and name HG1  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  63 and name HA   )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  63 and name HB#  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  64 and name HD2  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  64 and name HD1  )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid   3 and name HD1# ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid   4 and name HN   ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid   4 and name HN   ) (resid  25 and name HA   )  1.80  0.00  3.20 
assign (resid   4 and name HA   ) (resid   5 and name HN   )  1.80  0.00  1.70
assign (resid   4 and name HA   ) (resid   5 and name HG2# )  1.80  0.00  3.20
assign (resid   4 and name HA   ) (resid  60 and name HA   )  1.80  0.00  3.20
assign (resid   4 and name HB2  ) (resid   5 and name HN   )  1.80  0.00  3.20
assign (resid   4 and name HB1  ) (resid   5 and name HN   )  1.80  0.00  3.20 
assign (resid   4 and name HB#  ) (resid   6 and name HE#  )  1.80  0.00  3.20
assign (resid   4 and name HB#  ) (resid  57 and name HE#  )  1.80  0.00  3.20
assign (resid   4 and name HD2  ) (resid  25 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HN   ) (resid   5 and name HB   )  1.80  0.00  1.70  
assign (resid   5 and name HN   ) (resid   5 and name HG1# )  1.80  0.00  3.20 
assign (resid   5 and name HN   ) (resid   5 and name HG2# )  1.80  0.00  1.70
assign (resid   5 and name HN   ) (resid  57 and name HD#  )  1.80  0.00  3.20
assign (resid   5 and name HN   ) (resid  57 and name HE#  )  1.80  0.00  3.20
assign (resid   5 and name HN   ) (resid  59 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HN   ) (resid  60 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HA   ) (resid   6 and name HN   )  1.80  0.00  1.10
assign (resid   5 and name HA   ) (resid   6 and name HB#  )  1.80  0.00  3.20 
assign (resid   5 and name HA   ) (resid  23 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HA   ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid   5 and name HA   ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HB   ) (resid  58 and name HB#  )  1.80  0.00  3.20
assign (resid   5 and name HB   ) (resid  59 and name HN   )  1.80  0.00  1.70
assign (resid   5 and name HG1# ) (resid   6 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid   6 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid   6 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid   7 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid   7 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  21 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  21 and name HB#  )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  22 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  23 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  23 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  23 and name HE#  )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  23 and name HE#  )  1.80  0.00  3.20
assign (resid   5 and name HG1# ) (resid  58 and name HB#  )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  58 and name HB#  )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  59 and name HD2  )  1.80  0.00  3.20 
assign (resid   5 and name HG1# ) (resid  59 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  59 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  60 and name HA   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  61 and name HG2  )  1.80  0.00  3.20
assign (resid   5 and name HG2# ) (resid  61 and name HG1  )  1.80  0.00  3.20
assign (resid   6 and name HA   ) (resid   7 and name HN   )  1.80  0.00  1.70
assign (resid   6 and name HA   ) (resid  57 and name HA   )  1.80  0.00  3.20
assign (resid   6 and name HA   ) (resid  58 and name HN   )  1.80  0.00  3.20
assign (resid   6 and name HA   ) (resid  58 and name HB#  )  1.80  0.00  3.20
assign (resid   6 and name HB2  ) (resid  22 and name HN   )  1.80  0.00  3.20
assign (resid   6 and name HB1  ) (resid  22 and name HN   )  1.80  0.00  3.20
assign (resid   6 and name HB2  ) (resid  22 and name HB   )  1.80  0.00  3.20
assign (resid   6 and name HB1  ) (resid  22 and name HB   )  1.80  0.00  3.20
assign (resid   6 and name HB#  ) (resid  22 and name HG2# )  1.80  0.00  3.20
assign (resid   6 and name HB2  ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid   6 and name HB1  ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid   6 and name HE#  ) (resid  24 and name HG2# )  1.80  0.00  3.20
assign (resid   6 and name HE#  ) (resid  29 and name HA   )  1.80  0.00  3.20
assign (resid   6 and name HD#  ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid   6 and name HE#  ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid   7 and name HN   ) (resid   7 and name HB2  )  1.80  0.00  1.70
assign (resid   7 and name HN   ) (resid   7 and name HB1  )  1.80  0.00  1.70
assign (resid   7 and name HN   ) (resid  56 and name HN   )  1.80  0.00  3.20
assign (resid   7 and name HN   ) (resid  56 and name HB#  )  1.80  0.00  3.20
assign (resid   7 and name HN   ) (resid  57 and name HA   )  1.80  0.00  3.20
assign (resid   7 and name HN   ) (resid  58 and name HN   )  1.80  0.00  3.20
assign (resid   7 and name HA   ) (resid   8 and name HN   )  1.80  0.00  1.10
assign (resid   7 and name HA   ) (resid  21 and name HA   )  1.80  0.00  3.20
assign (resid   7 and name HA   ) (resid  22 and name HN   )  1.80  0.00  3.20
assign (resid   7 and name HB#  ) (resid  56 and name HN   )  1.80  0.00  3.20
assign (resid   7 and name HB#  ) (resid  56 and name HB#  )  1.80  0.00  3.20
assign (resid   8 and name HN   ) (resid   8 and name HG2# )  1.80  0.00  3.20
assign (resid   8 and name HN   ) (resid  21 and name HA   )  1.80  0.00  3.20
assign (resid   8 and name HA   ) (resid   9 and name HN   )  1.80  0.00  1.10
assign (resid   8 and name HA   ) (resid  55 and name HA   )  1.80  0.00  3.20
assign (resid   8 and name HA   ) (resid  55 and name HB#  )  1.80  0.00  3.20
assign (resid   8 and name HA   ) (resid  56 and name HN   )  1.80  0.00  3.20
assign (resid   8 and name HB   ) (resid  10 and name HG2# )  1.80  0.00  3.20
assign (resid   8 and name HB   ) (resid  20 and name HN   )  1.80  0.00  3.20
assign (resid   8 and name HB   ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid   8 and name HB   ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid   8 and name HB   ) (resid  22 and name HG2# )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid   9 and name HN   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  10 and name HB   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  10 and name HG2# )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  20 and name HN   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  36 and name HA   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  50 and name HA   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  54 and name HB#  )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  55 and name HA   )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  55 and name HB#  )  1.80  0.00  3.20
assign (resid   8 and name HG2# ) (resid  56 and name HN   )  1.80  0.00  3.20
assign (resid   9 and name HN   ) (resid   9 and name HD#  )  1.80  0.00  3.20
assign (resid   9 and name HN   ) (resid  54 and name HA   )  1.80  0.00  3.20
assign (resid   9 and name HN   ) (resid  54 and name HB#  )  1.80  0.00  3.20
assign (resid   9 and name HN   ) (resid  55 and name HA   )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid   9 and name HD#  )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  10 and name HN   )  1.80  0.00  1.10
assign (resid   9 and name HA   ) (resid  10 and name HB   )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  10 and name HG2# )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  19 and name HA   )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  19 and name HD2  )  1.80  0.00  3.20
assign (resid   9 and name HA   ) (resid  20 and name HN   )  1.80  0.00  3.20
assign (resid   9 and name HB#  ) (resid   9 and name HD#  )  1.80  0.00  3.20
assign (resid   9 and name HB2  ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid   9 and name HB1  ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid   9 and name HD#  ) (resid  10 and name HN   )  1.80  0.00  3.20 
assign (resid   9 and name HD#  ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid   9 and name HD#  ) (resid  19 and name HB#  )  1.80  0.00  3.20
assign (resid   9 and name HE#  ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid   9 and name HE#  ) (resid  19 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HN   ) (resid  10 and name HG1# )  1.80  0.00  3.20
assign (resid  10 and name HN   ) (resid  10 and name HG2# )  1.80  0.00  3.20
assign (resid  10 and name HN   ) (resid  17 and name HA   )  1.80  0.00  3.20
assign (resid  10 and name HN   ) (resid  17 and name HG1# )  1.80  0.00  3.20 
assign (resid  10 and name HN   ) (resid  18 and name HN   )  1.80  0.00  3.20
assign (resid  10 and name HN   ) (resid  18 and name HB#  )  1.80  0.00  3.20 
assign (resid  10 and name HN   ) (resid  19 and name HA   )  1.80  0.00  3.20
assign (resid  10 and name HA   ) (resid  11 and name HN   )  1.80  0.00  1.10
assign (resid  10 and name HA   ) (resid  54 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HA   ) (resid  54 and name HG#  )  1.80  0.00  3.20
assign (resid  10 and name HB   ) (resid  11 and name HN   )  1.80  0.00  3.20
assign (resid  10 and name HB   ) (resid  18 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HB   ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid  10 and name HB   ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  10 and name HB   ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  11 and name HN   )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  11 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  12 and name HA   )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  18 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  18 and name HE#  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  18 and name HE#  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  45 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  48 and name HA   )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  50 and name HA   )  1.80  0.00  3.20
assign (resid  10 and name HG1# ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  54 and name HB2  )  1.80  0.00  3.20
assign (resid  10 and name HG2# ) (resid  54 and name HB1  )  1.80  0.00  3.20
assign (resid  11 and name HA   ) (resid  17 and name HN   )  1.80  0.00  3.20
assign (resid  11 and name HA   ) (resid  17 and name HA   )  1.80  0.00  3.20
assign (resid  11 and name HA   ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid  11 and name HA   ) (resid  17 and name HG2# )  1.80  0.00  3.20
assign (resid  11 and name HB#  ) (resid  11 and name HE#  )  1.80  0.00  3.20
assign (resid  11 and name HB#  ) (resid  17 and name HG2# )  1.80  0.00  3.20 
assign (resid  11 and name HG#  ) (resid  17 and name HA   )  1.80  0.00  3.20 
assign (resid  11 and name HG#  ) (resid  17 and name HG2# )  1.80  0.00  3.20
assign (resid  11 and name HE#  ) (resid  17 and name HG1# )  1.80  0.00  3.20 
assign (resid  11 and name HD#  ) (resid  17 and name HG1# )  1.80  0.00  3.20
assign (resid  11 and name HG#  ) (resid  17 and name HG1# )  1.80  0.00  3.20 
assign (resid  11 and name HE#  ) (resid  17 and name HG2# )  1.80  0.00  3.20
assign (resid  12 and name HN   ) (resid  13 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HN   ) (resid  16 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HN   ) (resid  17 and name HA   )  1.80  0.00  3.20 
assign (resid  12 and name HN   ) (resid  17 and name HG2# )  1.80  0.00  3.20
assign (resid  12 and name HN   ) (resid  18 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HA   ) (resid  14 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HA   ) (resid  15 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HA   ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  13 and name HB#  )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  14 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  16 and name HN   )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  18 and name HG2  )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  18 and name HG1  )  1.80  0.00  3.20
assign (resid  12 and name HB#  ) (resid  18 and name HE#  )  1.80  0.00  3.20
assign (resid  13 and name HN   ) (resid  13 and name HG2  )  1.80  0.00  3.20
assign (resid  13 and name HN   ) (resid  13 and name HG1  )  1.80  0.00  3.20
assign (resid  13 and name HN   ) (resid  13 and name HD#  )  1.80  0.00  3.20 
assign (resid  13 and name HN   ) (resid  14 and name HN   )  1.80  0.00  3.20
assign (resid  13 and name HN   ) (resid  15 and name HN   )  1.80  0.00  3.20
assign (resid  13 and name HA   ) (resid  13 and name HD#  )  1.80  0.00  3.20
assign (resid  13 and name HA   ) (resid  13 and name HE#  )  1.80  0.00  3.20
assign (resid  13 and name HA   ) (resid  15 and name HN   )  1.80  0.00  3.20
assign (resid  13 and name HB#  ) (resid  13 and name HD#  )  1.80  0.00  3.20
assign (resid  13 and name HB#  ) (resid  13 and name HE#  )  1.80  0.00  3.20
assign (resid  13 and name HB1  ) (resid  13 and name HE#  )  1.80  0.00  3.20
assign (resid  13 and name HB#  ) (resid  14 and name HN   )  1.80  0.00  2.70
assign (resid  13 and name HG2  ) (resid  13 and name HE#  )  1.80  0.00  3.20
assign (resid  13 and name HG2  ) (resid  14 and name HN   )  1.80  0.00  3.20
assign (resid  13 and name HG1  ) (resid  14 and name HN   )  1.80  0.00  3.20 
assign (resid  13 and name HD#  ) (resid  14 and name HN   )  1.80  0.00  3.20 
assign (resid  14 and name HN   ) (resid  15 and name HA#  )  1.80  0.00  3.20
assign (resid  14 and name HA   ) (resid  15 and name HN   )  1.80  0.00  1.70 
assign (resid  15 and name HN   ) (resid  16 and name HN   )  1.80  0.00  1.70
assign (resid  16 and name HN   ) (resid  16 and name HB#  )  1.80  0.00  1.70 
assign (resid  16 and name HN   ) (resid  17 and name HN   )  1.80  0.00  3.20 
assign (resid  16 and name HA   ) (resid  17 and name HN   )  1.80  0.00  1.10
assign (resid  16 and name HA   ) (resid  17 and name HG2# )  1.80  0.00  3.20 
assign (resid  16 and name HB#  ) (resid  17 and name HN   )  1.80  0.00  1.70
assign (resid  16 and name HD2  ) (resid  17 and name HN   )  1.80  0.00  3.20 
assign (resid  16 and name HD2  ) (resid  83 and name HA2  )  1.80  0.00  3.20
assign (resid  16 and name HD2  ) (resid  83 and name HA1  )  1.80  0.00  3.20
assign (resid  17 and name HN   ) (resid  17 and name HG2# )  1.80  0.00  3.20 
assign (resid  17 and name HB   ) (resid  18 and name HN   )  1.80  0.00  3.20
assign (resid  17 and name HG1# ) (resid  18 and name HN   )  1.80  0.00  3.20 
assign (resid  17 and name HG1# ) (resid  19 and name HN   )  1.80  0.00  3.20
assign (resid  17 and name HG1# ) (resid  19 and name HB#  )  1.80  0.00  3.20
assign (resid  18 and name HA   ) (resid  19 and name HN   )  1.80  0.00  1.10
assign (resid  18 and name HB#  ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid  18 and name HB#  ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid  18 and name HG#  ) (resid  19 and name HN   )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  20 and name HE#  )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  39 and name HZ2  )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  39 and name HZ3  )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  39 and name HH2  )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  18 and name HE#  ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  19 and name HN   ) (resid  83 and name HA#  )  1.80  0.00  3.20
assign (resid  19 and name HA   ) (resid  19 and name HD2  )  1.80  0.00  3.20
assign (resid  19 and name HA   ) (resid  20 and name HN   )  1.80  0.00  1.10
assign (resid  19 and name HB#  ) (resid  19 and name HD2  )  1.80  0.00  3.20
assign (resid  20 and name HN   ) (resid  20 and name HD#  )  1.80  0.00  3.20 
assign (resid  20 and name HN   ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  20 and name HA   ) (resid  21 and name HN   )  1.80  0.00  1.10
assign (resid  20 and name HA   ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HA   ) (resid  80 and name HA   )  1.80  0.00  3.20
assign (resid  20 and name HA   ) (resid  81 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HA   ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  20 and name HB#  ) (resid  20 and name HD#  )  1.80  0.00  3.20
assign (resid  20 and name HB2  ) (resid  21 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HB1  ) (resid  21 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HB2  ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HB1  ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HB2  ) (resid  80 and name HA   )  1.80  0.00  3.20
assign (resid  20 and name HB1  ) (resid  80 and name HA   )  1.80  0.00  3.20
assign (resid  20 and name HB#  ) (resid  81 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  21 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  22 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  39 and name HZ3  )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  79 and name HN   )  1.80  0.00  3.20
assign (resid  20 and name HD#  ) (resid  80 and name HA   )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  22 and name HG2# )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  36 and name HA   )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  39 and name HZ3  )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  20 and name HE#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  20 and name HZ   ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  20 and name HZ   ) (resid  40 and name HG   )  1.80  0.00  3.20
assign (resid  20 and name HZ   ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  79 and name HN   )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  79 and name HB#  )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  79 and name HD#  )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  81 and name HA   )  1.80  0.00  3.20
assign (resid  21 and name HN   ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  21 and name HA   ) (resid  22 and name HN   )  1.80  0.00  1.10
assign (resid  21 and name HA   ) (resid  22 and name HG2# )  1.80  0.00  3.20 
assign (resid  21 and name HB#  ) (resid  23 and name HE#  )  1.80  0.00  3.20
assign (resid  21 and name HB#  ) (resid  79 and name HB#  )  1.80  0.00  3.20
assign (resid  21 and name HB#  ) (resid  79 and name HD#  )  1.80  0.00  3.20
assign (resid  22 and name HN   ) (resid  22 and name HG2# )  1.80  0.00  3.20 
assign (resid  22 and name HA   ) (resid  23 and name HN   )  1.80  0.00  1.10
assign (resid  22 and name HA   ) (resid  78 and name HA   )  1.80  0.00  3.20
assign (resid  22 and name HA   ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  22 and name HA   ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  22 and name HB   ) (resid  24 and name HG2# )  1.80  0.00  3.20 
assign (resid  22 and name HB   ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  23 and name HN   )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  23 and name HN   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  24 and name HN   )  1.80  0.00  3.20 
assign (resid  22 and name HG1# ) (resid  24 and name HB   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  24 and name HG2# )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  32 and name HA   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  35 and name HN   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  35 and name HB2  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  35 and name HB1  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  36 and name HA   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  76 and name HB2  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  76 and name HB1  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  77 and name HN   )  1.80  0.00  3.20 
assign (resid  22 and name HG2# ) (resid  78 and name HA   )  1.80  0.00  3.20 
assign (resid  22 and name HG1# ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  78 and name HG1# )  1.80  0.00  3.20 
assign (resid  22 and name HG2# ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  22 and name HG1# ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  22 and name HG2# ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  23 and name HN   ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid  23 and name HN   ) (resid  77 and name HN   )  1.80  0.00  3.20
assign (resid  23 and name HN   ) (resid  77 and name HB#  )  1.80  0.00  3.20
assign (resid  23 and name HN   ) (resid  78 and name HA   )  1.80  0.00  3.20
assign (resid  23 and name HN   ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  23 and name HA   ) (resid  23 and name HD#  )  1.80  0.00  3.20
assign (resid  23 and name HA   ) (resid  24 and name HN   )  1.80  0.00  1.10
assign (resid  23 and name HB2  ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid  23 and name HB1  ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid  23 and name HB2  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  23 and name HB#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  23 and name HB1  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  23 and name HB2  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  23 and name HB1  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  23 and name HB#  ) (resid  77 and name HN   )  1.80  0.00  3.20 
assign (resid  23 and name HB#  ) (resid  77 and name HB#  )  1.80  0.00  3.20
assign (resid  23 and name HD#  ) (resid  24 and name HN   )  1.80  0.00  3.20
assign (resid  23 and name HD#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  23 and name HD#  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  23 and name HD#  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  23 and name HD#  ) (resid  77 and name HB#  )  1.80  0.00  3.20
assign (resid  23 and name HE#  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  24 and name HN   ) (resid  24 and name HG2# )  1.80  0.00  3.20 
assign (resid  24 and name HN   ) (resid  25 and name HN   )  1.80  0.00  3.20 
assign (resid  24 and name HN   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  24 and name HA   ) (resid  71 and name HG1# )  1.80  0.00  3.20
assign (resid  24 and name HA   ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid  24 and name HA   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  24 and name HA   ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  24 and name HA   ) (resid  77 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  25 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  26 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  26 and name HG2# )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  24 and name HB   ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  25 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  26 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  32 and name HN   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  32 and name HA   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  24 and name HG2# ) (resid  76 and name HB#  )  1.80  0.00  3.20
assign (resid  25 and name HN   ) (resid  26 and name HN   )  1.80  0.00  1.70 
assign (resid  25 and name HN   ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid  25 and name HN   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  25 and name HA   ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid  25 and name HB2  ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid  25 and name HB1  ) (resid  71 and name HG2# )  1.80  0.00  3.20
assign (resid  26 and name HN   ) (resid  26 and name HG2# )  1.80  0.00  3.20
assign (resid  26 and name HB   ) (resid  28 and name HB#  )  1.80  0.00  3.20
assign (resid  26 and name HG1# ) (resid  28 and name HA   )  1.80  0.00  3.20
assign (resid  26 and name HG1# ) (resid  28 and name HB#  )  1.80  0.00  3.20
assign (resid  26 and name HG2# ) (resid  28 and name HB#  )  1.80  0.00  3.20
assign (resid  26 and name HG1# ) (resid  31 and name HB#  )  1.80  0.00  3.20
assign (resid  26 and name HG2# ) (resid  31 and name HB#  )  1.80  0.00  3.20
assign (resid  26 and name HG2# ) (resid  31 and name HD#  )  1.80  0.00  3.20
assign (resid  26 and name HG1# ) (resid  31 and name HE#  )  1.80  0.00  3.20
assign (resid  26 and name HG1# ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  26 and name HG2# ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  27 and name HA   ) (resid  28 and name HN   )  1.80  0.00  1.10
assign (resid  27 and name HB#  ) (resid  28 and name HN   )  1.80  0.00  2.20
assign (resid  28 and name HN   ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid  28 and name HA   ) (resid  29 and name HN   )  1.80  0.00  1.70
assign (resid  28 and name HA   ) (resid  30 and name HN   )  1.80  0.00  3.20
assign (resid  28 and name HA   ) (resid  31 and name HB#  )  1.80  0.00  3.20
assign (resid  28 and name HB2  ) (resid  31 and name HN   )  1.80  0.00  3.20
assign (resid  28 and name HB1  ) (resid  31 and name HN   )  1.80  0.00  3.20
assign (resid  28 and name HB2  ) (resid  31 and name HB2  )  1.80  0.00  3.20
assign (resid  28 and name HB2  ) (resid  31 and name HB1  )  1.80  0.00  3.20
assign (resid  28 and name HB1  ) (resid  31 and name HB2  )  1.80  0.00  3.20
assign (resid  28 and name HB1  ) (resid  31 and name HB1  )  1.80  0.00  3.20
assign (resid  28 and name HB#  ) (resid  31 and name HD#  )  1.80  0.00  3.20
assign (resid  28 and name HB#  ) (resid  32 and name HN   )  1.80  0.00  3.20
assign (resid  29 and name HA   ) (resid  32 and name HB#  )  1.80  0.00  3.20
assign (resid  29 and name HN   ) (resid  30 and name HN   )  1.80  0.00  3.20
assign (resid  29 and name HB2  ) (resid  30 and name HN   )  1.80  0.00  3.20
assign (resid  29 and name HB1  ) (resid  30 and name HN   )  1.80  0.00  3.20
assign (resid  29 and name HB#  ) (resid  33 and name HD1# )  1.80  0.00  3.20
assign (resid  30 and name HN   ) (resid  30 and name HG2  )  1.80  0.00  3.20
assign (resid  30 and name HN   ) (resid  30 and name HG1  )  1.80  0.00  3.20
assign (resid  30 and name HN   ) (resid  31 and name HN   )  1.80  0.00  1.10
assign (resid  30 and name HA   ) (resid  32 and name HN   )  1.80  0.00  3.20
assign (resid  30 and name HA   ) (resid  33 and name HN   )  1.80  0.00  3.20
assign (resid  30 and name HA   ) (resid  33 and name HB   )  1.80  0.00  3.20
assign (resid  30 and name HA   ) (resid  33 and name HG1# )  1.80  0.00  3.20 
assign (resid  30 and name HA   ) (resid  33 and name HD1# )  1.80  0.00  3.20
assign (resid  30 and name HB2  ) (resid  30 and name HE#  )  1.80  0.00  3.20
assign (resid  30 and name HB1  ) (resid  30 and name HE#  )  1.80  0.00  3.20
assign (resid  30 and name HB2  ) (resid  31 and name HN   )  1.80  0.00  3.20
assign (resid  30 and name HB1  ) (resid  31 and name HN   )  1.80  0.00  3.20
assign (resid  30 and name HG2  ) (resid  30 and name HE#  )  1.80  0.00  3.20
assign (resid  30 and name HG1  ) (resid  30 and name HE#  )  1.80  0.00  3.20
assign (resid  30 and name HG#  ) (resid  31 and name HN   )  1.80  0.00  3.20
assign (resid  30 and name HG#  ) (resid  34 and name HN   )  1.80  0.00  3.20
assign (resid  31 and name HN   ) (resid  31 and name HG#  )  1.80  0.00  3.20
assign (resid  31 and name HN   ) (resid  31 and name HD#  )  1.80  0.00  3.20
assign (resid  31 and name HN   ) (resid  32 and name HN   )  1.80  0.00  1.70
assign (resid  31 and name HN   ) (resid  33 and name HN   )  1.80  0.00  3.20
assign (resid  31 and name HA   ) (resid  31 and name HD#  )  1.80  0.00  3.20
assign (resid  31 and name HA   ) (resid  31 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HA   ) (resid  34 and name HN   )  1.80  0.00  3.20
assign (resid  31 and name HA   ) (resid  34 and name HB#  )  1.80  0.00  3.20
assign (resid  31 and name HA   ) (resid  34 and name HG#  )  1.80  0.00  3.20 
assign (resid  31 and name HA   ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HB2  ) (resid  31 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HB1  ) (resid  31 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HB#  ) (resid  32 and name HN   )  1.80  0.00  2.70
assign (resid  31 and name HG#  ) (resid  34 and name HB#  )  1.80  0.00  3.20
assign (resid  31 and name HG#  ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HD#  ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  31 and name HE#  ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  32 and name HN   ) (resid  33 and name HN   )  1.80  0.00  1.70
assign (resid  32 and name HA   ) (resid  35 and name HN   )  1.80  0.00  3.20 
assign (resid  32 and name HA   ) (resid  35 and name HB2  )  1.80  0.00  3.20
assign (resid  32 and name HA   ) (resid  35 and name HB1  )  1.80  0.00  3.20
assign (resid  32 and name HA   ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  32 and name HA   ) (resid  35 and name HE#  )  1.80  0.00  3.20
assign (resid  32 and name HA   ) (resid  36 and name HN   )  1.80  0.00  3.20 
assign (resid  32 and name HB#  ) (resid  35 and name HN   )  1.80  0.00  3.20
assign (resid  32 and name HB#  ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  32 and name HB#  ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  33 and name HN   ) (resid  33 and name HG1# )  1.80  0.00  3.20
assign (resid  33 and name HN   ) (resid  33 and name HD1# )  1.80  0.00  3.20
assign (resid  33 and name HN   ) (resid  34 and name HN   )  1.80  0.00  1.70
assign (resid  33 and name HA   ) (resid  33 and name HD1# )  1.80  0.00  3.20
assign (resid  33 and name HA   ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  33 and name HA   ) (resid  36 and name HB#  )  1.80  0.00  3.20
assign (resid  33 and name HA   ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  33 and name HA   ) (resid  55 and name HB2  )  1.80  0.00  3.20
assign (resid  33 and name HA   ) (resid  55 and name HB1  )  1.80  0.00  3.20
assign (resid  33 and name HB   ) (resid  34 and name HN   )  1.80  0.00  3.20
assign (resid  33 and name HG12 ) (resid  33 and name HG2# )  1.80  0.00  3.20
assign (resid  33 and name HG11 ) (resid  33 and name HG2# )  1.80  0.00  3.20
assign (resid  33 and name HG1# ) (resid  50 and name HG1# )  1.80  0.00  3.20 
assign (resid  33 and name HG1# ) (resid  51 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HG12 ) (resid  55 and name HB2  )  1.80  0.00  3.20
assign (resid  33 and name HG12 ) (resid  55 and name HB1  )  1.80  0.00  3.20
assign (resid  33 and name HG11 ) (resid  55 and name HB2  )  1.80  0.00  3.20
assign (resid  33 and name HG11 ) (resid  55 and name HB1  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  34 and name HN   )  1.80  0.00  3.20 
assign (resid  33 and name HG2# ) (resid  34 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  35 and name HN   )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  37 and name HG2  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  37 and name HG1  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  37 and name HD2  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  37 and name HD1  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  37 and name HE#  )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  50 and name HB   )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  50 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  51 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HG2# ) (resid  55 and name HB#  )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  51 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  51 and name HB   )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  51 and name HG2# )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  52 and name HA   )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  52 and name HB#  )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  53 and name HN   )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  55 and name HB2  )  1.80  0.00  3.20
assign (resid  33 and name HD1# ) (resid  55 and name HB1  )  1.80  0.00  3.20
assign (resid  34 and name HN   ) (resid  34 and name HG2  )  1.80  0.00  3.20
assign (resid  34 and name HN   ) (resid  34 and name HG1  )  1.80  0.00  3.20
assign (resid  34 and name HN   ) (resid  35 and name HN   )  1.80  0.00  1.70
assign (resid  34 and name HA   ) (resid  37 and name HB#  )  1.80  0.00  3.20
assign (resid  34 and name HA   ) (resid  37 and name HD#  )  1.80  0.00  3.20
assign (resid  34 and name HA   ) (resid  38 and name HN   )  1.80  0.00  3.20
assign (resid  34 and name HB#  ) (resid  38 and name HG#  )  1.80  0.00  3.20
assign (resid  35 and name HN   ) (resid  35 and name HB#  )  1.80  0.00  1.70
assign (resid  35 and name HN   ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  35 and name HN   ) (resid  36 and name HN   )  1.80  0.00  1.20
assign (resid  35 and name HA   ) (resid  35 and name HD#  )  1.80  0.00  3.20
assign (resid  35 and name HA   ) (resid  38 and name HN   )  1.80  0.00  3.20 
assign (resid  35 and name HA   ) (resid  38 and name HB2  )  1.80  0.00  3.20
assign (resid  35 and name HA   ) (resid  38 and name HB1  )  1.80  0.00  3.20
assign (resid  35 and name HA   ) (resid  39 and name HN   )  1.80  0.00  3.20 
assign (resid  35 and name HB2  ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  35 and name HB1  ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  35 and name HB#  ) (resid  76 and name HB#  )  1.80  0.00  3.20
assign (resid  35 and name HB#  ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  35 and name HB#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  36 and name HN   )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  38 and name HB#  )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  38 and name HE2# )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  76 and name HB#  )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  35 and name HD#  ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  35 and name HE#  ) (resid  76 and name HB#  )  1.80  0.00  3.20
assign (resid  35 and name HE#  ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  36 and name HA   ) (resid  39 and name HB2  )  1.80  0.00  3.20
assign (resid  36 and name HA   ) (resid  39 and name HB1  )  1.80  0.00  3.20
assign (resid  36 and name HA   ) (resid  39 and name HE3  )  1.80  0.00  3.20
assign (resid  36 and name HA   ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  36 and name HB#  ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  36 and name HB#  ) (resid  50 and name HB   )  1.80  0.00  3.20
assign (resid  36 and name HB#  ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  36 and name HB#  ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  36 and name HB#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  37 and name HN   ) (resid  37 and name HG2  )  1.80  0.00  3.20
assign (resid  37 and name HN   ) (resid  37 and name HG1  )  1.80  0.00  3.20
assign (resid  37 and name HN   ) (resid  38 and name HN   )  1.80  0.00  1.10
assign (resid  37 and name HN   ) (resid  39 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HA   ) (resid  40 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HA   ) (resid  40 and name HB2  )  1.80  0.00  3.20
assign (resid  37 and name HA   ) (resid  40 and name HB1  )  1.80  0.00  3.20
assign (resid  37 and name HA   ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  37 and name HA   ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  37 and name HB#  ) (resid  37 and name HD#  )  1.80  0.00  3.20
assign (resid  37 and name HB#  ) (resid  41 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HG2  ) (resid  38 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HG1  ) (resid  38 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HG#  ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  37 and name HG#  ) (resid  50 and name HB   )  1.80  0.00  3.20
assign (resid  37 and name HG2  ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  37 and name HG2  ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  37 and name HG1  ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  37 and name HG1  ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  37 and name HD#  ) (resid  50 and name HN   )  1.80  0.00  3.20
assign (resid  37 and name HD#  ) (resid  50 and name HB   )  1.80  0.00  3.20 
assign (resid  37 and name HD#  ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  37 and name HD#  ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  37 and name HE#  ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  37 and name HE#  ) (resid  50 and name HB   )  1.80  0.00  3.20
assign (resid  38 and name HN   ) (resid  38 and name HB#  )  1.80  0.00  2.10
assign (resid  38 and name HN   ) (resid  38 and name HG2  )  1.80  0.00  3.20
assign (resid  38 and name HN   ) (resid  38 and name HG1  )  1.80  0.00  3.20 
assign (resid  38 and name HN   ) (resid  39 and name HN   )  1.80  0.00  1.70
assign (resid  38 and name HE2# ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HN   ) (resid  39 and name HE3  )  1.80  0.00  3.20
assign (resid  39 and name HN   ) (resid  40 and name HN   )  1.80  0.00  1.70
assign (resid  39 and name HN   ) (resid  40 and name HG   )  1.80  0.00  3.20
assign (resid  39 and name HA   ) (resid  39 and name HD1  )  1.80  0.00  3.20
assign (resid  39 and name HA   ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HB#  ) (resid  39 and name HD1  )  1.80  0.00  3.20
assign (resid  39 and name HB#  ) (resid  39 and name HE3  )  1.80  0.00  3.20
assign (resid  39 and name HB2  ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HB1  ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HB#  ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  39 and name HB#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  39 and name HD1  ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HD1  ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  39 and name HE1  ) (resid  43 and name HG2# )  1.80  0.00  2.20
assign (resid  39 and name HE1  ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  39 and name HE1  ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  39 and name HE1  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HE3  ) (resid  40 and name HN   )  1.80  0.00  3.20 
assign (resid  39 and name HE3  ) (resid  40 and name HG   )  1.80  0.00  3.20
assign (resid  39 and name HE3  ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  39 and name HE3  ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  78 and name HG2# )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  80 and name HG#  )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  80 and name HD2  )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  80 and name HD1  )  1.80  0.00  3.20
assign (resid  39 and name HZ2  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  39 and name HZ3  ) (resid  40 and name HG   )  1.80  0.00  3.20
assign (resid  39 and name HZ3  ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  39 and name HZ3  ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  39 and name HH2  ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  39 and name HH2  ) (resid  80 and name HG#  )  1.80  0.00  3.20
assign (resid  39 and name HH2  ) (resid  80 and name HD#  )  1.80  0.00  3.20
assign (resid  39 and name HH2  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  40 and name HN   ) (resid  40 and name HG   )  1.80  0.00  3.20
assign (resid  40 and name HN   ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  40 and name HN   ) (resid  40 and name HD2# )  1.80  0.00  3.20
assign (resid  40 and name HN   ) (resid  41 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  40 and name HD1# )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  40 and name HD2# )  1.80  0.00  1.70
assign (resid  40 and name HA   ) (resid  42 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  43 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  43 and name HG12 )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  43 and name HG11 )  1.80  0.00  3.20 
assign (resid  40 and name HA   ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  45 and name HB2  )  1.80  0.00  3.20
assign (resid  40 and name HA   ) (resid  45 and name HB1  )  1.80  0.00  3.20
assign (resid  40 and name HB2  ) (resid  41 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HB1  ) (resid  41 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HB#  ) (resid  45 and name HB2  )  1.80  0.00  3.20
assign (resid  40 and name HB#  ) (resid  45 and name HB1  )  1.80  0.00  3.20
assign (resid  40 and name HD1# ) (resid  41 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HD2# ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  40 and name HD2# ) (resid  45 and name HB#  )  1.80  0.00  3.20
assign (resid  40 and name HD2# ) (resid  45 and name HG2  )  1.80  0.00  3.20
assign (resid  40 and name HD2# ) (resid  45 and name HG1  )  1.80  0.00  3.20
assign (resid  40 and name HD1# ) (resid  48 and name HN   )  1.80  0.00  3.20
assign (resid  40 and name HD1# ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  40 and name HD2# ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  40 and name HD1# ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  41 and name HN   ) (resid  42 and name HN   )  1.80  0.00  1.70
assign (resid  41 and name HA   ) (resid  46 and name HB#  )  1.80  0.00  3.20
assign (resid  41 and name HA   ) (resid  46 and name HG#  )  1.80  0.00  3.20
assign (resid  41 and name HB#  ) (resid  46 and name HB#  )  1.80  0.00  3.20
assign (resid  41 and name HB#  ) (resid  46 and name HG#  )  1.80  0.00  3.20
assign (resid  41 and name HB#  ) (resid  42 and name HN   )  1.80  0.00  2.70
assign (resid  42 and name HN   ) (resid  43 and name HN   )  1.80  0.00  1.70
assign (resid  42 and name HN   ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  42 and name HB#  ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  43 and name HN   ) (resid  43 and name HG1# )  1.80  0.00  3.20
assign (resid  43 and name HN   ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  43 and name HN   ) (resid  44 and name HN   )  1.80  0.00  1.70
assign (resid  43 and name HN   ) (resid  45 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HA   ) (resid  43 and name HD1# )  1.80  0.00  3.20
assign (resid  43 and name HB   ) (resid  44 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HB   ) (resid  45 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HG12 ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  43 and name HG11 ) (resid  43 and name HG2# )  1.80  0.00  3.20
assign (resid  43 and name HG1# ) (resid  44 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HG1# ) (resid  45 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HG1# ) (resid  45 and name HB#  )  1.80  0.00  3.20
assign (resid  43 and name HG12 ) (resid  45 and name HG#  )  1.80  0.00  3.20
assign (resid  43 and name HG11 ) (resid  45 and name HG#  )  1.80  0.00  3.20
assign (resid  43 and name HG2# ) (resid  44 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HG2# ) (resid  45 and name HN   )  1.80  0.00  3.20 
assign (resid  43 and name HD1# ) (resid  44 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HD1# ) (resid  45 and name HN   )  1.80  0.00  3.20
assign (resid  43 and name HD1# ) (resid  45 and name HB2  )  1.80  0.00  3.20
assign (resid  43 and name HD1# ) (resid  45 and name HB1  )  1.80  0.00  3.20
assign (resid  43 and name HD1# ) (resid  45 and name HG2  )  1.80  0.00  3.20
assign (resid  43 and name HD1# ) (resid  45 and name HG1  )  1.80  0.00  3.20
assign (resid  44 and name HN   ) (resid  45 and name HN   )  1.80  0.00  1.70
assign (resid  44 and name HN   ) (resid  46 and name HN   )  1.80  0.00  3.20
assign (resid  44 and name HA#  ) (resid  46 and name HN   )  1.80  0.00  3.20
assign (resid  45 and name HN   ) (resid  45 and name HB#  )  1.80  0.00  1.70
assign (resid  45 and name HN   ) (resid  46 and name HN   )  1.80  0.00  1.70
assign (resid  45 and name HA   ) (resid  46 and name HN   )  1.80  0.00  1.70
assign (resid  45 and name HB#  ) (resid  48 and name HB#  )  1.80  0.00  3.20
assign (resid  47 and name HA2  ) (resid  48 and name HN   )  1.80  0.00  1.70
assign (resid  47 and name HA1  ) (resid  48 and name HN   )  1.80  0.00  1.70
assign (resid  48 and name HN   ) (resid  49 and name HN   )  1.80  0.00  3.20
assign (resid  48 and name HN   ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  48 and name HB#  ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  49 and name HN   ) (resid  49 and name HG2# )  1.80  0.00  3.20
assign (resid  49 and name HN   ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  49 and name HB   ) (resid  50 and name HN   )  1.80  0.00  3.20 
assign (resid  49 and name HB   ) (resid  54 and name HG#  )  1.80  0.00  3.20
assign (resid  49 and name HG2# ) (resid  50 and name HA   )  1.80  0.00  3.20
assign (resid  50 and name HN   ) (resid  50 and name HG1# )  1.80  0.00  3.20
assign (resid  50 and name HN   ) (resid  50 and name HG2# )  1.80  0.00  3.20
assign (resid  50 and name HA   ) (resid  54 and name HN   )  1.80  0.00  3.20
assign (resid  50 and name HA   ) (resid  54 and name HB2  )  1.80  0.00  3.20
assign (resid  50 and name HA   ) (resid  54 and name HB1  )  1.80  0.00  3.20
assign (resid  50 and name HA   ) (resid  54 and name HG#  )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  51 and name HN   )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  54 and name HN   )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  54 and name HB2  )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  54 and name HB1  )  1.80  0.00  3.20
assign (resid  50 and name HG2# ) (resid  54 and name HB#  )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  54 and name HG#  )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  55 and name HA   )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  55 and name HB2  )  1.80  0.00  3.20
assign (resid  50 and name HG1# ) (resid  55 and name HB1  )  1.80  0.00  3.20
assign (resid  50 and name HG2# ) (resid  55 and name HB#  )  1.80  0.00  3.20
assign (resid  51 and name HN   ) (resid  51 and name HG2# )  1.80  0.00  3.20
assign (resid  51 and name HN   ) (resid  54 and name HN   )  1.80  0.00  3.20
assign (resid  51 and name HN   ) (resid  54 and name HB1  )  1.80  0.00  3.20
assign (resid  51 and name HN   ) (resid  54 and name HB2  )  1.80  0.00  3.20
assign (resid  51 and name HN   ) (resid  54 and name HG#  )  1.80  0.00  3.20
assign (resid  51 and name HB   ) (resid  52 and name HB#  )  1.80  0.00  3.20
assign (resid  51 and name HG2# ) (resid  52 and name HN   )  1.80  0.00  3.20
assign (resid  51 and name HG2# ) (resid  53 and name HN   )  1.80  0.00  3.20
assign (resid  51 and name HG2# ) (resid  53 and name HB#  )  1.80  0.00  3.20
assign (resid  52 and name HA   ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid  52 and name HA   ) (resid  55 and name HB#  )  1.80  0.00  3.20
assign (resid  53 and name HN   ) (resid  53 and name HB2  )  1.80  0.00  1.70
assign (resid  53 and name HN   ) (resid  53 and name HB1  )  1.80  0.00  1.70
assign (resid  53 and name HN   ) (resid  53 and name HG2  )  1.80  0.00  3.20
assign (resid  53 and name HN   ) (resid  53 and name HG1  )  1.80  0.00  3.20
assign (resid  53 and name HN   ) (resid  54 and name HN   )  1.80  0.00  1.70
assign (resid  53 and name HN   ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid  53 and name HA   ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid  53 and name HB2  ) (resid  54 and name HN   )  1.80  0.00  3.20
assign (resid  53 and name HB1  ) (resid  54 and name HN   )  1.80  0.00  3.20
assign (resid  54 and name HN   ) (resid  54 and name HG2  )  1.80  0.00  3.20
assign (resid  54 and name HN   ) (resid  54 and name HG1  )  1.80  0.00  3.20
assign (resid  54 and name HN   ) (resid  55 and name HN   )  1.80  0.00  1.20
assign (resid  54 and name HB2  ) (resid  55 and name HN   )  1.80  0.00  2.20
assign (resid  54 and name HB1  ) (resid  55 and name HN   )  1.80  0.00  2.20
assign (resid  54 and name HG#  ) (resid  55 and name HN   )  1.80  0.00  3.20
assign (resid  55 and name HN   ) (resid  56 and name HN   )  1.80  0.00  3.20
assign (resid  55 and name HA   ) (resid  56 and name HN   )  1.80  0.00  1.10
assign (resid  56 and name HN   ) (resid  56 and name HG#  )  1.80  0.00  3.20
assign (resid  56 and name HN   ) (resid  56 and name HD#  )  1.80  0.00  3.20
assign (resid  56 and name HN   ) (resid  57 and name HN   )  1.80  0.00  3.20
assign (resid  56 and name HA   ) (resid  56 and name HD#  )  1.80  0.00  3.20
assign (resid  56 and name HA   ) (resid  57 and name HN   )  1.80  0.00  1.10
assign (resid  56 and name HG#  ) (resid  57 and name HN   )  1.80  0.00  3.20
assign (resid  57 and name HN   ) (resid  57 and name HD#  )  1.80  0.00  3.20
assign (resid  57 and name HN   ) (resid  58 and name HN   )  1.80  0.00  3.20
assign (resid  57 and name HA   ) (resid  57 and name HD#  )  1.80  0.00  3.20
assign (resid  57 and name HB#  ) (resid  57 and name HD#  )  1.80  0.00  3.20
assign (resid  57 and name HB#  ) (resid  57 and name HE#  )  1.80  0.00  3.20
assign (resid  57 and name HE#  ) (resid  59 and name HA   )  1.80  0.00  3.20
assign (resid  58 and name HN   ) (resid  59 and name HN   )  1.80  0.00  1.20
assign (resid  59 and name HN   ) (resid  60 and name HN   )  1.80  0.00  3.20
assign (resid  59 and name HA   ) (resid  60 and name HN   )  1.80  0.00  1.10
assign (resid  59 and name HB2  ) (resid  60 and name HN   )  1.80  0.00  1.70
assign (resid  59 and name HB1  ) (resid  60 and name HN   )  1.80  0.00  1.70
assign (resid  59 and name HD2  ) (resid  61 and name HB#  )  1.80  0.00  3.20
assign (resid  60 and name HA   ) (resid  61 and name HN   )  1.80  0.00  1.70
assign (resid  60 and name HB2  ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid  60 and name HB1  ) (resid  61 and name HN   )  1.80  0.00  3.20
assign (resid  61 and name HN   ) (resid  61 and name HG2  )  1.80  0.00  3.20
assign (resid  61 and name HN   ) (resid  61 and name HG1  )  1.80  0.00  3.20
assign (resid  61 and name HN   ) (resid  62 and name HN   )  1.80  0.00  3.20
assign (resid  61 and name HA   ) (resid  62 and name HN   )  1.80  0.00  1.70 
assign (resid  61 and name HB2  ) (resid  62 and name HN   )  1.80  0.00  3.20
assign (resid  61 and name HB1  ) (resid  62 and name HN   )  1.80  0.00  3.20
assign (resid  62 and name HN   ) (resid  62 and name HG#  )  1.80  0.00  3.20
assign (resid  62 and name HG2  ) (resid  62 and name HE#  )  1.80  0.00  3.20
assign (resid  62 and name HG1  ) (resid  62 and name HE#  )  1.80  0.00  3.20
assign (resid  62 and name HG2  ) (resid  63 and name HN   )  1.80  0.00  3.20
assign (resid  62 and name HG1  ) (resid  63 and name HN   )  1.80  0.00  3.20
assign (resid  63 and name HN   ) (resid  64 and name HD#  )  1.80  0.00  3.20
assign (resid  63 and name HA   ) (resid  64 and name HG#  )  1.80  0.00  3.20
assign (resid  63 and name HA   ) (resid  64 and name HD2  )  1.80  0.00  3.20
assign (resid  63 and name HA   ) (resid  64 and name HD1  )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  64 and name HD2  )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  64 and name HD1  )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  67 and name HB   )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  68 and name HN   )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  68 and name HA   )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  68 and name HG1# )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid  63 and name HB#  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  64 and name HB2  ) (resid  65 and name HN   )  1.80  0.00  3.20
assign (resid  64 and name HB1  ) (resid  65 and name HN   )  1.80  0.00  3.20
assign (resid  64 and name HB#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  64 and name HB#  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  64 and name HG#  ) (resid  67 and name HN   )  1.80  0.00  3.20 
assign (resid  64 and name HG#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  64 and name HG#  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  64 and name HD#  ) (resid  67 and name HB   )  1.80  0.00  3.20
assign (resid  64 and name HD#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  64 and name HD2  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  64 and name HD1  ) (resid  67 and name HG2# )  1.80  0.00  3.20
assign (resid  65 and name HN   ) (resid  65 and name HB2  )  1.80  0.00  1.70
assign (resid  65 and name HN   ) (resid  65 and name HB1  )  1.80  0.00  1.70
assign (resid  65 and name HN   ) (resid  66 and name HN   )  1.80  0.00  2.20
assign (resid  65 and name HA   ) (resid  68 and name HN   )  1.80  0.00  3.20
assign (resid  65 and name HA   ) (resid  68 and name HB   )  1.80  0.00  3.20
assign (resid  65 and name HA   ) (resid  68 and name HG1# )  1.80  0.00  3.20 
assign (resid  65 and name HA   ) (resid  68 and name HG2# )  1.80  0.00  3.20
assign (resid  65 and name HA   ) (resid  68 and name HD1# )  1.80  0.00  2.20
assign (resid  66 and name HN   ) (resid  66 and name HG2  )  1.80  0.00  3.20
assign (resid  66 and name HN   ) (resid  66 and name HG1  )  1.80  0.00  3.20
assign (resid  66 and name HN   ) (resid  67 and name HN   )  1.80  0.00  3.20
assign (resid  66 and name HA   ) (resid  69 and name HN   )  1.80  0.00  3.20
assign (resid  66 and name HB#  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  66 and name HG#  ) (resid  67 and name HN   )  1.80  0.00  3.20
assign (resid  66 and name HG2  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  66 and name HG1  ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  67 and name HN   ) (resid  67 and name HG1# )  1.80  0.00  3.20
assign (resid  67 and name HN   ) (resid  67 and name HG2# )  1.80  0.00  2.20
assign (resid  67 and name HN   ) (resid  68 and name HG1# )  1.80  0.00  3.20
assign (resid  67 and name HA   ) (resid  67 and name HG1# )  1.80  0.00  1.20
assign (resid  67 and name HA   ) (resid  70 and name HB#  )  1.80  0.00  3.20
assign (resid  67 and name HA   ) (resid  77 and name HD#  )  1.80  0.00  3.20
assign (resid  67 and name HB   ) (resid  68 and name HN   )  1.80  0.00  3.20
assign (resid  67 and name HB   ) (resid  70 and name HB#  )  1.80  0.00  3.20
assign (resid  67 and name HB   ) (resid  71 and name HD1# )  1.80  0.00  3.20 
assign (resid  67 and name HB   ) (resid  77 and name HB2  )  1.80  0.00  3.20
assign (resid  67 and name HB   ) (resid  77 and name HB1  )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  68 and name HN   )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  68 and name HN   )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  68 and name HA   )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  68 and name HG1# )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  70 and name HB#  )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  70 and name HB#  )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  71 and name HG1# )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  67 and name HG2# ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  77 and name HB2  )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  77 and name HB1  )  1.80  0.00  3.20
assign (resid  67 and name HG1# ) (resid  77 and name HD#  )  1.80  0.00  3.20
assign (resid  68 and name HN   ) (resid  68 and name HG12 )  1.80  0.00  3.20
assign (resid  68 and name HN   ) (resid  68 and name HG11 )  1.80  0.00  3.20
assign (resid  68 and name HN   ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid  68 and name HN   ) (resid  69 and name HN   )  1.80  0.00  1.70
assign (resid  68 and name HA   ) (resid  68 and name HD1# )  1.80  0.00  3.20
assign (resid  68 and name HA   ) (resid  70 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HA   ) (resid  71 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HA   ) (resid  71 and name HB   )  1.80  0.00  3.20
assign (resid  68 and name HA   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  68 and name HA   ) (resid  72 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HB   ) (resid  69 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HB   ) (resid  69 and name HB#  )  1.80  0.00  3.20
assign (resid  68 and name HG12 ) (resid  68 and name HG2# )  1.80  0.00  3.20
assign (resid  68 and name HG11 ) (resid  68 and name HG2# )  1.80  0.00  3.20
assign (resid  68 and name HG12 ) (resid  69 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HG11 ) (resid  69 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HG2# ) (resid  69 and name HA   )  1.80  0.00  3.20
assign (resid  68 and name HG2# ) (resid  69 and name HN   )  1.80  0.00  3.20
assign (resid  68 and name HG2# ) (resid  72 and name HG#  )  1.80  0.00  3.20
assign (resid  68 and name HG2# ) (resid  72 and name HD#  )  1.80  0.00  3.20
assign (resid  68 and name HG2# ) (resid  72 and name HE#  )  1.80  0.00  3.20
assign (resid  69 and name HN   ) (resid  69 and name HB#  )  1.80  0.00  2.10
assign (resid  69 and name HN   ) (resid  69 and name HG#  )  1.80  0.00  3.20
assign (resid  69 and name HN   ) (resid  70 and name HN   )  1.80  0.00  1.70
assign (resid  69 and name HN   ) (resid  71 and name HN   )  1.80  0.00  3.20
assign (resid  69 and name HA   ) (resid  72 and name HB#  )  1.80  0.00  3.20
assign (resid  69 and name HA   ) (resid  72 and name HD#  )  1.80  0.00  3.20
assign (resid  69 and name HA   ) (resid  72 and name HE#  )  1.80  0.00  3.20
assign (resid  69 and name HB#  ) (resid  70 and name HB#  )  1.80  0.00  3.20
assign (resid  69 and name HG#  ) (resid  70 and name HN   )  1.80  0.00  3.20
assign (resid  70 and name HN   ) (resid  71 and name HN   )  1.80  0.00  1.70
assign (resid  70 and name HA   ) (resid  73 and name HN   )  1.80  0.00  3.20
assign (resid  70 and name HA   ) (resid  73 and name HB#  )  1.80  0.00  3.20
assign (resid  70 and name HA   ) (resid  74 and name HN   )  1.80  0.00  3.20
assign (resid  70 and name HA   ) (resid  74 and name HD21 )  1.80  0.00  3.20
assign (resid  70 and name HA   ) (resid  74 and name HD22 )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  71 and name HA   )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  73 and name HN   )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  73 and name HB#  )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  74 and name HN   )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  74 and name HD21 )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  74 and name HD22 )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  77 and name HA   )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  77 and name HB2  )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  77 and name HB1  )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  77 and name HD#  )  1.80  0.00  3.20
assign (resid  70 and name HB#  ) (resid  77 and name HE#  )  1.80  0.00  3.20
assign (resid  71 and name HN   ) (resid  71 and name HG12 )  1.80  0.00  3.20
assign (resid  71 and name HN   ) (resid  71 and name HG11 )  1.80  0.00  3.20
assign (resid  71 and name HN   ) (resid  71 and name HD1# )  1.80  0.00  3.20
assign (resid  71 and name HN   ) (resid  72 and name HN   )  1.80  0.00  1.70
assign (resid  71 and name HA   ) (resid  71 and name HD1# )  1.80  0.00  3.20 
assign (resid  71 and name HA   ) (resid  74 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HA   ) (resid  74 and name HB#  )  1.80  0.00  3.20
assign (resid  71 and name HA   ) (resid  75 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HA   ) (resid  76 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HA   ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HG12 ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HG11 ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HG1# ) (resid  77 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HG12 ) (resid  77 and name HB#  )  1.80  0.00  3.20
assign (resid  71 and name HG11 ) (resid  77 and name HB#  )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  72 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  72 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  75 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  75 and name HA#  )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  76 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HG2# ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HD1# ) (resid  76 and name HA   )  1.80  0.00  3.20
assign (resid  71 and name HD1# ) (resid  77 and name HN   )  1.80  0.00  3.20
assign (resid  71 and name HD1# ) (resid  77 and name HB2  )  1.80  0.00  3.20
assign (resid  71 and name HD1# ) (resid  77 and name HB1  )  1.80  0.00  3.20
assign (resid  72 and name HN   ) (resid  72 and name HB#  )  1.80  0.00  2.10
assign (resid  72 and name HN   ) (resid  72 and name HG#  )  1.80  0.00  3.20
assign (resid  72 and name HN   ) (resid  72 and name HD#  )  1.80  0.00  3.20
assign (resid  72 and name HN   ) (resid  73 and name HN   )  1.80  0.00  1.70
assign (resid  72 and name HA   ) (resid  73 and name HN   )  1.80  0.00  1.70
assign (resid  72 and name HB#  ) (resid  72 and name HD#  )  1.80  0.00  3.20
assign (resid  72 and name HB#  ) (resid  72 and name HE#  )  1.80  0.00  3.20
assign (resid  72 and name HB#  ) (resid  73 and name HN   )  1.80  0.00  2.70
assign (resid  72 and name HG2  ) (resid  72 and name HE#  )  1.80  0.00  3.20
assign (resid  72 and name HG1  ) (resid  72 and name HE#  )  1.80  0.00  3.20
assign (resid  72 and name HG2  ) (resid  73 and name HN   )  1.80  0.00  3.20
assign (resid  72 and name HG1  ) (resid  73 and name HN   )  1.80  0.00  3.20
assign (resid  73 and name HN   ) (resid  73 and name HB#  )  1.80  0.00  2.10
assign (resid  73 and name HN   ) (resid  73 and name HG2  )  1.80  0.00  3.20
assign (resid  73 and name HN   ) (resid  73 and name HG1  )  1.80  0.00  3.20
assign (resid  73 and name HN   ) (resid  74 and name HN   )  1.80  0.00  1.70
assign (resid  73 and name HN   ) (resid  75 and name HN   )  1.80  0.00  3.20
assign (resid  73 and name HB#  ) (resid  74 and name HN   )  1.80  0.00  2.70
assign (resid  73 and name HB#  ) (resid  74 and name HD2# )  1.80  0.00  3.20
assign (resid  73 and name HB#  ) (resid  75 and name HN   )  1.80  0.00  3.20
assign (resid  74 and name HN   ) (resid  74 and name HB#  )  1.80  0.00  2.10
assign (resid  74 and name HN   ) (resid  74 and name HD21 )  1.80  0.00  3.20
assign (resid  74 and name HN   ) (resid  74 and name HD22 )  1.80  0.00  3.20
assign (resid  74 and name HN   ) (resid  75 and name HA#  )  1.80  0.00  3.20
assign (resid  74 and name HN   ) (resid  75 and name HN   )  1.80  0.00  1.70
assign (resid  74 and name HN   ) (resid  76 and name HN   )  1.80  0.00  3.20
assign (resid  74 and name HB#  ) (resid  75 and name HN   )  1.80  0.00  2.20
assign (resid  74 and name HB#  ) (resid  76 and name HN   )  1.80  0.00  3.20
assign (resid  74 and name HB#  ) (resid  76 and name HE#  )  1.80  0.00  3.20
assign (resid  75 and name HN   ) (resid  76 and name HN   )  1.80  0.00  1.70
assign (resid  76 and name HN   ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  76 and name HN   ) (resid  77 and name HN   )  1.80  0.00  3.20
assign (resid  76 and name HA   ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  76 and name HA   ) (resid  77 and name HN   )  1.80  0.00  1.10
assign (resid  76 and name HB1  ) (resid  76 and name HD#  )  1.80  0.00  3.20
assign (resid  76 and name HD#  ) (resid  77 and name HN   )  1.80  0.00  3.20 
assign (resid  76 and name HD#  ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  76 and name HD#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  76 and name HE#  ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  76 and name HE#  ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  77 and name HA   ) (resid  77 and name HD#  )  1.80  0.00  3.20
assign (resid  77 and name HA   ) (resid  78 and name HN   )  1.80  0.00  1.10
assign (resid  77 and name HB2  ) (resid  78 and name HN   )  1.80  0.00  3.20
assign (resid  77 and name HB1  ) (resid  78 and name HN   )  1.80  0.00  3.20
assign (resid  77 and name HD#  ) (resid  78 and name HN   )  1.80  0.00  3.20
assign (resid  77 and name HD#  ) (resid  79 and name HB#  )  1.80  0.00  3.20
assign (resid  78 and name HN   ) (resid  78 and name HG1# )  1.80  0.00  3.20
assign (resid  78 and name HN   ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  78 and name HA   ) (resid  78 and name HD1# )  1.80  0.00  3.20
assign (resid  78 and name HA   ) (resid  79 and name HN   )  1.80  0.00  1.10
assign (resid  78 and name HG2# ) (resid  79 and name HN   )  1.80  0.00  3.20
assign (resid  78 and name HG2# ) (resid  80 and name HN   )  1.80  0.00  2.20
assign (resid  78 and name HG2# ) (resid  80 and name HA   )  1.80  0.00  3.20
assign (resid  78 and name HG2# ) (resid  80 and name HG#  )  1.80  0.00  3.20
assign (resid  78 and name HG2# ) (resid  80 and name HD#  )  1.80  0.00  3.20
assign (resid  78 and name HG2# ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  78 and name HD1# ) (resid  79 and name HN   )  1.80  0.00  3.20
assign (resid  79 and name HN   ) (resid  79 and name HD#  )  1.80  0.00  3.20
assign (resid  79 and name HN   ) (resid  80 and name HN   )  1.80  0.00  3.20
assign (resid  79 and name HA   ) (resid  79 and name HD#  )  1.80  0.00  3.20
assign (resid  79 and name HA   ) (resid  80 and name HN   )  1.80  0.00  1.10
assign (resid  79 and name HB2  ) (resid  80 and name HN   )  1.80  0.00  3.20
assign (resid  79 and name HB1  ) (resid  80 and name HN   )  1.80  0.00  3.20
assign (resid  79 and name HD#  ) (resid  80 and name HN   )  1.80  0.00  3.20 
assign (resid  79 and name HD#  ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  79 and name HE#  ) (resid  81 and name HA   )  1.80  0.00  3.20
assign (resid  79 and name HE#  ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HN   ) (resid  80 and name HG#  )  1.80  0.00  3.20
assign (resid  80 and name HN   ) (resid  80 and name HD#  )  1.80  0.00  3.20
assign (resid  80 and name HN   ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HA   ) (resid  80 and name HD#  )  1.80  0.00  3.20
assign (resid  80 and name HA   ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HB#  ) (resid  80 and name HD#  )  1.80  0.00  3.20
assign (resid  80 and name HB2  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HB1  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HB#  ) (resid  84 and name HB#  )  1.80  0.00  3.20
assign (resid  80 and name HG2  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HG1  ) (resid  80 and name HE#  )  1.80  0.00  3.20
assign (resid  80 and name HG#  ) (resid  81 and name HN   )  1.80  0.00  3.20
assign (resid  81 and name HN   ) (resid  81 and name HG#  )  1.80  0.00  3.20
assign (resid  81 and name HN   ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  81 and name HN   ) (resid  82 and name HN   )  1.80  0.00  3.20
assign (resid  81 and name HA   ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  81 and name HB2  ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  81 and name HB1  ) (resid  81 and name HE#  )  1.80  0.00  3.20
assign (resid  81 and name HB2  ) (resid  82 and name HN   )  1.80  0.00  3.20
assign (resid  81 and name HB1  ) (resid  82 and name HN   )  1.80  0.00  3.20
assign (resid  81 and name HG#  ) (resid  82 and name HN   )  1.80  0.00  3.20
assign (resid  81 and name HE#  ) (resid  82 and name HN   )  1.80  0.00  3.20



REMARK H-bond restraints, slow exchangers only

assign (resid  24 and name O    )(resid   4 and name N    )  2.70  0.00  0.60
assign (resid  24 and name O    )(resid   4 and name HN   )  1.70  0.00  0.60
assign (resid  22 and name O    )(resid   6 and name N    )  2.70  0.00  0.60
assign (resid  22 and name O    )(resid   6 and name HN   )  1.70  0.00  0.60
assign (resid  54 and name O    )(resid   9 and name N    )  2.70  0.00  0.60
assign (resid  54 and name O    )(resid   9 and name HN   )  1.70  0.00  0.60
assign (resid  18 and name O    )(resid  10 and name N    )  2.70  0.00  0.60
assign (resid  18 and name O    )(resid  10 and name HN   )  1.70  0.00  0.60
assign (resid  10 and name O    )(resid  18 and name N    )  2.70  0.00  0.60
assign (resid  10 and name O    )(resid  18 and name HN   )  1.70  0.00  0.60
assign (resid   6 and name O    )(resid  22 and name N    )  2.70  0.00  0.60
assign (resid   6 and name O    )(resid  22 and name HN   )  1.70  0.00  0.60
assign (resid  77 and name O    )(resid  23 and name N    )  2.70  0.00  0.60
assign (resid  77 and name O    )(resid  23 and name HN   )  1.70  0.00  0.60
assign (resid   4 and name O    )(resid  24 and name N    )  2.70  0.00  0.60
assign (resid   4 and name O    )(resid  24 and name HN   )  1.70  0.00  0.60
assign (resid  23 and name O    )(resid  77 and name N    )  2.70  0.00  0.60
assign (resid  23 and name O    )(resid  77 and name HN   )  1.70  0.00  0.60
assign (resid  30 and name O    )(resid  34 and name N    )  2.70  0.00  0.60
assign (resid  30 and name O    )(resid  34 and name HN   )  1.70  0.00  0.60
assign (resid  31 and name O    )(resid  35 and name N    )  2.70  0.00  0.60
assign (resid  31 and name O    )(resid  35 and name HN   )  1.70  0.00  0.60
assign (resid  32 and name O    )(resid  36 and name N    )  2.70  0.00  0.60
assign (resid  32 and name O    )(resid  36 and name HN   )  1.70  0.00  0.60
assign (resid  33 and name O    )(resid  37 and name N    )  2.70  0.00  0.60
assign (resid  33 and name O    )(resid  37 and name HN   )  1.70  0.00  0.60
assign (resid  36 and name O    )(resid  40 and name N    )  2.70  0.00  0.60
assign (resid  36 and name O    )(resid  40 and name HN   )  1.70  0.00  0.60
assign (resid  39 and name O    )(resid  43 and name N    )  2.70  0.00  0.60
assign (resid  39 and name O    )(resid  43 and name HN   )  1.70  0.00  0.60
assign (resid  67 and name O    )(resid  71 and name N    )  2.70  0.00  0.60
assign (resid  67 and name O    )(resid  71 and name HN   )  1.70  0.00  0.60
assign (resid  68 and name O    )(resid  72 and name N    )  2.70  0.00  0.60
assign (resid  68 and name O    )(resid  72 and name HN   )  1.70  0.00  0.60

REMARK DIHEDRAL RESTRAINTS

! PHI for HIS 4
assign (resid  3   and name C   )  (resid  4  and name N   )
       (resid  4   and name CA  )  (resid  4  and name C   )  1.0 -119.67 30 2

! PSI for HIS 4
assign (resid  4   and name N   )  (resid  4  and name CA  )
       (resid  4   and name C   )  (resid  5  and name N   )  1.0 132.23 40 2

! PHI for VAL 5
assign (resid  4   and name C   )  (resid  5  and name N   )
       (resid  5   and name CA  )  (resid  5  and name C   )  1.0 -110.84 30 2

! PSI for VAL 5
assign (resid  5   and name N   )  (resid  5  and name CA  )
       (resid  5   and name C   )  (resid  6  and name N   )  1.0 131.32 40 2

! PHI for TYR 6
assign (resid  5   and name C   )  (resid  6  and name N   )
       (resid  6   and name CA  )  (resid  6  and name C   )  1.0 -101.68 30 2

! PSI for TYR 6
assign (resid  6   and name N   )  (resid  6  and name CA  )
       (resid  6   and name C   )  (resid  7  and name N   )  1.0 121.74 40 2

! PHI for THR 8
assign (resid  7   and name C   )  (resid  8  and name N   )
       (resid  8   and name CA  )  (resid  8  and name C   )  1.0 -112.14 30 2

! PSI for THR 8
assign (resid  8   and name N   )  (resid  8  and name CA  )
       (resid  8   and name C   )  (resid  9  and name N   )  1.0 124.23 40 2

! PHI for TYR 9
assign (resid  8   and name C   )  (resid  9  and name N   )
       (resid  9   and name CA  )  (resid  9  and name C   )  1.0 -113.46 30 2

! PSI for TYR 9
assign (resid  9   and name N   )  (resid  9  and name CA  )
       (resid  9   and name C   )  (resid  10  and name N   )  1.0 142.28 40 2

! PHI for VAL 10
assign (resid  9   and name C   )  (resid  10  and name N   )
       (resid  10   and name CA  )  (resid  10  and name C   )  1.0 -137.82 30 2

! PSI for VAL 10
assign (resid  10   and name N   )  (resid  10  and name CA  )
       (resid  10   and name C   )  (resid  11  and name N   )  1.0 149.48 40 2

! PHI for LYS 11
assign (resid  10   and name C   )  (resid  11  and name N   )
       (resid  11   and name CA  )  (resid  11  and name C   )  1.0 -95.18 30 2

! PSI for LYS 11
assign (resid  11   and name N   )  (resid  11  and name CA  )
       (resid  11   and name C   )  (resid  12  and name N   )  1.0 120.87 40 2

! PHI for ALA 12
assign (resid  11   and name C   )  (resid  12  and name N   )
       (resid  12   and name CA  )  (resid  12  and name C   )  1.0 -89.1 30 2

! PSI for ALA 12
assign (resid  12   and name N   )  (resid  12  and name CA  )
       (resid  12   and name C   )  (resid  13  and name N   )  1.0 135.7 40 2

! PHI for LYS 13
assign (resid  12   and name C   )  (resid  13  and name N   )
       (resid  13   and name CA  )  (resid  13  and name C   )  1.0 -61.7 30 2

! PSI for LYS 13
assign (resid  13   and name N   )  (resid  13  and name CA  )
       (resid  13   and name C   )  (resid  14  and name N   )  1.0 -27.06 40 2

! PHI for MET 18
assign (resid  17   and name C   )  (resid  18  and name N   )
       (resid  18   and name CA  )  (resid  18  and name C   )  1.0 -109.79 30 2

! PSI for MET 18
assign (resid  18   and name N   )  (resid  18  and name CA  )
       (resid  18   and name C   )  (resid  19  and name N   )  1.0 130.6 40 2

! PHI for HIS 19
assign (resid  18   and name C   )  (resid  19  and name N   )
       (resid  19   and name CA  )  (resid  19  and name C   )  1.0 -111.99 30 2

! PSI for HIS 19
assign (resid  19   and name N   )  (resid  19  and name CA  )
       (resid  19   and name C   )  (resid  20  and name N   )  1.0 132.47 40 2

! PHI for PHE 20
assign (resid  19   and name C   )  (resid  20  and name N   )
       (resid  20   and name CA  )  (resid  20  and name C   )  1.0 -141.8 30 2

! PSI for PHE 20
assign (resid  20   and name N   )  (resid  20  and name CA  )
       (resid  20   and name C   )  (resid  21  and name N   )  1.0 161.81 40 2

! PHI for ASP 21
assign (resid  20   and name C   )  (resid  21  and name N   )
       (resid  21   and name CA  )  (resid  21  and name C   )  1.0 -126.15 30 2

! PSI for ASP 21
assign (resid  21   and name N   )  (resid  21  and name CA  )
       (resid  21   and name C   )  (resid  22  and name N   )  1.0 147.74 40 2

! PHI for VAL 22
assign (resid  21   and name C   )  (resid  22  and name N   )
       (resid  22   and name CA  )  (resid  22  and name C   )  1.0 -108.72 30 2

! PSI for VAL 22
assign (resid  22   and name N   )  (resid  22  and name CA  )
       (resid  22   and name C   )  (resid  23  and name N   )  1.0 120.68 40 2

! PHI for PHE 23
assign (resid  22   and name C   )  (resid  23  and name N   )
       (resid  23   and name CA  )  (resid  23  and name C   )  1.0 -113.99 30 2

! PSI for PHE 23
assign (resid  23   and name N   )  (resid  23  and name CA  )
       (resid  23   and name C   )  (resid  24  and name N   )  1.0 133.25 40 2

! PHI for THR 24
assign (resid  23   and name C   )  (resid  24  and name N   )
       (resid  24   and name CA  )  (resid  24  and name C   )  1.0 -121.33 30 2

! PSI for THR 24
assign (resid  24   and name N   )  (resid  24  and name CA  )
       (resid  24   and name C   )  (resid  25  and name N   )  1.0 156.1 40 2

! PHI for ASP 28
!assign (resid  27   and name C   )  (resid  28  and name N   )
!       (resid  28   and name CA  )  (resid  28  and name C   )  1.0 -88.37 30 2

! PSI for ASP 28
!assign (resid  28   and name N   )  (resid  28  and name CA  )
!       (resid  28   and name C   )  (resid  29  and name N   )  1.0 126.19 40 2

! PHI for ASP 29
assign (resid  28   and name C   )  (resid  29  and name N   )
       (resid  29   and name CA  )  (resid  29  and name C   )  1.0 -60.4 30 2

! PSI for ASP 29
assign (resid  29   and name N   )  (resid  29  and name CA  )
       (resid  29   and name C   )  (resid  30  and name N   )  1.0 -32.92 40 2

! PHI for LYS 30
assign (resid  29   and name C   )  (resid  30  and name N   )
       (resid  30   and name CA  )  (resid  30  and name C   )  1.0 -63.26 30 2

! PSI for LYS 30
assign (resid  30   and name N   )  (resid  30  and name CA  )
       (resid  30   and name C   )  (resid  31  and name N   )  1.0 -39.64 40 2

! PHI for LYS 31
assign (resid  30   and name C   )  (resid  31  and name N   )
       (resid  31   and name CA  )  (resid  31  and name C   )  1.0 -68.38 30 2

! PSI for LYS 31
assign (resid  31   and name N   )  (resid  31  and name CA  )
       (resid  31   and name C   )  (resid  32  and name N   )  1.0 -40.03 40 2

! PHI for ALA 32
assign (resid  31   and name C   )  (resid  32  and name N   )
       (resid  32   and name CA  )  (resid  32  and name C   )  1.0 -62.75 30 2

! PSI for ALA 32
assign (resid  32   and name N   )  (resid  32  and name CA  )
       (resid  32   and name C   )  (resid  33  and name N   )  1.0 -42.55 40 2

! PHI for ILE 33
assign (resid  32   and name C   )  (resid  33  and name N   )
       (resid  33   and name CA  )  (resid  33  and name C   )  1.0 -63.82 30 2

! PSI for ILE 33
assign (resid  33   and name N   )  (resid  33  and name CA  )
       (resid  33   and name C   )  (resid  34  and name N   )  1.0 -42.48 40 2

! PHI for GLU 34
assign (resid  33   and name C   )  (resid  34  and name N   )
       (resid  34   and name CA  )  (resid  34  and name C   )  1.0 -60.78 30 2

! PSI for GLU 34
assign (resid  34   and name N   )  (resid  34  and name CA  )
       (resid  34   and name C   )  (resid  35  and name N   )  1.0 -42.82 40 2

! PHI for PHE 35
assign (resid  34   and name C   )  (resid  35  and name N   )
       (resid  35   and name CA  )  (resid  35  and name C   )  1.0 -64.24 30 2

! PSI for PHE 35
assign (resid  35   and name N   )  (resid  35  and name CA  )
       (resid  35   and name C   )  (resid  36  and name N   )  1.0 -42.02 40 2

! PHI for ALA 36
assign (resid  35   and name C   )  (resid  36  and name N   )
       (resid  36   and name CA  )  (resid  36  and name C   )  1.0 -59.84 30 2

! PSI for ALA 36
assign (resid  36   and name N   )  (resid  36  and name CA  )
       (resid  36   and name C   )  (resid  37  and name N   )  1.0 -40.56 40 2

! PHI for LYS 37
assign (resid  36   and name C   )  (resid  37  and name N   )
       (resid  37   and name CA  )  (resid  37  and name C   )  1.0 -63.85 30 2

! PSI for LYS 37
assign (resid  37   and name N   )  (resid  37  and name CA  )
       (resid  37   and name C   )  (resid  38  and name N   )  1.0 -41.27 40 2

! PHI for GLN 38
assign (resid  37   and name C   )  (resid  38  and name N   )
       (resid  38   and name CA  )  (resid  38  and name C   )  1.0 -65.72 30 2

! PSI for GLN 38
assign (resid  38   and name N   )  (resid  38  and name CA  )
       (resid  38   and name C   )  (resid  39  and name N   )  1.0 -38.78 40 2

! PHI for TRP 39
assign (resid  38   and name C   )  (resid  39  and name N   )
       (resid  39   and name CA  )  (resid  39  and name C   )  1.0 -65.75 30 2

! PSI for TRP 39
assign (resid  39   and name N   )  (resid  39  and name CA  )
       (resid  39   and name C   )  (resid  40  and name N   )  1.0 -42.92 40 2

! PHI for LEU 40
assign (resid  39   and name C   )  (resid  40  and name N   )
       (resid  40   and name CA  )  (resid  40  and name C   )  1.0 -61.18 30 2

! PSI for LEU 40
assign (resid  40   and name N   )  (resid  40  and name CA  )
       (resid  40   and name C   )  (resid  41  and name N   )  1.0 -40.25 40 2

! PHI for SER 41
assign (resid  40   and name C   )  (resid  41  and name N   )
       (resid  41   and name CA  )  (resid  41  and name C   )  1.0 -61.99 30 2

! PSI for SER 41
assign (resid  41   and name N   )  (resid  41  and name CA  )
       (resid  41   and name C   )  (resid  42  and name N   )  1.0 -38.56 40 2

! PHI for SER 42
assign (resid  41   and name C   )  (resid  42  and name N   )
       (resid  42   and name CA  )  (resid  42  and name C   )  1.0 -65.68 30 2

! PSI for SER 42
assign (resid  42   and name N   )  (resid  42  and name CA  )
       (resid  42   and name C   )  (resid  43  and name N   )  1.0 -30.79 40 2

! PHI for THR 49
assign (resid  48   and name C   )  (resid  49  and name N   )
       (resid  49   and name CA  )  (resid  49  and name C   )  1.0 -85.52 30 2

! PSI for THR 49
assign (resid  49   and name N   )  (resid  49  and name CA  )
       (resid  49   and name C   )  (resid  50  and name N   )  1.0 129.1 40 2

! PHI for VAL 50
assign (resid  49   and name C   )  (resid  50  and name N   )
       (resid  50   and name CA  )  (resid  50  and name C   )  1.0 -99.98 30 2

! PSI for VAL 50
assign (resid  50   and name N   )  (resid  50  and name CA  )
       (resid  50   and name C   )  (resid  51  and name N   )  1.0 131.36 40 2

! PHI for THR 51
assign (resid  50   and name C   )  (resid  51  and name N   )
       (resid  51   and name CA  )  (resid  51  and name C   )  1.0 -115.06 30 2

! PSI for THR 51
assign (resid  51   and name N   )  (resid  51  and name CA  )
       (resid  51   and name C   )  (resid  52  and name N   )  1.0 159.09 40 2

! PHI for GLU 53
assign (resid  52   and name C   )  (resid  53  and name N   )
       (resid  53   and name CA  )  (resid  53  and name C   )  1.0 -67.07 30 2

! PSI for GLU 53
assign (resid  53   and name N   )  (resid  53  and name CA  )
       (resid  53   and name C   )  (resid  54  and name N   )  1.0 -37.23 40 2

! PHI for ARG 56
assign (resid  55   and name C   )  (resid  56  and name N   )
       (resid  56   and name CA  )  (resid  56  and name C   )  1.0 -117.62 30 2

! PSI for ARG 56
assign (resid  56   and name N   )  (resid  56  and name CA  )
       (resid  56   and name C   )  (resid  57  and name N   )  1.0 127.99 40 2

! PHI for SER 60
assign (resid  59   and name C   )  (resid  60  and name N   )
       (resid  60   and name CA  )  (resid  60  and name C   )  1.0 -115.05 30 2

! PSI for SER 60
assign (resid  60   and name N   )  (resid  60  and name CA  )
       (resid  60   and name C   )  (resid  61  and name N   )  1.0 146.13 40 2

! PHI for GLN 61
assign (resid  60   and name C   )  (resid  61  and name N   )
       (resid  61   and name CA  )  (resid  61  and name C   )  1.0 -147.9 30 2

! PSI for GLN 61
assign (resid  61   and name N   )  (resid  61  and name CA  )
       (resid  61   and name C   )  (resid  62  and name N   )  1.0 157.51 40 2

! PHI for LYS 62
assign (resid  61   and name C   )  (resid  62  and name N   )
       (resid  62   and name CA  )  (resid  62  and name C   )  1.0 -80.12 30 2

! PSI for LYS 62
assign (resid  62   and name N   )  (resid  62  and name CA  )
       (resid  62   and name C   )  (resid  63  and name N   )  1.0 131.05 40 2

! PSI for PRO 64
assign (resid  64   and name N   )  (resid  64  and name CA  )
       (resid  64   and name C   )  (resid  65  and name N   )  1.0 141.79 40 2

! PHI for GLU 66
assign (resid  65   and name C   )  (resid  66  and name N   )
       (resid  66   and name CA  )  (resid  66  and name C   )  1.0 -66.49 30 2

! PSI for GLU 66
assign (resid  66   and name N   )  (resid  66  and name CA  )
       (resid  66   and name C   )  (resid  67  and name N   )  1.0 -34.46 40 2

! PHI for VAL 67
assign (resid  66   and name C   )  (resid  67  and name N   )
       (resid  67   and name CA  )  (resid  67  and name C   )  1.0 -83.95 30 2

! PSI for VAL 67
assign (resid  67   and name N   )  (resid  67  and name CA  )
       (resid  67   and name C   )  (resid  68  and name N   )  1.0 -23.79 40 2

! PHI for GLU 69
assign (resid  68   and name C   )  (resid  69  and name N   )
       (resid  69   and name CA  )  (resid  69  and name C   )  1.0 -59.83 30 2

! PSI for GLU 69
assign (resid  69   and name N   )  (resid  69  and name CA  )
       (resid  69   and name C   )  (resid  70  and name N   )  1.0 -42.81 40 2

! PHI for ALA 70
assign (resid  69   and name C   )  (resid  70  and name N   )
       (resid  70   and name CA  )  (resid  70  and name C   )  1.0 -66.61 30 2

! PSI for ALA 70
assign (resid  70   and name N   )  (resid  70  and name CA  )
       (resid  70   and name C   )  (resid  71  and name N   )  1.0 -41.82 40 2

! PHI for ILE 71
assign (resid  70   and name C   )  (resid  71  and name N   )
       (resid  71   and name CA  )  (resid  71  and name C   )  1.0 -64.42 30 2

! PSI for ILE 71
assign (resid  71   and name N   )  (resid  71  and name CA  )
       (resid  71   and name C   )  (resid  72  and name N   )  1.0 -39.69 40 2

! PHI for LYS 72
assign (resid  71   and name C   )  (resid  72  and name N   )
       (resid  72   and name CA  )  (resid  72  and name C   )  1.0 -61.24 30 2

! PSI for LYS 72
assign (resid  72   and name N   )  (resid  72  and name CA  )
       (resid  72   and name C   )  (resid  73  and name N   )  1.0 -41.81 40 2

! PHI for GLN 73
assign (resid  72   and name C   )  (resid  73  and name N   )
       (resid  73   and name CA  )  (resid  73  and name C   )  1.0 -79.55 30 2

! PSI for GLN 73
assign (resid  73   and name N   )  (resid  73  and name CA  )
       (resid  73   and name C   )  (resid  74  and name N   )  1.0 -32.63 40 2

! PHI for ASN 74
assign (resid  73   and name C   )  (resid  74  and name N   )
       (resid  74   and name CA  )  (resid  74  and name C   )  1.0 -111.24 30 2

! PSI for ASN 74
assign (resid  74   and name N   )  (resid  74  and name CA  )
       (resid  74   and name C   )  (resid  75  and name N   )  1.0 -15.89 40 2

! PHI for PHE 77
assign (resid  76   and name C   )  (resid  77  and name N   )
       (resid  77   and name CA  )  (resid  77  and name C   )  1.0 -131.17 30 2

! PSI for PHE 77
assign (resid  77   and name N   )  (resid  77  and name CA  )
       (resid  77   and name C   )  (resid  78  and name N   )  1.0 132.38 40 2

! PHI for ILE 78
assign (resid  77   and name C   )  (resid  78  and name N   )
       (resid  78   and name CA  )  (resid  78  and name C   )  1.0 -108.21 30 2

! PSI for ILE 78
assign (resid  78   and name N   )  (resid  78  and name CA  )
       (resid  78   and name C   )  (resid  79  and name N   )  1.0 114.18 40 2

! PHI for TYR 79
assign (resid  78   and name C   )  (resid  79  and name N   )
       (resid  79   and name CA  )  (resid  79  and name C   )  1.0 -105.69 30 2

! PSI for TYR 79
assign (resid  79   and name N   )  (resid  79  and name CA  )
       (resid  79   and name C   )  (resid  80  and name N   )  1.0 118.08 40 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1  14.760   0.546  -9.966
    2    HA   MET   1           HA       MET   1  12.452   0.268 -10.423
    3   1HB   MET   1          1HB       MET   1  12.457  -2.205 -10.165
    4   2HB   MET   1          2HB       MET   1  12.590  -2.003  -8.425
    5   1HG   MET   1          1HG       MET   1  10.423  -0.929  -8.357
    6   2HG   MET   1          2HG       MET   1  10.296  -1.034 -10.114
    7   1HE   MET   1          1HE       MET   1   7.637  -3.636  -8.902
    8   2HE   MET   1          2HE       MET   1   7.932  -2.201  -9.885
    9   3HE   MET   1          3HE       MET   1   8.045  -2.105  -8.128
   10    H    GLN   2           H        GLN   2  11.238   1.747  -9.353
   11    HA   GLN   2           HA       GLN   2  12.247   2.542  -6.710
   12   1HB   GLN   2          1HB       GLN   2  11.167   4.717  -7.144
   13   2HB   GLN   2          2HB       GLN   2  12.350   4.307  -8.375
   14   1HG   GLN   2          1HG       GLN   2  10.601   3.685  -9.911
   15   2HG   GLN   2          2HG       GLN   2   9.377   3.940  -8.670
   16   1HE2  GLN   2          2HE2      GLN   2  12.147   6.022  -9.136
   17   2HE2  GLN   2          1HE2      GLN   2  11.259   7.395  -9.699
   18    H    ILE   3           H        ILE   3  11.113   1.896  -5.020
   19    HA   ILE   3           HA       ILE   3   8.376   1.035  -5.343
   20    HB   ILE   3           HB       ILE   3   8.500   0.628  -2.845
   21   1HG1  ILE   3          1HG1      ILE   3  11.441   1.183  -3.312
   22   2HG1  ILE   3          2HG1      ILE   3  10.352   2.207  -2.383
   23   1HG2  ILE   3          1HG2      ILE   3  10.462  -0.764  -4.657
   24   2HG2  ILE   3          2HG2      ILE   3   9.871  -1.395  -3.119
   25   3HG2  ILE   3          3HG2      ILE   3   8.752  -1.148  -4.460
   26   1HD1  ILE   3          1HD1      ILE   3  11.727   0.820  -0.937
   27   2HD1  ILE   3          2HD1      ILE   3  10.018   0.407  -0.777
   28   3HD1  ILE   3          3HD1      ILE   3  11.093  -0.631  -1.714
   29    H    HIS   4           H        HIS   4   6.666   2.252  -5.101
   30    HA   HIS   4           HA       HIS   4   6.940   4.920  -3.965
   31   1HB   HIS   4          1HB       HIS   4   4.526   3.595  -5.232
   32   2HB   HIS   4          2HB       HIS   4   4.658   5.292  -4.787
   33    HD1  HIS   4           HD1      HIS   4   4.010   4.434  -7.670
   34    HD2  HIS   4           HD2      HIS   4   7.842   5.261  -6.282
   35    HE1  HIS   4           HE1      HIS   4   5.355   5.052  -9.709
   36    HE2  HIS   4           HE2      HIS   4   7.651   5.615  -8.839
   37    H    VAL   5           H        VAL   5   6.756   5.090  -1.848
   38    HA   VAL   5           HA       VAL   5   5.395   3.041  -0.318
   39    HB   VAL   5           HB       VAL   5   6.815   5.521   0.670
   40   1HG1  VAL   5          1HG1      VAL   5   6.014   2.992   2.103
   41   2HG1  VAL   5          2HG1      VAL   5   6.960   4.309   2.795
   42   3HG1  VAL   5          3HG1      VAL   5   5.288   4.587   2.310
   43   1HG2  VAL   5          1HG2      VAL   5   8.331   4.120  -0.620
   44   2HG2  VAL   5          2HG2      VAL   5   8.727   4.049   1.098
   45   3HG2  VAL   5          3HG2      VAL   5   7.864   2.713   0.336
   46    H    TYR   6           H        TYR   6   3.231   3.219  -0.350
   47    HA   TYR   6           HA       TYR   6   2.042   5.855   0.120
   48   1HB   TYR   6          1HB       TYR   6   0.932   3.282  -0.967
   49   2HB   TYR   6          2HB       TYR   6  -0.131   4.563  -0.391
   50    HD1  TYR   6           HD1      TYR   6   2.165   3.522  -3.031
   51    HD2  TYR   6           HD2      TYR   6  -0.234   6.712  -1.558
   52    HE1  TYR   6           HE1      TYR   6   2.338   4.651  -5.209
   53    HE2  TYR   6           HE2      TYR   6  -0.068   7.848  -3.731
   54    HH   TYR   6           HH       TYR   6   1.418   7.888  -5.676
   55    H    ASP   7           H        ASP   7   2.160   6.227   2.219
   56    HA   ASP   7           HA       ASP   7   1.720   4.351   4.298
   57   1HB   ASP   7          1HB       ASP   7   2.997   6.518   4.463
   58   2HB   ASP   7          2HB       ASP   7   1.459   7.367   4.394
   59    H    THR   8           H        THR   8  -0.214   3.417   4.702
   60    HA   THR   8           HA       THR   8  -2.625   4.909   3.914
   61    HB   THR   8           HB       THR   8  -2.370   1.917   4.238
   62    HG1  THR   8           HG1      THR   8  -1.044   2.979   2.515
   63   1HG2  THR   8          1HG2      THR   8  -4.657   2.767   4.383
   64   2HG2  THR   8          2HG2      THR   8  -4.438   3.649   2.872
   65   3HG2  THR   8          3HG2      THR   8  -4.420   1.885   2.875
   66    H    TYR   9           H        TYR   9  -4.038   5.491   5.409
   67    HA   TYR   9           HA       TYR   9  -3.842   4.347   8.102
   68   1HB   TYR   9          1HB       TYR   9  -5.289   6.799   7.083
   69   2HB   TYR   9          2HB       TYR   9  -5.338   6.239   8.747
   70    HD1  TYR   9           HD1      TYR   9  -3.364   7.951   6.209
   71    HD2  TYR   9           HD2      TYR   9  -3.355   6.407  10.173
   72    HE1  TYR   9           HE1      TYR   9  -1.360   9.283   6.719
   73    HE2  TYR   9           HE2      TYR   9  -1.353   7.733  10.690
   74    HH   TYR   9           HH       TYR   9  -0.268  10.247   8.787
   75    H    VAL  10           H        VAL  10  -5.087   2.604   8.372
   76    HA   VAL  10           HA       VAL  10  -7.872   2.770   7.419
   77    HB   VAL  10           HB       VAL  10  -6.109   0.339   7.758
   78   1HG1  VAL  10          1HG1      VAL  10  -9.067   0.413   7.174
   79   2HG1  VAL  10          2HG1      VAL  10  -8.043  -1.023   7.141
   80   3HG1  VAL  10          3HG1      VAL  10  -8.319  -0.172   8.662
   81   1HG2  VAL  10          1HG2      VAL  10  -6.659  -0.027   5.388
   82   2HG2  VAL  10          2HG2      VAL  10  -7.570   1.483   5.384
   83   3HG2  VAL  10          3HG2      VAL  10  -5.826   1.505   5.657
   84    H    LYS  11           H        LYS  11  -9.139   3.290   9.068
   85    HA   LYS  11           HA       LYS  11  -8.225   2.848  11.787
   86   1HB   LYS  11          1HB       LYS  11 -10.695   4.214  10.700
   87   2HB   LYS  11          2HB       LYS  11 -10.229   4.179  12.395
   88   1HG   LYS  11          1HG       LYS  11  -8.252   5.460  11.937
   89   2HG   LYS  11          2HG       LYS  11  -8.551   5.375  10.198
   90   1HD   LYS  11          1HD       LYS  11 -10.589   6.664  10.461
   91   2HD   LYS  11          2HD       LYS  11 -10.375   6.688  12.211
   92   1HE   LYS  11          1HE       LYS  11  -8.423   7.863  10.241
   93   2HE   LYS  11          2HE       LYS  11  -9.683   8.787  11.056
   94   1HZ   LYS  11          1HZ       LYS  11  -8.667   8.072  13.191
   95   2HZ   LYS  11          2HZ       LYS  11  -7.385   7.390  12.317
   96   3HZ   LYS  11          3HZ       LYS  11  -7.663   9.061  12.250
   97    H    ALA  12           H        ALA  12  -8.471   0.777  12.430
   98    HA   ALA  12           HA       ALA  12 -11.002  -0.590  12.155
   99   1HB   ALA  12          1HB       ALA  12  -9.982  -2.335  13.526
  100   2HB   ALA  12          2HB       ALA  12  -8.903  -1.874  12.208
  101   3HB   ALA  12          3HB       ALA  12  -8.596  -1.291  13.845
  102    H    LYS  13           H        LYS  13 -12.311  -1.178  14.052
  103    HA   LYS  13           HA       LYS  13 -12.848   1.189  15.532
  104   1HB   LYS  13          1HB       LYS  13 -14.631  -0.341  14.818
  105   2HB   LYS  13          2HB       LYS  13 -13.996  -1.582  15.892
  106   1HG   LYS  13          1HG       LYS  13 -14.433  -0.105  17.814
  107   2HG   LYS  13          2HG       LYS  13 -15.140   1.078  16.713
  108   1HD   LYS  13          1HD       LYS  13 -16.850  -0.528  16.065
  109   2HD   LYS  13          2HD       LYS  13 -16.126  -1.744  17.120
  110   1HE   LYS  13          1HE       LYS  13 -17.323   0.887  17.986
  111   2HE   LYS  13          2HE       LYS  13 -18.053  -0.705  18.189
  112   1HZ   LYS  13          1HZ       LYS  13 -16.163  -1.324  19.597
  113   2HZ   LYS  13          2HZ       LYS  13 -15.530   0.245  19.446
  114   3HZ   LYS  13          3HZ       LYS  13 -17.016   0.000  20.229
  115    H    ASP  14           H        ASP  14 -12.131  -2.090  16.791
  116    HA   ASP  14           HA       ASP  14 -10.963  -0.741  19.144
  117   1HB   ASP  14          1HB       ASP  14 -11.787  -2.521  20.558
  118   2HB   ASP  14          2HB       ASP  14 -13.128  -1.851  19.638
  119    H    GLY  15           H        GLY  15 -10.382  -2.858  16.581
  120   1HA   GLY  15          1HA       GLY  15  -8.457  -4.577  17.751
  121   2HA   GLY  15          2HA       GLY  15  -8.576  -4.181  16.041
  122    H    HIS  16           H        HIS  16  -7.627  -2.162  15.333
  123    HA   HIS  16           HA       HIS  16  -6.104  -0.458  16.917
  124   1HB   HIS  16          1HB       HIS  16  -3.795  -1.100  16.091
  125   2HB   HIS  16          2HB       HIS  16  -4.485  -2.168  17.302
  126    HD1  HIS  16           HD1      HIS  16  -3.835  -4.484  16.812
  127    HD2  HIS  16           HD2      HIS  16  -4.570  -2.343  13.323
  128    HE1  HIS  16           HE1      HIS  16  -3.524  -6.123  14.930
  129    HE2  HIS  16           HE2      HIS  16  -4.180  -4.860  12.850
  130    H    VAL  17           H        VAL  17  -5.452   1.329  15.731
  131    HA   VAL  17           HA       VAL  17  -6.369   1.749  13.141
  132    HB   VAL  17           HB       VAL  17  -3.990   3.095  14.444
  133   1HG1  VAL  17          1HG1      VAL  17  -4.104   3.495  12.043
  134   2HG1  VAL  17          2HG1      VAL  17  -5.784   4.007  12.194
  135   3HG1  VAL  17          3HG1      VAL  17  -4.501   4.960  12.939
  136   1HG2  VAL  17          1HG2      VAL  17  -5.582   4.815  15.153
  137   2HG2  VAL  17          2HG2      VAL  17  -6.909   3.859  14.493
  138   3HG2  VAL  17          3HG2      VAL  17  -5.972   3.245  15.855
  139    H    MET  18           H        MET  18  -5.795   0.755  11.370
  140    HA   MET  18           HA       MET  18  -3.365  -0.777  11.232
  141   1HB   MET  18          1HB       MET  18  -5.683  -0.347   9.358
  142   2HB   MET  18          2HB       MET  18  -4.267  -1.276   8.887
  143   1HG   MET  18          1HG       MET  18  -5.939  -1.905  11.302
  144   2HG   MET  18          2HG       MET  18  -6.217  -2.610   9.707
  145   1HE   MET  18          1HE       MET  18  -3.340  -2.961   8.557
  146   2HE   MET  18          2HE       MET  18  -4.582  -4.212   8.484
  147   3HE   MET  18          3HE       MET  18  -2.963  -4.608   9.063
  148    H    HIS  19           H        HIS  19  -1.747   0.718  11.272
  149    HA   HIS  19           HA       HIS  19  -1.616   2.645   9.074
  150   1HB   HIS  19          1HB       HIS  19  -1.160   3.344  11.477
  151   2HB   HIS  19          2HB       HIS  19   0.297   2.362  11.400
  152    HD1  HIS  19           HD1      HIS  19   2.106   4.090  11.398
  153    HD2  HIS  19           HD2      HIS  19  -0.913   4.933   8.665
  154    HE1  HIS  19           HE1      HIS  19   2.888   6.105  10.117
  155    HE2  HIS  19           HE2      HIS  19   1.168   6.417   8.301
  156    H    PHE  20           H        PHE  20  -1.051   1.446   7.338
  157    HA   PHE  20           HA       PHE  20   1.524   0.048   7.496
  158   1HB   PHE  20          1HB       PHE  20   0.629  -1.720   6.006
  159   2HB   PHE  20          2HB       PHE  20  -0.185  -1.678   7.565
  160    HD1  PHE  20           HD1      PHE  20  -0.523  -1.004   3.975
  161    HD2  PHE  20           HD2      PHE  20  -2.507  -1.105   7.737
  162    HE1  PHE  20           HE1      PHE  20  -2.695  -0.885   2.827
  163    HE2  PHE  20           HE2      PHE  20  -4.682  -0.982   6.596
  164    HZ   PHE  20           HZ       PHE  20  -4.778  -0.873   4.138
  165    H    ASP  21           H        ASP  21   2.727   0.032   5.546
  166    HA   ASP  21           HA       ASP  21   1.835   2.105   3.673
  167   1HB   ASP  21          1HB       ASP  21   4.212   2.330   3.042
  168   2HB   ASP  21          2HB       ASP  21   3.940   2.642   4.749
  169    H    VAL  22           H        VAL  22   1.607   1.716   1.579
  170    HA   VAL  22           HA       VAL  22   1.734  -1.081   0.729
  171    HB   VAL  22           HB       VAL  22   0.422   1.273  -0.652
  172   1HG1  VAL  22          1HG1      VAL  22   0.958  -0.491  -2.214
  173   2HG1  VAL  22          2HG1      VAL  22   0.218  -1.693  -1.157
  174   3HG1  VAL  22          3HG1      VAL  22  -0.784  -0.464  -1.931
  175   1HG2  VAL  22          1HG2      VAL  22  -0.806  -0.859   1.092
  176   2HG2  VAL  22          2HG2      VAL  22  -0.638   0.849   1.491
  177   3HG2  VAL  22          3HG2      VAL  22  -1.697   0.352   0.172
  178    H    PHE  23           H        PHE  23   3.552  -1.669  -0.263
  179    HA   PHE  23           HA       PHE  23   5.135   0.239  -1.767
  180   1HB   PHE  23          1HB       PHE  23   5.463  -2.742  -1.330
  181   2HB   PHE  23          2HB       PHE  23   6.584  -1.750  -2.250
  182    HD1  PHE  23           HD1      PHE  23   5.855  -3.116   0.901
  183    HD2  PHE  23           HD2      PHE  23   7.589   0.293  -0.965
  184    HE1  PHE  23           HE1      PHE  23   7.128  -2.644   2.953
  185    HE2  PHE  23           HE2      PHE  23   8.863   0.772   1.084
  186    HZ   PHE  23           HZ       PHE  23   8.636  -0.699   3.046
  187    H    THR  24           H        THR  24   4.427   0.790  -3.742
  188    HA   THR  24           HA       THR  24   3.769  -1.414  -5.550
  189    HB   THR  24           HB       THR  24   1.606  -0.541  -4.781
  190    HG1  THR  24           HG1      THR  24   1.343  -1.225  -6.809
  191   1HG2  THR  24          1HG2      THR  24   2.261   1.755  -4.267
  192   2HG2  THR  24          2HG2      THR  24   2.526   2.074  -5.981
  193   3HG2  THR  24          3HG2      THR  24   0.900   1.730  -5.389
  194    H    ASP  25           H        ASP  25   3.847  -0.814  -7.798
  195    HA   ASP  25           HA       ASP  25   5.998   1.079  -8.334
  196   1HB   ASP  25          1HB       ASP  25   6.273  -1.136  -9.256
  197   2HB   ASP  25          2HB       ASP  25   4.677  -1.084  -9.990
  198    H    VAL  26           H        VAL  26   2.625   0.846  -8.473
  199    HA   VAL  26           HA       VAL  26   2.158   2.576 -10.714
  200    HB   VAL  26           HB       VAL  26   0.260   1.887  -8.461
  201   1HG1  VAL  26          1HG1      VAL  26  -1.491   2.361 -10.108
  202   2HG1  VAL  26          2HG1      VAL  26  -0.474   3.771  -9.814
  203   3HG1  VAL  26          3HG1      VAL  26  -0.256   2.819 -11.282
  204   1HG2  VAL  26          1HG2      VAL  26  -0.570   0.097  -9.916
  205   2HG2  VAL  26          2HG2      VAL  26   0.712   0.452 -11.075
  206   3HG2  VAL  26          3HG2      VAL  26   1.117  -0.153  -9.468
  207    H    ARG  27           H        ARG  27   1.650   4.769 -10.696
  208    HA   ARG  27           HA       ARG  27   2.434   6.168  -8.233
  209   1HB   ARG  27          1HB       ARG  27   2.916   8.097  -9.644
  210   2HB   ARG  27          2HB       ARG  27   3.764   6.678 -10.241
  211   1HG   ARG  27          1HG       ARG  27   2.132   6.400 -12.004
  212   2HG   ARG  27          2HG       ARG  27   1.186   7.749 -11.372
  213   1HD   ARG  27          1HD       ARG  27   3.031   9.272 -11.823
  214   2HD   ARG  27          2HD       ARG  27   4.015   7.929 -12.404
  215    HE   ARG  27           HE       ARG  27   1.898   7.761 -14.024
  216   1HH1  ARG  27          1HH1      ARG  27   3.806  10.536 -13.057
  217   2HH1  ARG  27          2HH1      ARG  27   3.548  11.395 -14.545
  218   1HH2  ARG  27          1HH2      ARG  27   1.558   8.875 -15.972
  219   2HH2  ARG  27          2HH2      ARG  27   2.266  10.444 -16.216
  220    H    ASP  28           H        ASP  28  -0.243   5.054  -8.851
  221    HA   ASP  28           HA       ASP  28  -1.811   7.529  -9.021
  222   1HB   ASP  28          1HB       ASP  28  -2.357   5.798 -10.703
  223   2HB   ASP  28          2HB       ASP  28  -2.768   4.689  -9.404
  224    H    ASP  29           H        ASP  29  -2.670   8.308  -7.277
  225    HA   ASP  29           HA       ASP  29  -2.516   7.078  -4.746
  226   1HB   ASP  29          1HB       ASP  29  -4.195   9.021  -4.186
  227   2HB   ASP  29          2HB       ASP  29  -2.522   9.384  -4.606
  228    H    LYS  30           H        LYS  30  -5.125   7.370  -7.094
  229    HA   LYS  30           HA       LYS  30  -7.182   6.299  -5.499
  230   1HB   LYS  30          1HB       LYS  30  -7.703   7.427  -7.565
  231   2HB   LYS  30          2HB       LYS  30  -6.770   6.260  -8.491
  232   1HG   LYS  30          1HG       LYS  30  -8.372   4.505  -7.838
  233   2HG   LYS  30          2HG       LYS  30  -9.324   5.725  -6.992
  234   1HD   LYS  30          1HD       LYS  30 -10.337   5.395  -9.119
  235   2HD   LYS  30          2HD       LYS  30  -9.518   6.954  -9.167
  236   1HE   LYS  30          1HE       LYS  30  -8.302   4.407 -10.225
  237   2HE   LYS  30          2HE       LYS  30  -9.253   5.508 -11.216
  238   1HZ   LYS  30          1HZ       LYS  30  -6.585   5.918 -10.023
  239   2HZ   LYS  30          2HZ       LYS  30  -7.106   6.193 -11.613
  240   3HZ   LYS  30          3HZ       LYS  30  -7.567   7.258 -10.376
  241    H    LYS  31           H        LYS  31  -4.890   4.771  -7.732
  242    HA   LYS  31           HA       LYS  31  -5.713   2.124  -7.373
  243   1HB   LYS  31          1HB       LYS  31  -3.157   3.418  -8.219
  244   2HB   LYS  31          2HB       LYS  31  -3.168   1.692  -7.904
  245   1HG   LYS  31          1HG       LYS  31  -4.972   3.111  -9.854
  246   2HG   LYS  31          2HG       LYS  31  -3.513   2.208 -10.273
  247   1HD   LYS  31          1HD       LYS  31  -4.486   0.170  -9.387
  248   2HD   LYS  31          2HD       LYS  31  -5.919   1.055  -8.863
  249   1HE   LYS  31          1HE       LYS  31  -6.441   1.591 -11.186
  250   2HE   LYS  31          2HE       LYS  31  -4.998   0.728 -11.716
  251   1HZ   LYS  31          1HZ       LYS  31  -5.901  -1.320 -10.990
  252   2HZ   LYS  31          2HZ       LYS  31  -7.185  -0.557 -10.174
  253   3HZ   LYS  31          3HZ       LYS  31  -7.127  -0.544 -11.871
  254    H    ALA  32           H        ALA  32  -3.462   4.104  -5.498
  255    HA   ALA  32           HA       ALA  32  -2.546   2.138  -3.737
  256   1HB   ALA  32          1HB       ALA  32  -3.088   5.044  -3.135
  257   2HB   ALA  32          2HB       ALA  32  -2.070   3.960  -2.187
  258   3HB   ALA  32          3HB       ALA  32  -1.603   4.394  -3.831
  259    H    ILE  33           H        ILE  33  -5.395   4.246  -3.525
  260    HA   ILE  33           HA       ILE  33  -6.454   3.204  -1.138
  261    HB   ILE  33           HB       ILE  33  -7.882   4.424  -3.510
  262   1HG1  ILE  33          1HG1      ILE  33  -7.030   5.596  -0.854
  263   2HG1  ILE  33          2HG1      ILE  33  -6.299   5.939  -2.418
  264   1HG2  ILE  33          1HG2      ILE  33  -8.930   3.860  -0.741
  265   2HG2  ILE  33          2HG2      ILE  33  -9.773   4.779  -1.986
  266   3HG2  ILE  33          3HG2      ILE  33  -9.432   3.066  -2.234
  267   1HD1  ILE  33          1HD1      ILE  33  -8.351   6.988  -3.170
  268   2HD1  ILE  33          2HD1      ILE  33  -9.133   6.594  -1.639
  269   3HD1  ILE  33          3HD1      ILE  33  -7.785   7.729  -1.671
  270    H    GLU  34           H        GLU  34  -7.046   2.358  -4.523
  271    HA   GLU  34           HA       GLU  34  -9.029   0.441  -4.092
  272   1HB   GLU  34          1HB       GLU  34  -8.562   1.473  -6.269
  273   2HB   GLU  34          2HB       GLU  34  -7.029   0.619  -6.351
  274   1HG   GLU  34          1HG       GLU  34  -8.081  -1.462  -6.619
  275   2HG   GLU  34          2HG       GLU  34  -9.649  -0.821  -6.129
  276    H    PHE  35           H        PHE  35  -5.501   0.007  -4.450
  277    HA   PHE  35           HA       PHE  35  -5.548  -2.809  -4.287
  278   1HB   PHE  35          1HB       PHE  35  -3.345  -0.850  -3.617
  279   2HB   PHE  35          2HB       PHE  35  -3.125  -2.595  -3.667
  280    HD1  PHE  35           HD1      PHE  35  -1.757  -0.347  -5.314
  281    HD2  PHE  35           HD2      PHE  35  -4.985  -3.007  -6.102
  282    HE1  PHE  35           HE1      PHE  35  -1.278  -0.210  -7.723
  283    HE2  PHE  35           HE2      PHE  35  -4.512  -2.875  -8.512
  284    HZ   PHE  35           HZ       PHE  35  -2.655  -1.475  -9.324
  285    H    ALA  36           H        ALA  36  -5.275  -0.299  -1.829
  286    HA   ALA  36           HA       ALA  36  -4.756  -2.004   0.357
  287   1HB   ALA  36          1HB       ALA  36  -6.132   0.683   0.353
  288   2HB   ALA  36          2HB       ALA  36  -5.438  -0.127   1.757
  289   3HB   ALA  36          3HB       ALA  36  -4.392   0.417   0.447
  290    H    LYS  37           H        LYS  37  -7.773  -0.770  -1.038
  291    HA   LYS  37           HA       LYS  37  -9.467  -1.881   0.940
  292   1HB   LYS  37          1HB       LYS  37 -10.060  -1.052  -1.902
  293   2HB   LYS  37          2HB       LYS  37 -11.287  -1.495  -0.720
  294   1HG   LYS  37          1HG       LYS  37 -10.556   0.353   0.714
  295   2HG   LYS  37          2HG       LYS  37  -9.357   0.807  -0.497
  296   1HD   LYS  37          1HD       LYS  37 -11.269   2.229  -0.751
  297   2HD   LYS  37          2HD       LYS  37 -11.213   1.122  -2.123
  298   1HE   LYS  37          1HE       LYS  37 -12.906  -0.280  -1.083
  299   2HE   LYS  37          2HE       LYS  37 -12.931   0.772   0.332
  300   1HZ   LYS  37          1HZ       LYS  37 -13.703   2.582  -1.086
  301   2HZ   LYS  37          2HZ       LYS  37 -13.704   1.547  -2.430
  302   3HZ   LYS  37          3HZ       LYS  37 -14.770   1.263  -1.141
  303    H    GLN  38           H        GLN  38  -8.414  -3.070  -2.241
  304    HA   GLN  38           HA       GLN  38  -9.898  -5.456  -2.246
  305   1HB   GLN  38          1HB       GLN  38  -7.154  -4.944  -3.414
  306   2HB   GLN  38          2HB       GLN  38  -8.172  -6.325  -3.795
  307   1HG   GLN  38          1HG       GLN  38  -9.860  -4.798  -4.720
  308   2HG   GLN  38          2HG       GLN  38  -8.787  -3.437  -4.384
  309   1HE2  GLN  38          2HE2      GLN  38  -9.370  -6.208  -6.387
  310   2HE2  GLN  38          1HE2      GLN  38  -8.186  -5.839  -7.590
  311    H    TRP  39           H        TRP  39  -6.778  -4.635  -0.859
  312    HA   TRP  39           HA       TRP  39  -6.095  -7.229   0.041
  313   1HB   TRP  39          1HB       TRP  39  -4.456  -5.412  -0.244
  314   2HB   TRP  39          2HB       TRP  39  -5.210  -4.528   1.077
  315    HD1  TRP  39           HD1      TRP  39  -3.406  -7.916   0.530
  316    HE1  TRP  39           HE1      TRP  39  -2.097  -8.473   2.671
  317    HE3  TRP  39           HE3      TRP  39  -4.877  -3.960   3.403
  318    HZ2  TRP  39           HZ2      TRP  39  -1.736  -7.363   5.245
  319    HZ3  TRP  39           HZ3      TRP  39  -4.002  -3.775   5.695
  320    HH2  TRP  39           HH2      TRP  39  -2.464  -5.443   6.595
  321    H    LEU  40           H        LEU  40  -7.697  -4.479   1.618
  322    HA   LEU  40           HA       LEU  40  -7.992  -5.597   4.164
  323   1HB   LEU  40          1HB       LEU  40  -9.775  -3.660   2.692
  324   2HB   LEU  40          2HB       LEU  40  -9.938  -4.045   4.394
  325    HG   LEU  40           HG       LEU  40  -7.528  -2.747   3.118
  326   1HD1  LEU  40          1HD1      LEU  40  -9.654  -1.587   4.913
  327   2HD1  LEU  40          2HD1      LEU  40  -8.238  -0.742   4.289
  328   3HD1  LEU  40          3HD1      LEU  40  -9.496  -1.289   3.181
  329   1HD2  LEU  40          1HD2      LEU  40  -6.913  -4.116   5.032
  330   2HD2  LEU  40          2HD2      LEU  40  -6.783  -2.402   5.431
  331   3HD2  LEU  40          3HD2      LEU  40  -8.161  -3.340   6.008
  332    H    SER  41           H        SER  41 -10.202  -5.696   1.379
  333    HA   SER  41           HA       SER  41 -12.182  -7.288   2.582
  334   1HB   SER  41          1HB       SER  41 -11.413  -7.107  -0.340
  335   2HB   SER  41          2HB       SER  41 -12.939  -7.729   0.288
  336    HG   SER  41           HG       SER  41 -13.558  -5.736   0.859
  337    H    SER  42           H        SER  42  -9.128  -8.070   1.118
  338    HA   SER  42           HA       SER  42  -9.603 -10.847   0.741
  339   1HB   SER  42          1HB       SER  42  -7.859  -9.565  -0.476
  340   2HB   SER  42          2HB       SER  42  -6.971  -9.372   1.034
  341    HG   SER  42           HG       SER  42  -7.662 -11.971   0.285
  342    H    ILE  43           H        ILE  43  -7.852  -9.002   3.253
  343    HA   ILE  43           HA       ILE  43  -7.302 -11.379   4.767
  344    HB   ILE  43           HB       ILE  43  -6.379  -9.850   6.476
  345   1HG1  ILE  43          1HG1      ILE  43  -7.166  -7.671   4.526
  346   2HG1  ILE  43          2HG1      ILE  43  -7.924  -7.959   6.086
  347   1HG2  ILE  43          1HG2      ILE  43  -4.980 -10.688   4.673
  348   2HG2  ILE  43          2HG2      ILE  43  -5.459  -9.331   3.652
  349   3HG2  ILE  43          3HG2      ILE  43  -4.511  -9.045   5.111
  350   1HD1  ILE  43          1HD1      ILE  43  -6.369  -6.111   6.201
  351   2HD1  ILE  43          2HD1      ILE  43  -5.813  -7.454   7.201
  352   3HD1  ILE  43          3HD1      ILE  43  -5.064  -7.152   5.632
  353    H    GLY  44           H        GLY  44  -9.815  -8.953   4.805
  354   1HA   GLY  44          1HA       GLY  44 -11.947  -9.745   5.731
  355   2HA   GLY  44          2HA       GLY  44 -11.031 -10.426   7.065
  356    H    GLU  45           H        GLU  45  -9.630  -7.533   6.389
  357    HA   GLU  45           HA       GLU  45 -11.121  -6.238   8.552
  358   1HB   GLU  45          1HB       GLU  45  -8.384  -5.619   7.413
  359   2HB   GLU  45          2HB       GLU  45  -9.145  -4.747   8.738
  360   1HG   GLU  45          1HG       GLU  45  -9.236  -6.911   9.992
  361   2HG   GLU  45          2HG       GLU  45  -8.261  -7.621   8.708
  362    H    GLU  46           H        GLU  46 -12.477  -6.277   6.258
  363    HA   GLU  46           HA       GLU  46 -11.965  -4.050   4.532
  364   1HB   GLU  46          1HB       GLU  46 -13.059  -6.123   3.769
  365   2HB   GLU  46          2HB       GLU  46 -14.418  -5.795   4.832
  366   1HG   GLU  46          1HG       GLU  46 -14.780  -3.672   3.542
  367   2HG   GLU  46          2HG       GLU  46 -13.576  -4.256   2.393
  368    H    GLY  47           H        GLY  47 -13.352  -4.310   7.590
  369   1HA   GLY  47          1HA       GLY  47 -15.493  -2.422   7.250
  370   2HA   GLY  47          2HA       GLY  47 -14.932  -3.100   8.765
  371    H    ALA  48           H        ALA  48 -13.756  -0.909   6.243
  372    HA   ALA  48           HA       ALA  48 -13.469   1.232   8.154
  373   1HB   ALA  48          1HB       ALA  48 -11.026   0.157   6.752
  374   2HB   ALA  48          2HB       ALA  48 -11.096   1.616   7.741
  375   3HB   ALA  48          3HB       ALA  48 -11.363   0.036   8.479
  376    H    THR  49           H        THR  49 -13.102   3.266   7.138
  377    HA   THR  49           HA       THR  49 -13.833   3.259   4.295
  378    HB   THR  49           HB       THR  49 -14.034   5.526   6.293
  379    HG1  THR  49           HG1      THR  49 -15.986   3.676   5.320
  380   1HG2  THR  49          1HG2      THR  49 -13.865   6.288   3.974
  381   2HG2  THR  49          2HG2      THR  49 -15.182   5.208   3.515
  382   3HG2  THR  49          3HG2      THR  49 -15.490   6.560   4.604
  383    H    VAL  50           H        VAL  50 -12.292   3.745   2.869
  384    HA   VAL  50           HA       VAL  50  -9.910   5.188   3.825
  385    HB   VAL  50           HB       VAL  50 -10.168   3.426   1.377
  386   1HG1  VAL  50          1HG1      VAL  50  -7.724   3.616   1.262
  387   2HG1  VAL  50          2HG1      VAL  50  -8.510   5.184   1.085
  388   3HG1  VAL  50          3HG1      VAL  50  -7.754   4.745   2.615
  389   1HG2  VAL  50          1HG2      VAL  50  -8.817   2.893   4.021
  390   2HG2  VAL  50          2HG2      VAL  50 -10.294   2.124   3.436
  391   3HG2  VAL  50          3HG2      VAL  50  -8.763   1.844   2.606
  392    H    THR  51           H        THR  51 -10.042   7.272   3.388
  393    HA   THR  51           HA       THR  51 -11.209   8.145   0.832
  394    HB   THR  51           HB       THR  51 -11.420  10.365   1.909
  395    HG1  THR  51           HG1      THR  51 -11.106  10.346   4.276
  396   1HG2  THR  51          1HG2      THR  51 -12.666   8.119   3.497
  397   2HG2  THR  51          2HG2      THR  51 -13.223   9.792   3.471
  398   3HG2  THR  51          3HG2      THR  51 -13.308   8.812   2.007
  399    H    SER  52           H        SER  52 -10.145  10.531   0.396
  400    HA   SER  52           HA       SER  52  -7.472  10.079  -0.392
  401   1HB   SER  52          1HB       SER  52  -8.991  12.679  -0.091
  402   2HB   SER  52          2HB       SER  52  -7.456  12.495  -0.938
  403    HG   SER  52           HG       SER  52  -8.926  12.319  -2.512
  404    H    GLU  53           H        GLU  53  -8.856  11.070   2.568
  405    HA   GLU  53           HA       GLU  53  -6.503  12.373   3.595
  406   1HB   GLU  53          1HB       GLU  53  -9.113  11.502   4.824
  407   2HB   GLU  53          2HB       GLU  53  -7.819  12.234   5.758
  408   1HG   GLU  53          1HG       GLU  53  -9.176  13.505   3.399
  409   2HG   GLU  53          2HG       GLU  53  -9.533  13.851   5.092
  410    H    GLU  54           H        GLU  54  -7.899   9.200   3.566
  411    HA   GLU  54           HA       GLU  54  -6.211   8.181   5.671
  412   1HB   GLU  54          1HB       GLU  54  -7.951   6.667   3.718
  413   2HB   GLU  54          2HB       GLU  54  -7.261   6.039   5.208
  414   1HG   GLU  54          1HG       GLU  54  -9.328   8.216   4.992
  415   2HG   GLU  54          2HG       GLU  54  -9.621   6.546   5.467
  416    H    CYS  55           H        CYS  55  -6.268   8.223   2.162
  417    HA   CYS  55           HA       CYS  55  -3.933   6.517   1.986
  418   1HB   CYS  55          1HB       CYS  55  -4.085   6.878  -0.421
  419   2HB   CYS  55          2HB       CYS  55  -5.665   6.442   0.228
  420    HG   CYS  55           HG       CYS  55  -5.154   9.740   0.091
  421    H    ARG  56           H        ARG  56  -1.878   7.189   1.840
  422    HA   ARG  56           HA       ARG  56  -1.322  10.053   1.547
  423   1HB   ARG  56          1HB       ARG  56  -1.525   9.661   3.928
  424   2HB   ARG  56          2HB       ARG  56  -0.473   8.262   3.829
  425   1HG   ARG  56          1HG       ARG  56   1.385   9.784   3.187
  426   2HG   ARG  56          2HG       ARG  56   0.298  11.147   3.487
  427   1HD   ARG  56          1HD       ARG  56  -0.035  10.358   5.785
  428   2HD   ARG  56          2HD       ARG  56   1.074   9.024   5.483
  429    HE   ARG  56           HE       ARG  56   2.155  11.675   5.057
  430   1HH1  ARG  56          1HH1      ARG  56   1.776   8.939   7.206
  431   2HH1  ARG  56          2HH1      ARG  56   3.026   9.462   8.299
  432   1HH2  ARG  56          1HH2      ARG  56   3.828  12.350   6.479
  433   2HH2  ARG  56          2HH2      ARG  56   4.215  11.388   7.871
  434    H    PHE  57           H        PHE  57   0.658  10.487   0.585
  435    HA   PHE  57           HA       PHE  57   2.223   8.120  -0.212
  436   1HB   PHE  57          1HB       PHE  57   1.273   9.350  -2.113
  437   2HB   PHE  57          2HB       PHE  57   2.033  10.833  -1.546
  438    HD1  PHE  57           HD1      PHE  57   2.946   7.341  -2.496
  439    HD2  PHE  57           HD2      PHE  57   4.035  11.453  -2.486
  440    HE1  PHE  57           HE1      PHE  57   4.948   6.809  -3.821
  441    HE2  PHE  57           HE2      PHE  57   6.040  10.929  -3.812
  442    HZ   PHE  57           HZ       PHE  57   6.497   8.604  -4.482
  443    H    CYS  58           H        CYS  58   4.134   7.887   0.734
  444    HA   CYS  58           HA       CYS  58   5.244  10.064   2.286
  445   1HB   CYS  58          1HB       CYS  58   6.235   7.238   1.854
  446   2HB   CYS  58          2HB       CYS  58   6.936   8.396   2.981
  447    HG   CYS  58           HG       CYS  58   5.551   6.759   4.621
  448    H    HIS  59           H        HIS  59   6.674   7.833  -0.101
  449    HA   HIS  59           HA       HIS  59   7.828   9.791  -1.735
  450   1HB   HIS  59          1HB       HIS  59  10.203   9.618  -1.030
  451   2HB   HIS  59          2HB       HIS  59   9.200  10.389   0.189
  452    HD1  HIS  59           HD1      HIS  59   9.148   9.330   2.490
  453    HD2  HIS  59           HD2      HIS  59  11.004   6.935  -0.365
  454    HE1  HIS  59           HE1      HIS  59  10.153   7.405   3.759
  455    HE2  HIS  59           HE2      HIS  59  11.112   5.880   1.994
  456    H    SER  60           H        SER  60   9.853   8.774  -2.885
  457    HA   SER  60           HA       SER  60   9.399   5.882  -3.223
  458   1HB   SER  60          1HB       SER  60  10.391   7.873  -5.286
  459   2HB   SER  60          2HB       SER  60  10.156   6.145  -5.549
  460    HG   SER  60           HG       SER  60   8.347   8.160  -5.651
  461    H    GLU  61           H        GLU  61  11.134   4.577  -2.893
  462    HA   GLU  61           HA       GLU  61  13.775   5.839  -2.661
  463   1HB   GLU  61          1HB       GLU  61  14.198   4.560  -0.581
  464   2HB   GLU  61          2HB       GLU  61  12.921   5.753  -0.403
  465   1HG   GLU  61          1HG       GLU  61  11.244   3.985  -0.639
  466   2HG   GLU  61          2HG       GLU  61  12.533   2.793  -0.796
  467    H    LYS  62           H        LYS  62  15.440   3.960  -2.167
  468    HA   LYS  62           HA       LYS  62  15.468   2.248  -4.410
  469   1HB   LYS  62          1HB       LYS  62  17.115   2.353  -1.891
  470   2HB   LYS  62          2HB       LYS  62  17.376   1.119  -3.115
  471   1HG   LYS  62          1HG       LYS  62  17.829   2.855  -4.772
  472   2HG   LYS  62          2HG       LYS  62  17.573   4.093  -3.540
  473   1HD   LYS  62          1HD       LYS  62  19.471   3.364  -2.300
  474   2HD   LYS  62          2HD       LYS  62  19.635   1.912  -3.291
  475   1HE   LYS  62          1HE       LYS  62  19.986   4.746  -4.264
  476   2HE   LYS  62          2HE       LYS  62  21.296   3.638  -3.863
  477   1HZ   LYS  62          1HZ       LYS  62  19.315   3.344  -6.052
  478   2HZ   LYS  62          2HZ       LYS  62  20.981   3.598  -6.205
  479   3HZ   LYS  62          3HZ       LYS  62  20.401   2.126  -5.597
  480    H    ALA  63           H        ALA  63  15.330  -0.034  -4.504
  481    HA   ALA  63           HA       ALA  63  13.487  -1.087  -2.459
  482   1HB   ALA  63          1HB       ALA  63  12.366  -0.563  -4.567
  483   2HB   ALA  63          2HB       ALA  63  13.469  -1.646  -5.417
  484   3HB   ALA  63          3HB       ALA  63  12.342  -2.294  -4.226
  485    HA   PRO  64           HA       PRO  64  16.504  -4.403  -2.035
  486   1HB   PRO  64          1HB       PRO  64  14.350  -5.574  -0.393
  487   2HB   PRO  64          2HB       PRO  64  16.013  -5.183   0.053
  488   1HG   PRO  64          1HG       PRO  64  13.945  -3.743   0.964
  489   2HG   PRO  64          2HG       PRO  64  15.503  -2.991   0.570
  490   1HD   PRO  64          1HD       PRO  64  12.965  -3.043  -1.023
  491   2HD   PRO  64          2HD       PRO  64  14.106  -1.706  -0.765
  492    H    ASP  65           H        ASP  65  16.559  -6.626  -2.649
  493    HA   ASP  65           HA       ASP  65  15.269  -7.234  -5.010
  494   1HB   ASP  65          1HB       ASP  65  16.426  -9.194  -3.020
  495   2HB   ASP  65          2HB       ASP  65  16.141  -9.496  -4.725
  496    H    GLU  66           H        GLU  66  14.399  -8.080  -1.728
  497    HA   GLU  66           HA       GLU  66  12.477 -10.023  -2.144
  498   1HB   GLU  66          1HB       GLU  66  13.297  -9.497   0.051
  499   2HB   GLU  66          2HB       GLU  66  12.655  -7.866  -0.045
  500   1HG   GLU  66          1HG       GLU  66  10.391  -8.729  -0.002
  501   2HG   GLU  66          2HG       GLU  66  11.008 -10.383   0.019
  502    H    VAL  67           H        VAL  67  11.911  -6.496  -1.874
  503    HA   VAL  67           HA       VAL  67   9.114  -6.799  -2.346
  504    HB   VAL  67           HB       VAL  67   8.969  -4.383  -2.404
  505   1HG1  VAL  67          1HG1      VAL  67   9.910  -3.875  -0.196
  506   2HG1  VAL  67          2HG1      VAL  67   9.098  -5.441  -0.229
  507   3HG1  VAL  67          3HG1      VAL  67  10.859  -5.359  -0.271
  508   1HG2  VAL  67          1HG2      VAL  67  11.985  -4.392  -2.385
  509   2HG2  VAL  67          2HG2      VAL  67  10.948  -3.873  -3.714
  510   3HG2  VAL  67          3HG2      VAL  67  10.960  -2.968  -2.201
  511    H    ILE  68           H        ILE  68  11.881  -6.347  -4.383
  512    HA   ILE  68           HA       ILE  68  10.688  -5.373  -6.714
  513    HB   ILE  68           HB       ILE  68  12.916  -7.416  -6.511
  514   1HG1  ILE  68          1HG1      ILE  68  13.464  -5.361  -5.308
  515   2HG1  ILE  68          2HG1      ILE  68  14.428  -5.489  -6.777
  516   1HG2  ILE  68          1HG2      ILE  68  12.119  -5.623  -8.801
  517   2HG2  ILE  68          2HG2      ILE  68  13.550  -6.652  -8.757
  518   3HG2  ILE  68          3HG2      ILE  68  11.942  -7.377  -8.733
  519   1HD1  ILE  68          1HD1      ILE  68  12.906  -3.923  -7.889
  520   2HD1  ILE  68          2HD1      ILE  68  11.991  -3.771  -6.387
  521   3HD1  ILE  68          3HD1      ILE  68  13.667  -3.227  -6.459
  522    H    GLU  69           H        GLU  69  11.152  -8.706  -5.613
  523    HA   GLU  69           HA       GLU  69   9.850  -9.944  -7.786
  524   1HB   GLU  69          1HB       GLU  69  10.192 -10.958  -4.957
  525   2HB   GLU  69          2HB       GLU  69   9.807 -11.938  -6.364
  526   1HG   GLU  69          1HG       GLU  69  12.352 -10.389  -5.942
  527   2HG   GLU  69          2HG       GLU  69  12.153 -12.129  -5.738
  528    H    ALA  70           H        ALA  70   8.739  -8.983  -4.567
  529    HA   ALA  70           HA       ALA  70   6.197 -10.114  -4.635
  530   1HB   ALA  70          1HB       ALA  70   7.248  -9.213  -2.614
  531   2HB   ALA  70          2HB       ALA  70   7.028  -7.577  -3.236
  532   3HB   ALA  70          3HB       ALA  70   5.623  -8.571  -2.854
  533    H    ILE  71           H        ILE  71   7.133  -6.770  -5.491
  534    HA   ILE  71           HA       ILE  71   4.476  -6.035  -6.223
  535    HB   ILE  71           HB       ILE  71   7.060  -4.653  -6.964
  536   1HG1  ILE  71          1HG1      ILE  71   5.226  -4.175  -4.603
  537   2HG1  ILE  71          2HG1      ILE  71   6.787  -4.986  -4.518
  538   1HG2  ILE  71          1HG2      ILE  71   4.224  -3.628  -6.836
  539   2HG2  ILE  71          2HG2      ILE  71   5.654  -2.653  -7.175
  540   3HG2  ILE  71          3HG2      ILE  71   5.160  -3.915  -8.303
  541   1HD1  ILE  71          1HD1      ILE  71   7.884  -2.937  -5.264
  542   2HD1  ILE  71          2HD1      ILE  71   6.318  -2.129  -5.332
  543   3HD1  ILE  71          3HD1      ILE  71   6.955  -2.686  -3.785
  544    H    LYS  72           H        LYS  72   7.223  -7.319  -7.963
  545    HA   LYS  72           HA       LYS  72   6.270  -6.805 -10.581
  546   1HB   LYS  72          1HB       LYS  72   8.572  -7.267 -10.327
  547   2HB   LYS  72          2HB       LYS  72   8.263  -8.742  -9.429
  548   1HG   LYS  72          1HG       LYS  72   7.460  -9.831 -11.439
  549   2HG   LYS  72          2HG       LYS  72   7.680  -8.337 -12.354
  550   1HD   LYS  72          1HD       LYS  72   9.527 -10.007 -12.628
  551   2HD   LYS  72          2HD       LYS  72  10.051  -8.421 -12.059
  552   1HE   LYS  72          1HE       LYS  72  10.100  -9.271  -9.760
  553   2HE   LYS  72          2HE       LYS  72   9.588 -10.855 -10.338
  554   1HZ   LYS  72          1HZ       LYS  72  12.061  -9.542 -11.305
  555   2HZ   LYS  72          2HZ       LYS  72  12.038 -10.541  -9.931
  556   3HZ   LYS  72          3HZ       LYS  72  11.610 -11.174 -11.446
  557    H    GLN  73           H        GLN  73   5.725  -9.395  -8.289
  558    HA   GLN  73           HA       GLN  73   4.393 -11.032 -10.289
  559   1HB   GLN  73          1HB       GLN  73   5.021 -11.506  -7.375
  560   2HB   GLN  73          2HB       GLN  73   4.187 -12.666  -8.402
  561   1HG   GLN  73          1HG       GLN  73   6.089 -12.974  -9.768
  562   2HG   GLN  73          2HG       GLN  73   6.905 -11.577  -9.067
  563   1HE2  GLN  73          2HE2      GLN  73   7.738 -14.384  -9.284
  564   2HE2  GLN  73          1HE2      GLN  73   8.105 -14.882  -7.669
  565    H    ASN  74           H        ASN  74   3.542  -9.346  -7.260
  566    HA   ASN  74           HA       ASN  74   0.751 -10.154  -7.647
  567   1HB   ASN  74          1HB       ASN  74   2.214  -8.944  -5.308
  568   2HB   ASN  74          2HB       ASN  74   0.460  -9.086  -5.346
  569   1HD2  ASN  74          2HD2      ASN  74   3.471 -10.786  -5.115
  570   2HD2  ASN  74          1HD2      ASN  74   2.809 -12.319  -4.644
  571    H    GLY  75           H        GLY  75   2.757  -7.442  -8.144
  572   1HA   GLY  75          1HA       GLY  75   2.047  -5.503  -9.299
  573   2HA   GLY  75          2HA       GLY  75   0.403  -5.814  -8.761
  574    H    TYR  76           H        TYR  76   1.302  -6.276  -5.989
  575    HA   TYR  76           HA       TYR  76   2.457  -3.798  -5.101
  576   1HB   TYR  76          1HB       TYR  76   0.483  -3.133  -3.736
  577   2HB   TYR  76          2HB       TYR  76   0.199  -3.009  -5.467
  578    HD1  TYR  76           HD1      TYR  76  -0.659  -4.825  -2.398
  579    HD2  TYR  76           HD2      TYR  76  -1.403  -4.466  -6.570
  580    HE1  TYR  76           HE1      TYR  76  -2.691  -6.182  -2.146
  581    HE2  TYR  76           HE2      TYR  76  -3.438  -5.827  -6.327
  582    HH   TYR  76           HH       TYR  76  -4.439  -7.416  -4.855
  583    H    PHE  77           H        PHE  77   2.805  -3.770  -2.783
  584    HA   PHE  77           HA       PHE  77   2.350  -6.318  -1.411
  585   1HB   PHE  77          1HB       PHE  77   4.615  -6.456  -2.344
  586   2HB   PHE  77          2HB       PHE  77   5.032  -4.922  -1.591
  587    HD1  PHE  77           HD1      PHE  77   5.912  -4.866   0.563
  588    HD2  PHE  77           HD2      PHE  77   3.962  -8.390  -0.811
  589    HE1  PHE  77           HE1      PHE  77   6.651  -6.057   2.584
  590    HE2  PHE  77           HE2      PHE  77   4.699  -9.589   1.208
  591    HZ   PHE  77           HZ       PHE  77   6.043  -8.422   2.908
  592    H    ILE  78           H        ILE  78   1.438  -5.931   0.494
  593    HA   ILE  78           HA       ILE  78   1.716  -3.274   1.690
  594    HB   ILE  78           HB       ILE  78  -0.249  -5.513   2.146
  595   1HG1  ILE  78          1HG1      ILE  78  -1.868  -3.571   1.792
  596   2HG1  ILE  78          2HG1      ILE  78  -0.472  -2.635   1.274
  597   1HG2  ILE  78          1HG2      ILE  78   0.397  -4.721   4.347
  598   2HG2  ILE  78          2HG2      ILE  78   0.079  -3.056   3.858
  599   3HG2  ILE  78          3HG2      ILE  78  -1.248  -4.215   3.958
  600   1HD1  ILE  78          1HD1      ILE  78  -0.074  -4.231  -0.525
  601   2HD1  ILE  78          2HD1      ILE  78  -1.480  -5.159  -0.006
  602   3HD1  ILE  78          3HD1      ILE  78  -1.685  -3.520  -0.620
  603    H    TYR  79           H        TYR  79   2.925  -2.930   3.449
  604    HA   TYR  79           HA       TYR  79   3.912  -5.280   4.920
  605   1HB   TYR  79          1HB       TYR  79   5.705  -3.954   3.947
  606   2HB   TYR  79          2HB       TYR  79   5.064  -2.489   4.683
  607    HD1  TYR  79           HD1      TYR  79   5.659  -1.879   6.883
  608    HD2  TYR  79           HD2      TYR  79   6.624  -5.767   5.449
  609    HE1  TYR  79           HE1      TYR  79   7.036  -2.268   8.880
  610    HE2  TYR  79           HE2      TYR  79   8.006  -6.163   7.443
  611    HH   TYR  79           HH       TYR  79   9.262  -4.738   9.126
  612    H    LYS  80           H        LYS  80   3.396  -5.530   7.029
  613    HA   LYS  80           HA       LYS  80   1.509  -3.718   8.232
  614   1HB   LYS  80          1HB       LYS  80   2.859  -6.240   9.158
  615   2HB   LYS  80          2HB       LYS  80   1.967  -5.242  10.291
  616   1HG   LYS  80          1HG       LYS  80   0.576  -7.041   9.537
  617   2HG   LYS  80          2HG       LYS  80  -0.052  -5.521   8.905
  618   1HD   LYS  80          1HD       LYS  80   0.533  -6.026   6.737
  619   2HD   LYS  80          2HD       LYS  80   1.827  -7.122   7.230
  620   1HE   LYS  80          1HE       LYS  80  -0.135  -8.277   6.235
  621   2HE   LYS  80          2HE       LYS  80   0.242  -8.802   7.873
  622   1HZ   LYS  80          1HZ       LYS  80  -2.132  -8.506   7.573
  623   2HZ   LYS  80          2HZ       LYS  80  -1.543  -7.387   8.696
  624   3HZ   LYS  80          3HZ       LYS  80  -1.902  -6.894   7.121
  625    H    MET  81           H        MET  81   2.650  -1.761   8.347
  626    HA   MET  81           HA       MET  81   5.133  -1.468   9.671
  627   1HB   MET  81          1HB       MET  81   4.257   0.211   8.103
  628   2HB   MET  81          2HB       MET  81   2.945   0.570   9.216
  629   1HG   MET  81          1HG       MET  81   4.622   1.298  10.884
  630   2HG   MET  81          2HG       MET  81   5.880   1.047   9.677
  631   1HE   MET  81          1HE       MET  81   5.977   2.404   7.360
  632   2HE   MET  81          2HE       MET  81   4.823   3.667   6.928
  633   3HE   MET  81          3HE       MET  81   4.294   1.988   7.033
  634    H    GLU  82           H        GLU  82   1.929  -0.339  10.758
  635    HA   GLU  82           HA       GLU  82   2.821  -0.716  13.524
  636   1HB   GLU  82          1HB       GLU  82   1.368   1.324  12.282
  637   2HB   GLU  82          2HB       GLU  82   0.175   0.437  13.221
  638   1HG   GLU  82          1HG       GLU  82   2.740   1.594  14.290
  639   2HG   GLU  82          2HG       GLU  82   1.135   2.299  14.475
  640    H    GLY  83           H        GLY  83   1.381  -1.747  15.045
  641   1HA   GLY  83          1HA       GLY  83  -0.240  -3.337  15.632
  642   2HA   GLY  83          2HA       GLY  83  -0.654  -3.514  13.930
  643    H    CYS  84           H        CYS  84   2.658  -3.579  14.475
  644    HA   CYS  84           HA       CYS  84   2.785  -6.371  13.776
  645   1HB   CYS  84          1HB       CYS  84   5.306  -5.866  13.850
  646   2HB   CYS  84          2HB       CYS  84   4.343  -5.059  12.617
  647    HG   CYS  84           HG       CYS  84   4.869  -2.634  13.310
  648    H    ASN  85           H        ASN  85   3.727  -4.339  16.523
  649    HA   ASN  85           HA       ASN  85   3.337  -6.490  18.349
  650   1HB   ASN  85          1HB       ASN  85   5.578  -6.710  19.213
  651   2HB   ASN  85          2HB       ASN  85   5.617  -7.042  17.487
  652   1HD2  ASN  85          2HD2      ASN  85   7.694  -6.178  19.383
  653   2HD2  ASN  85          1HD2      ASN  85   8.375  -4.740  18.693
  Start of MODEL    2
    1    H    MET   1           H        MET   1  15.158   1.058 -10.485
    2    HA   MET   1           HA       MET   1  12.248   1.590 -10.491
    3   1HB   MET   1          1HB       MET   1  13.273  -0.676 -11.298
    4   2HB   MET   1          2HB       MET   1  13.600  -0.937  -9.592
    5   1HG   MET   1          1HG       MET   1  10.885  -0.427 -10.792
    6   2HG   MET   1          2HG       MET   1  11.522  -2.002 -10.324
    7   1HE   MET   1          1HE       MET   1   8.728  -1.272  -7.654
    8   2HE   MET   1          2HE       MET   1   9.299  -2.397  -8.889
    9   3HE   MET   1          3HE       MET   1   8.714  -0.800  -9.354
   10    H    GLN   2           H        GLN   2  11.612   2.562  -8.737
   11    HA   GLN   2           HA       GLN   2  12.824   1.848  -6.174
   12   1HB   GLN   2          1HB       GLN   2  12.605   4.233  -5.447
   13   2HB   GLN   2          2HB       GLN   2  13.828   3.975  -6.679
   14   1HG   GLN   2          1HG       GLN   2  11.058   4.920  -7.347
   15   2HG   GLN   2          2HG       GLN   2  12.346   6.030  -6.893
   16   1HE2  GLN   2          2HE2      GLN   2  14.117   6.293  -8.284
   17   2HE2  GLN   2          1HE2      GLN   2  14.038   5.822  -9.948
   18    H    ILE   3           H        ILE   3  11.361   1.922  -4.415
   19    HA   ILE   3           HA       ILE   3   8.694   1.306  -5.316
   20    HB   ILE   3           HB       ILE   3   8.266   0.810  -2.871
   21   1HG1  ILE   3          1HG1      ILE   3  11.270   1.163  -2.729
   22   2HG1  ILE   3          2HG1      ILE   3  10.075   2.170  -1.918
   23   1HG2  ILE   3          1HG2      ILE   3  10.430  -0.681  -4.332
   24   2HG2  ILE   3          2HG2      ILE   3   9.488  -1.315  -2.982
   25   3HG2  ILE   3          3HG2      ILE   3   8.690  -0.910  -4.501
   26   1HD1  ILE   3          1HD1      ILE   3  11.093   0.586  -0.385
   27   2HD1  ILE   3          2HD1      ILE   3   9.371   0.259  -0.579
   28   3HD1  ILE   3          3HD1      ILE   3  10.558  -0.754  -1.400
   29    H    HIS   4           H        HIS   4   6.960   2.466  -5.172
   30    HA   HIS   4           HA       HIS   4   7.123   5.133  -4.017
   31   1HB   HIS   4          1HB       HIS   4   4.822   3.845  -5.523
   32   2HB   HIS   4          2HB       HIS   4   5.009   5.555  -5.149
   33    HD1  HIS   4           HD1      HIS   4   5.917   6.920  -7.032
   34    HD2  HIS   4           HD2      HIS   4   7.072   2.929  -7.296
   35    HE1  HIS   4           HE1      HIS   4   7.212   6.720  -9.180
   36    HE2  HIS   4           HE2      HIS   4   8.019   4.331  -9.250
   37    H    VAL   5           H        VAL   5   6.784   5.220  -1.916
   38    HA   VAL   5           HA       VAL   5   5.384   3.064  -0.570
   39    HB   VAL   5           HB       VAL   5   6.774   5.469   0.624
   40   1HG1  VAL   5          1HG1      VAL   5   6.886   4.094   2.653
   41   2HG1  VAL   5          2HG1      VAL   5   5.224   4.410   2.157
   42   3HG1  VAL   5          3HG1      VAL   5   5.954   2.836   1.841
   43   1HG2  VAL   5          1HG2      VAL   5   7.860   2.704   0.104
   44   2HG2  VAL   5          2HG2      VAL   5   8.330   4.180  -0.737
   45   3HG2  VAL   5          3HG2      VAL   5   8.692   3.990   0.978
   46    H    TYR   6           H        TYR   6   3.290   3.178  -0.122
   47    HA   TYR   6           HA       TYR   6   2.089   5.834   0.232
   48   1HB   TYR   6          1HB       TYR   6   0.822   3.193  -0.494
   49   2HB   TYR   6          2HB       TYR   6  -0.093   4.657  -0.140
   50    HD1  TYR   6           HD1      TYR   6   2.120   2.996  -2.532
   51    HD2  TYR   6           HD2      TYR   6  -0.095   6.527  -1.687
   52    HE1  TYR   6           HE1      TYR   6   2.404   3.725  -4.859
   53    HE2  TYR   6           HE2      TYR   6   0.180   7.263  -4.016
   54    HH   TYR   6           HH       TYR   6   1.359   5.185  -6.463
   55    H    ASP   7           H        ASP   7   1.814   6.462   2.168
   56    HA   ASP   7           HA       ASP   7   1.866   4.698   4.444
   57   1HB   ASP   7          1HB       ASP   7   3.002   6.823   4.604
   58   2HB   ASP   7          2HB       ASP   7   1.551   7.692   4.122
   59    H    THR   8           H        THR   8   0.054   3.529   4.746
   60    HA   THR   8           HA       THR   8  -2.528   4.833   4.204
   61    HB   THR   8           HB       THR   8  -2.025   1.862   4.376
   62    HG1  THR   8           HG1      THR   8  -0.835   3.053   2.648
   63   1HG2  THR   8          1HG2      THR   8  -4.358   2.571   4.635
   64   2HG2  THR   8          2HG2      THR   8  -4.253   3.483   3.129
   65   3HG2  THR   8          3HG2      THR   8  -4.121   1.726   3.105
   66    H    TYR   9           H        TYR   9  -3.583   5.467   5.939
   67    HA   TYR   9           HA       TYR   9  -3.352   3.944   8.438
   68   1HB   TYR   9          1HB       TYR   9  -4.123   6.754   7.773
   69   2HB   TYR   9          2HB       TYR   9  -4.806   6.019   9.219
   70    HD1  TYR   9           HD1      TYR   9  -3.610   6.040  11.205
   71    HD2  TYR   9           HD2      TYR   9  -1.539   6.699   7.550
   72    HE1  TYR   9           HE1      TYR   9  -1.571   6.576  12.466
   73    HE2  TYR   9           HE2      TYR   9   0.508   7.238   8.802
   74    HH   TYR   9           HH       TYR   9   1.128   8.050  11.070
   75    H    VAL  10           H        VAL  10  -4.775   2.320   8.492
   76    HA   VAL  10           HA       VAL  10  -7.532   2.851   7.594
   77    HB   VAL  10           HB       VAL  10  -6.216   0.185   8.155
   78   1HG1  VAL  10          1HG1      VAL  10  -8.198  -0.772   7.079
   79   2HG1  VAL  10          2HG1      VAL  10  -8.626   0.152   8.518
   80   3HG1  VAL  10          3HG1      VAL  10  -8.889   0.842   6.917
   81   1HG2  VAL  10          1HG2      VAL  10  -5.234   1.251   6.198
   82   2HG2  VAL  10          2HG2      VAL  10  -6.227  -0.127   5.724
   83   3HG2  VAL  10          3HG2      VAL  10  -6.841   1.513   5.519
   84    H    LYS  11           H        LYS  11  -8.754   3.510   9.229
   85    HA   LYS  11           HA       LYS  11  -8.121   2.681  11.939
   86   1HB   LYS  11          1HB       LYS  11 -10.278   4.571  10.986
   87   2HB   LYS  11          2HB       LYS  11  -9.694   4.382  12.634
   88   1HG   LYS  11          1HG       LYS  11  -7.517   5.242  11.991
   89   2HG   LYS  11          2HG       LYS  11  -8.051   5.381  10.316
   90   1HD   LYS  11          1HD       LYS  11  -8.168   7.549  11.332
   91   2HD   LYS  11          2HD       LYS  11  -9.814   6.966  11.076
   92   1HE   LYS  11          1HE       LYS  11  -9.879   6.238  13.439
   93   2HE   LYS  11          2HE       LYS  11  -8.274   6.929  13.668
   94   1HZ   LYS  11          1HZ       LYS  11  -9.996   8.444  14.406
   95   2HZ   LYS  11          2HZ       LYS  11  -9.165   9.099  13.081
   96   3HZ   LYS  11          3HZ       LYS  11 -10.710   8.429  12.871
   97    H    ALA  12           H        ALA  12  -8.756   0.591  12.127
   98    HA   ALA  12           HA       ALA  12 -11.364  -0.283  11.235
   99   1HB   ALA  12          1HB       ALA  12  -9.440  -1.778  11.058
  100   2HB   ALA  12          2HB       ALA  12  -9.235  -1.732  12.809
  101   3HB   ALA  12          3HB       ALA  12 -10.678  -2.466  12.109
  102    H    LYS  13           H        LYS  13 -12.982  -1.167  12.645
  103    HA   LYS  13           HA       LYS  13 -13.727   0.476  14.752
  104   1HB   LYS  13          1HB       LYS  13 -14.483  -2.370  14.116
  105   2HB   LYS  13          2HB       LYS  13 -15.199  -1.494  15.456
  106   1HG   LYS  13          1HG       LYS  13 -16.104   0.155  13.913
  107   2HG   LYS  13          2HG       LYS  13 -15.353  -0.696  12.557
  108   1HD   LYS  13          1HD       LYS  13 -16.709  -2.627  12.919
  109   2HD   LYS  13          2HD       LYS  13 -17.310  -1.990  14.449
  110   1HE   LYS  13          1HE       LYS  13 -17.829  -0.784  11.734
  111   2HE   LYS  13          2HE       LYS  13 -18.955  -1.807  12.624
  112   1HZ   LYS  13          1HZ       LYS  13 -17.936   0.848  13.488
  113   2HZ   LYS  13          2HZ       LYS  13 -19.502   0.502  12.948
  114   3HZ   LYS  13          3HZ       LYS  13 -18.952  -0.149  14.410
  115    H    ASP  14           H        ASP  14 -12.668  -2.894  15.115
  116    HA   ASP  14           HA       ASP  14 -11.596  -2.197  17.778
  117   1HB   ASP  14          1HB       ASP  14 -12.938  -4.813  17.057
  118   2HB   ASP  14          2HB       ASP  14 -12.421  -4.284  18.654
  119    H    GLY  15           H        GLY  15 -10.662  -2.816  14.860
  120   1HA   GLY  15          1HA       GLY  15  -8.768  -4.967  15.479
  121   2HA   GLY  15          2HA       GLY  15  -9.155  -4.369  13.872
  122    H    HIS  16           H        HIS  16  -8.747  -1.916  16.163
  123    HA   HIS  16           HA       HIS  16  -7.076  -0.479  16.733
  124   1HB   HIS  16          1HB       HIS  16  -5.724  -2.542  17.116
  125   2HB   HIS  16          2HB       HIS  16  -5.195  -2.471  15.443
  126    HD1  HIS  16           HD1      HIS  16  -4.860  -0.624  18.708
  127    HD2  HIS  16           HD2      HIS  16  -3.057  -0.814  14.966
  128    HE1  HIS  16           HE1      HIS  16  -2.730   0.701  18.912
  129    HE2  HIS  16           HE2      HIS  16  -1.586   0.451  16.677
  130    H    VAL  17           H        VAL  17  -5.952   1.281  15.768
  131    HA   VAL  17           HA       VAL  17  -6.568   1.798  13.034
  132    HB   VAL  17           HB       VAL  17  -4.630   3.252  14.853
  133   1HG1  VAL  17          1HG1      VAL  17  -4.840   5.112  13.265
  134   2HG1  VAL  17          2HG1      VAL  17  -4.137   3.684  12.505
  135   3HG1  VAL  17          3HG1      VAL  17  -5.828   4.097  12.213
  136   1HG2  VAL  17          1HG2      VAL  17  -7.505   3.836  14.144
  137   2HG2  VAL  17          2HG2      VAL  17  -6.903   3.295  15.711
  138   3HG2  VAL  17          3HG2      VAL  17  -6.455   4.886  15.095
  139    H    MET  18           H        MET  18  -5.689   0.612  11.521
  140    HA   MET  18           HA       MET  18  -3.024  -0.510  11.835
  141   1HB   MET  18          1HB       MET  18  -5.166  -0.929   9.737
  142   2HB   MET  18          2HB       MET  18  -3.648  -1.812   9.817
  143   1HG   MET  18          1HG       MET  18  -5.518  -1.811  12.148
  144   2HG   MET  18          2HG       MET  18  -5.797  -2.880  10.773
  145   1HE   MET  18          1HE       MET  18  -2.717  -5.176  10.743
  146   2HE   MET  18          2HE       MET  18  -3.061  -3.746   9.768
  147   3HE   MET  18          3HE       MET  18  -4.347  -4.897  10.131
  148    H    HIS  19           H        HIS  19  -1.442   0.899  11.285
  149    HA   HIS  19           HA       HIS  19  -1.720   2.163   8.643
  150   1HB   HIS  19          1HB       HIS  19   0.032   3.807   9.393
  151   2HB   HIS  19          2HB       HIS  19  -1.526   3.952  10.187
  152    HD1  HIS  19           HD1      HIS  19   2.066   3.303  10.836
  153    HD2  HIS  19           HD2      HIS  19  -1.528   3.242  12.928
  154    HE1  HIS  19           HE1      HIS  19   2.696   3.278  13.271
  155    HE2  HIS  19           HE2      HIS  19   0.504   3.393  14.516
  156    H    PHE  20           H        PHE  20  -0.400   1.584   7.107
  157    HA   PHE  20           HA       PHE  20   2.057   0.149   7.736
  158   1HB   PHE  20          1HB       PHE  20   1.352  -1.682   6.118
  159   2HB   PHE  20          2HB       PHE  20   0.551  -1.681   7.683
  160    HD1  PHE  20           HD1      PHE  20  -1.794  -1.161   7.881
  161    HD2  PHE  20           HD2      PHE  20   0.143  -1.096   4.092
  162    HE1  PHE  20           HE1      PHE  20  -3.985  -1.135   6.765
  163    HE2  PHE  20           HE2      PHE  20  -2.047  -1.068   2.971
  164    HZ   PHE  20           HZ       PHE  20  -4.115  -1.088   4.307
  165    H    ASP  21           H        ASP  21   3.154  -0.518   5.594
  166    HA   ASP  21           HA       ASP  21   3.109   1.862   3.869
  167   1HB   ASP  21          1HB       ASP  21   5.281  -0.208   4.298
  168   2HB   ASP  21          2HB       ASP  21   5.403   1.175   3.219
  169    H    VAL  22           H        VAL  22   2.030   1.565   2.014
  170    HA   VAL  22           HA       VAL  22   1.991  -1.084   0.786
  171    HB   VAL  22           HB       VAL  22   0.637   1.472  -0.101
  172   1HG1  VAL  22          1HG1      VAL  22  -0.641   0.038  -1.621
  173   2HG1  VAL  22          2HG1      VAL  22   1.084  -0.012  -1.984
  174   3HG1  VAL  22          3HG1      VAL  22   0.324  -1.350  -1.122
  175   1HG2  VAL  22          1HG2      VAL  22  -1.419   0.418   0.692
  176   2HG2  VAL  22          2HG2      VAL  22  -0.490  -0.969   1.261
  177   3HG2  VAL  22          3HG2      VAL  22  -0.253   0.614   2.002
  178    H    PHE  23           H        PHE  23   3.680  -1.619  -0.414
  179    HA   PHE  23           HA       PHE  23   5.169   0.472  -1.822
  180   1HB   PHE  23          1HB       PHE  23   5.815  -2.458  -1.410
  181   2HB   PHE  23          2HB       PHE  23   6.851  -1.299  -2.232
  182    HD1  PHE  23           HD1      PHE  23   6.491   1.033  -0.366
  183    HD2  PHE  23           HD2      PHE  23   7.168  -3.102   0.369
  184    HE1  PHE  23           HE1      PHE  23   7.574   1.592   1.772
  185    HE2  PHE  23           HE2      PHE  23   8.247  -2.549   2.509
  186    HZ   PHE  23           HZ       PHE  23   8.452  -0.200   3.213
  187    H    THR  24           H        THR  24   4.626   0.899  -3.862
  188    HA   THR  24           HA       THR  24   4.322  -1.333  -5.690
  189    HB   THR  24           HB       THR  24   2.000  -0.905  -4.970
  190    HG1  THR  24           HG1      THR  24   1.782  -1.585  -6.970
  191   1HG2  THR  24          1HG2      THR  24   2.197   1.481  -4.455
  192   2HG2  THR  24          2HG2      THR  24   2.402   1.838  -6.170
  193   3HG2  THR  24          3HG2      THR  24   0.876   1.175  -5.582
  194    H    ASP  25           H        ASP  25   3.969  -0.375  -7.997
  195    HA   ASP  25           HA       ASP  25   6.046   1.662  -8.334
  196   1HB   ASP  25          1HB       ASP  25   6.314  -0.478  -9.539
  197   2HB   ASP  25          2HB       ASP  25   4.779  -0.206 -10.355
  198    H    VAL  26           H        VAL  26   2.675   1.054  -8.836
  199    HA   VAL  26           HA       VAL  26   2.195   3.078 -10.772
  200    HB   VAL  26           HB       VAL  26   0.215   1.816  -8.866
  201   1HG1  VAL  26          1HG1      VAL  26  -0.182   3.184 -11.526
  202   2HG1  VAL  26          2HG1      VAL  26  -1.442   2.390 -10.581
  203   3HG1  VAL  26          3HG1      VAL  26  -0.636   3.826  -9.947
  204   1HG2  VAL  26          1HG2      VAL  26   1.410   0.101 -10.117
  205   2HG2  VAL  26          2HG2      VAL  26  -0.257   0.233 -10.678
  206   3HG2  VAL  26          3HG2      VAL  26   1.051   0.936 -11.628
  207    H    ARG  27           H        ARG  27   2.133   5.197 -10.480
  208    HA   ARG  27           HA       ARG  27   1.756   6.224  -7.756
  209   1HB   ARG  27          1HB       ARG  27   2.621   8.402  -8.785
  210   2HB   ARG  27          2HB       ARG  27   3.774   7.097  -8.559
  211   1HG   ARG  27          1HG       ARG  27   3.630   6.533 -10.917
  212   2HG   ARG  27          2HG       ARG  27   2.418   7.795 -11.158
  213   1HD   ARG  27          1HD       ARG  27   3.998   9.507 -10.606
  214   2HD   ARG  27          2HD       ARG  27   5.197   8.312 -10.114
  215    HE   ARG  27           HE       ARG  27   5.368   7.654 -12.458
  216   1HH1  ARG  27          1HH1      ARG  27   3.847  10.738 -11.748
  217   2HH1  ARG  27          2HH1      ARG  27   4.185  11.398 -13.324
  218   1HH2  ARG  27          1HH2      ARG  27   5.828   8.557 -14.515
  219   2HH2  ARG  27          2HH2      ARG  27   5.309  10.175 -14.875
  220    H    ASP  28           H        ASP  28  -0.510   5.505  -8.315
  221    HA   ASP  28           HA       ASP  28  -1.984   7.780  -9.467
  222   1HB   ASP  28          1HB       ASP  28  -2.142   5.795 -10.926
  223   2HB   ASP  28          2HB       ASP  28  -2.754   4.852  -9.572
  224    H    ASP  29           H        ASP  29  -3.486   8.657  -8.201
  225    HA   ASP  29           HA       ASP  29  -3.529   8.326  -5.478
  226   1HB   ASP  29          1HB       ASP  29  -4.399  10.322  -6.472
  227   2HB   ASP  29          2HB       ASP  29  -5.641   9.424  -7.335
  228    H    LYS  30           H        LYS  30  -6.164   7.236  -7.635
  229    HA   LYS  30           HA       LYS  30  -7.473   5.954  -5.438
  230   1HB   LYS  30          1HB       LYS  30  -8.766   7.039  -7.176
  231   2HB   LYS  30          2HB       LYS  30  -8.089   5.965  -8.391
  232   1HG   LYS  30          1HG       LYS  30  -9.242   4.088  -7.482
  233   2HG   LYS  30          2HG       LYS  30  -9.756   5.019  -6.073
  234   1HD   LYS  30          1HD       LYS  30 -11.118   6.450  -7.486
  235   2HD   LYS  30          2HD       LYS  30 -10.557   5.594  -8.923
  236   1HE   LYS  30          1HE       LYS  30 -12.817   4.901  -8.141
  237   2HE   LYS  30          2HE       LYS  30 -11.650   3.583  -8.236
  238   1HZ   LYS  30          1HZ       LYS  30 -12.092   5.015  -5.693
  239   2HZ   LYS  30          2HZ       LYS  30 -13.135   3.770  -6.174
  240   3HZ   LYS  30          3HZ       LYS  30 -11.486   3.449  -5.948
  241    H    LYS  31           H        LYS  31  -5.491   4.890  -8.132
  242    HA   LYS  31           HA       LYS  31  -6.161   2.168  -8.077
  243   1HB   LYS  31          1HB       LYS  31  -4.827   3.406  -9.848
  244   2HB   LYS  31          2HB       LYS  31  -3.438   3.250  -8.782
  245   1HG   LYS  31          1HG       LYS  31  -3.443   1.519 -10.492
  246   2HG   LYS  31          2HG       LYS  31  -3.620   0.822  -8.879
  247   1HD   LYS  31          1HD       LYS  31  -6.002   0.575  -9.206
  248   2HD   LYS  31          2HD       LYS  31  -5.902   1.387 -10.769
  249   1HE   LYS  31          1HE       LYS  31  -4.583  -1.231 -10.060
  250   2HE   LYS  31          2HE       LYS  31  -6.065  -1.052 -10.996
  251   1HZ   LYS  31          1HZ       LYS  31  -4.572  -1.199 -12.671
  252   2HZ   LYS  31          2HZ       LYS  31  -4.491   0.476 -12.436
  253   3HZ   LYS  31          3HZ       LYS  31  -3.295  -0.538 -11.778
  254    H    ALA  32           H        ALA  32  -3.629   3.954  -6.345
  255    HA   ALA  32           HA       ALA  32  -2.441   1.700  -5.124
  256   1HB   ALA  32          1HB       ALA  32  -1.362   3.292  -3.638
  257   2HB   ALA  32          2HB       ALA  32  -1.331   3.881  -5.301
  258   3HB   ALA  32          3HB       ALA  32  -2.485   4.554  -4.149
  259    H    ILE  33           H        ILE  33  -5.009   3.891  -4.101
  260    HA   ILE  33           HA       ILE  33  -5.327   2.880  -1.488
  261    HB   ILE  33           HB       ILE  33  -7.442   4.154  -3.234
  262   1HG1  ILE  33          1HG1      ILE  33  -5.538   5.451  -1.272
  263   2HG1  ILE  33          2HG1      ILE  33  -5.377   5.525  -3.023
  264   1HG2  ILE  33          1HG2      ILE  33  -8.306   3.014  -1.238
  265   2HG2  ILE  33          2HG2      ILE  33  -7.226   3.976  -0.231
  266   3HG2  ILE  33          3HG2      ILE  33  -8.516   4.762  -1.143
  267   1HD1  ILE  33          1HD1      ILE  33  -7.517   6.702  -3.158
  268   2HD1  ILE  33          2HD1      ILE  33  -7.649   6.646  -1.399
  269   3HD1  ILE  33          3HD1      ILE  33  -6.346   7.563  -2.159
  270    H    GLU  34           H        GLU  34  -6.700   1.967  -4.596
  271    HA   GLU  34           HA       GLU  34  -8.634   0.158  -3.622
  272   1HB   GLU  34          1HB       GLU  34  -7.936   1.153  -6.097
  273   2HB   GLU  34          2HB       GLU  34  -7.475  -0.539  -6.219
  274   1HG   GLU  34          1HG       GLU  34  -9.700  -0.318  -7.022
  275   2HG   GLU  34          2HG       GLU  34  -9.762  -1.155  -5.472
  276    H    PHE  35           H        PHE  35  -5.220  -0.191  -4.440
  277    HA   PHE  35           HA       PHE  35  -5.041  -2.992  -4.227
  278   1HB   PHE  35          1HB       PHE  35  -2.987  -0.844  -3.673
  279   2HB   PHE  35          2HB       PHE  35  -2.621  -2.564  -3.644
  280    HD1  PHE  35           HD1      PHE  35  -1.856   0.027  -5.472
  281    HD2  PHE  35           HD2      PHE  35  -4.083  -3.565  -5.967
  282    HE1  PHE  35           HE1      PHE  35  -1.405   0.086  -7.890
  283    HE2  PHE  35           HE2      PHE  35  -3.636  -3.512  -8.385
  284    HZ   PHE  35           HZ       PHE  35  -2.295  -1.686  -9.349
  285    H    ALA  36           H        ALA  36  -4.777  -0.423  -1.817
  286    HA   ALA  36           HA       ALA  36  -4.065  -2.056   0.369
  287   1HB   ALA  36          1HB       ALA  36  -4.755  -0.172   1.764
  288   2HB   ALA  36          2HB       ALA  36  -3.788   0.368   0.391
  289   3HB   ALA  36          3HB       ALA  36  -5.539   0.576   0.373
  290    H    LYS  37           H        LYS  37  -7.201  -1.079  -0.940
  291    HA   LYS  37           HA       LYS  37  -8.786  -2.112   1.153
  292   1HB   LYS  37          1HB       LYS  37  -9.462  -1.734  -1.765
  293   2HB   LYS  37          2HB       LYS  37 -10.632  -2.087  -0.501
  294   1HG   LYS  37          1HG       LYS  37 -10.026   0.012   0.614
  295   2HG   LYS  37          2HG       LYS  37  -8.913   0.371  -0.710
  296   1HD   LYS  37          1HD       LYS  37 -10.867   0.152  -2.273
  297   2HD   LYS  37          2HD       LYS  37 -11.905   0.074  -0.849
  298   1HE   LYS  37          1HE       LYS  37 -11.378   2.269  -0.213
  299   2HE   LYS  37          2HE       LYS  37  -9.994   2.337  -1.303
  300   1HZ   LYS  37          1HZ       LYS  37 -11.906   3.581  -2.148
  301   2HZ   LYS  37          2HZ       LYS  37 -11.478   2.303  -3.182
  302   3HZ   LYS  37          3HZ       LYS  37 -12.832   2.158  -2.169
  303    H    GLN  38           H        GLN  38  -7.410  -3.588  -1.721
  304    HA   GLN  38           HA       GLN  38  -8.806  -6.014  -1.692
  305   1HB   GLN  38          1HB       GLN  38  -5.936  -5.491  -2.489
  306   2HB   GLN  38          2HB       GLN  38  -6.815  -6.972  -2.837
  307   1HG   GLN  38          1HG       GLN  38  -8.451  -5.619  -4.132
  308   2HG   GLN  38          2HG       GLN  38  -7.409  -4.217  -3.885
  309   1HE2  GLN  38          2HE2      GLN  38  -7.011  -3.971  -6.072
  310   2HE2  GLN  38          1HE2      GLN  38  -6.008  -5.061  -6.973
  311    H    TRP  39           H        TRP  39  -5.925  -4.988   0.062
  312    HA   TRP  39           HA       TRP  39  -5.445  -7.480   1.341
  313   1HB   TRP  39          1HB       TRP  39  -3.749  -5.668   1.065
  314   2HB   TRP  39          2HB       TRP  39  -4.634  -4.705   2.242
  315    HD1  TRP  39           HD1      TRP  39  -2.756  -8.089   2.066
  316    HE1  TRP  39           HE1      TRP  39  -1.711  -8.547   4.376
  317    HE3  TRP  39           HE3      TRP  39  -4.643  -4.074   4.605
  318    HZ2  TRP  39           HZ2      TRP  39  -1.693  -7.354   6.930
  319    HZ3  TRP  39           HZ3      TRP  39  -4.059  -3.804   6.979
  320    HH2  TRP  39           HH2      TRP  39  -2.615  -5.412   8.117
  321    H    LEU  40           H        LEU  40  -7.114  -4.508   2.297
  322    HA   LEU  40           HA       LEU  40  -7.841  -5.273   4.898
  323   1HB   LEU  40          1HB       LEU  40  -9.274  -3.446   2.970
  324   2HB   LEU  40          2HB       LEU  40  -9.610  -3.556   4.687
  325    HG   LEU  40           HG       LEU  40  -6.986  -2.664   3.493
  326   1HD1  LEU  40          1HD1      LEU  40  -8.793  -1.071   3.078
  327   2HD1  LEU  40          2HD1      LEU  40  -9.184  -1.065   4.797
  328   3HD1  LEU  40          3HD1      LEU  40  -7.630  -0.440   4.243
  329   1HD2  LEU  40          1HD2      LEU  40  -7.975  -2.679   6.344
  330   2HD2  LEU  40          2HD2      LEU  40  -6.735  -3.737   5.670
  331   3HD2  LEU  40          3HD2      LEU  40  -6.446  -2.001   5.785
  332    H    SER  41           H        SER  41  -9.454  -5.758   1.799
  333    HA   SER  41           HA       SER  41 -11.842  -6.860   2.819
  334   1HB   SER  41          1HB       SER  41 -11.348  -5.994   0.450
  335   2HB   SER  41          2HB       SER  41 -10.618  -7.571   0.152
  336    HG   SER  41           HG       SER  41 -13.300  -6.881   0.608
  337    H    SER  42           H        SER  42  -8.695  -8.199   2.117
  338    HA   SER  42           HA       SER  42  -9.500 -10.936   2.232
  339   1HB   SER  42          1HB       SER  42  -6.750  -9.695   2.478
  340   2HB   SER  42          2HB       SER  42  -7.085 -11.407   2.210
  341    HG   SER  42           HG       SER  42  -7.433  -9.219   0.467
  342    H    ILE  43           H        ILE  43  -8.480  -8.566   4.582
  343    HA   ILE  43           HA       ILE  43  -8.268 -10.634   6.644
  344    HB   ILE  43           HB       ILE  43  -7.432  -8.884   8.129
  345   1HG1  ILE  43          1HG1      ILE  43  -7.724  -7.036   5.747
  346   2HG1  ILE  43          2HG1      ILE  43  -8.729  -6.997   7.191
  347   1HG2  ILE  43          1HG2      ILE  43  -5.319  -8.431   6.963
  348   2HG2  ILE  43          2HG2      ILE  43  -5.848 -10.101   6.757
  349   3HG2  ILE  43          3HG2      ILE  43  -6.059  -8.940   5.445
  350   1HD1  ILE  43          1HD1      ILE  43  -7.032  -5.258   7.229
  351   2HD1  ILE  43          2HD1      ILE  43  -6.791  -6.415   8.538
  352   3HD1  ILE  43          3HD1      ILE  43  -5.767  -6.480   7.103
  353    H    GLY  44           H        GLY  44 -10.648  -8.831   5.285
  354   1HA   GLY  44          1HA       GLY  44 -12.895  -9.070   5.942
  355   2HA   GLY  44          2HA       GLY  44 -12.358  -9.369   7.586
  356    H    GLU  45           H        GLU  45 -10.579  -6.865   7.198
  357    HA   GLU  45           HA       GLU  45 -12.501  -5.180   8.528
  358   1HB   GLU  45          1HB       GLU  45  -9.542  -4.929   8.044
  359   2HB   GLU  45          2HB       GLU  45 -10.483  -3.677   8.844
  360   1HG   GLU  45          1HG       GLU  45 -10.117  -6.518   9.770
  361   2HG   GLU  45          2HG       GLU  45  -9.394  -5.075  10.478
  362    H    GLU  46           H        GLU  46 -12.716  -5.563   5.557
  363    HA   GLU  46           HA       GLU  46 -12.243  -2.903   4.532
  364   1HB   GLU  46          1HB       GLU  46 -12.167  -4.885   3.028
  365   2HB   GLU  46          2HB       GLU  46 -13.884  -5.138   3.314
  366   1HG   GLU  46          1HG       GLU  46 -14.272  -2.829   2.406
  367   2HG   GLU  46          2HG       GLU  46 -12.578  -2.814   1.924
  368    H    GLY  47           H        GLY  47 -13.401  -1.947   6.380
  369   1HA   GLY  47          1HA       GLY  47 -16.165  -1.416   5.569
  370   2HA   GLY  47          2HA       GLY  47 -15.891  -1.972   7.215
  371    H    ALA  48           H        ALA  48 -13.379  -0.117   5.911
  372    HA   ALA  48           HA       ALA  48 -14.263   2.220   7.464
  373   1HB   ALA  48          1HB       ALA  48 -11.906   2.754   7.774
  374   2HB   ALA  48          2HB       ALA  48 -12.253   1.125   8.354
  375   3HB   ALA  48          3HB       ALA  48 -11.448   1.356   6.803
  376    H    THR  49           H        THR  49 -13.830   4.304   6.587
  377    HA   THR  49           HA       THR  49 -14.026   4.377   3.703
  378    HB   THR  49           HB       THR  49 -13.785   6.782   5.508
  379    HG1  THR  49           HG1      THR  49 -15.893   4.936   5.259
  380   1HG2  THR  49          1HG2      THR  49 -13.735   7.177   3.091
  381   2HG2  THR  49          2HG2      THR  49 -15.258   6.305   2.912
  382   3HG2  THR  49          3HG2      THR  49 -15.211   7.823   3.809
  383    H    VAL  50           H        VAL  50 -12.016   3.748   2.897
  384    HA   VAL  50           HA       VAL  50  -9.656   5.214   3.837
  385    HB   VAL  50           HB       VAL  50  -9.777   2.829   1.980
  386   1HG1  VAL  50          1HG1      VAL  50  -7.763   4.158   1.685
  387   2HG1  VAL  50          2HG1      VAL  50  -7.458   4.113   3.422
  388   3HG1  VAL  50          3HG1      VAL  50  -7.378   2.628   2.473
  389   1HG2  VAL  50          1HG2      VAL  50 -10.612   2.226   4.182
  390   2HG2  VAL  50          2HG2      VAL  50  -9.018   1.518   3.916
  391   3HG2  VAL  50          3HG2      VAL  50  -9.190   2.945   4.938
  392    H    THR  51           H        THR  51  -9.516   7.121   2.818
  393    HA   THR  51           HA       THR  51  -9.661   7.096  -0.132
  394    HB   THR  51           HB       THR  51 -10.122   9.667   1.277
  395    HG1  THR  51           HG1      THR  51 -11.415   8.400   2.580
  396   1HG2  THR  51          1HG2      THR  51 -10.257   9.434  -1.181
  397   2HG2  THR  51          2HG2      THR  51 -11.565   8.270  -0.986
  398   3HG2  THR  51          3HG2      THR  51 -11.792   9.946  -0.484
  399    H    SER  52           H        SER  52  -8.667   9.760  -0.430
  400    HA   SER  52           HA       SER  52  -5.909   9.248  -0.471
  401   1HB   SER  52          1HB       SER  52  -7.228  11.959  -0.668
  402   2HB   SER  52          2HB       SER  52  -5.693  11.455  -1.377
  403    HG   SER  52           HG       SER  52  -6.717  10.430  -2.944
  404    H    GLU  53           H        GLU  53  -7.914  10.560   2.009
  405    HA   GLU  53           HA       GLU  53  -5.742  11.920   3.361
  406   1HB   GLU  53          1HB       GLU  53  -8.180  12.659   3.365
  407   2HB   GLU  53          2HB       GLU  53  -8.484  11.318   4.460
  408   1HG   GLU  53          1HG       GLU  53  -6.951  12.266   6.082
  409   2HG   GLU  53          2HG       GLU  53  -6.580  13.591   4.976
  410    H    GLU  54           H        GLU  54  -7.104   8.805   3.231
  411    HA   GLU  54           HA       GLU  54  -5.916   7.981   5.767
  412   1HB   GLU  54          1HB       GLU  54  -7.645   6.546   3.749
  413   2HB   GLU  54          2HB       GLU  54  -6.886   5.721   5.101
  414   1HG   GLU  54          1HG       GLU  54  -9.184   6.233   5.615
  415   2HG   GLU  54          2HG       GLU  54  -8.108   7.156   6.660
  416    H    CYS  55           H        CYS  55  -5.729   7.284   2.304
  417    HA   CYS  55           HA       CYS  55  -3.122   6.006   2.722
  418   1HB   CYS  55          1HB       CYS  55  -4.699   4.701   1.399
  419   2HB   CYS  55          2HB       CYS  55  -4.951   6.059   0.309
  420    HG   CYS  55           HG       CYS  55  -3.147   5.351  -1.359
  421    H    ARG  56           H        ARG  56  -1.563   7.494   2.777
  422    HA   ARG  56           HA       ARG  56  -1.697   9.732   0.859
  423   1HB   ARG  56          1HB       ARG  56  -0.182   9.536   3.470
  424   2HB   ARG  56          2HB       ARG  56  -0.155  10.916   2.384
  425   1HG   ARG  56          1HG       ARG  56  -1.669  11.608   3.949
  426   2HG   ARG  56          2HG       ARG  56  -2.737  10.888   2.744
  427   1HD   ARG  56          1HD       ARG  56  -3.407  10.176   4.951
  428   2HD   ARG  56          2HD       ARG  56  -2.761   8.800   4.057
  429    HE   ARG  56           HE       ARG  56  -0.909   8.757   5.477
  430   1HH1  ARG  56          1HH1      ARG  56  -3.039  11.435   6.219
  431   2HH1  ARG  56          2HH1      ARG  56  -2.323  11.735   7.778
  432   1HH2  ARG  56          1HH2      ARG  56   0.047   9.150   7.504
  433   2HH2  ARG  56          2HH2      ARG  56  -0.558  10.445   8.503
  434    H    PHE  57           H        PHE  57   0.099  10.195  -0.439
  435    HA   PHE  57           HA       PHE  57   1.993   8.089  -0.832
  436   1HB   PHE  57          1HB       PHE  57   1.344   9.520  -2.710
  437   2HB   PHE  57          2HB       PHE  57   1.990  10.933  -1.881
  438    HD1  PHE  57           HD1      PHE  57   4.156  11.603  -2.305
  439    HD2  PHE  57           HD2      PHE  57   3.028   7.587  -3.139
  440    HE1  PHE  57           HE1      PHE  57   6.361  11.199  -3.317
  441    HE2  PHE  57           HE2      PHE  57   5.231   7.174  -4.155
  442    HZ   PHE  57           HZ       PHE  57   6.901   8.982  -4.243
  443    H    CYS  58           H        CYS  58   3.559   7.682   0.565
  444    HA   CYS  58           HA       CYS  58   4.311   9.612   2.545
  445   1HB   CYS  58          1HB       CYS  58   4.132   7.133   2.949
  446   2HB   CYS  58          2HB       CYS  58   5.586   6.926   1.980
  447    HG   CYS  58           HG       CYS  58   5.448   7.285   5.137
  448    H    HIS  59           H        HIS  59   6.259   7.773   0.188
  449    HA   HIS  59           HA       HIS  59   7.536   9.951  -0.977
  450   1HB   HIS  59          1HB       HIS  59   9.824   9.731   0.024
  451   2HB   HIS  59          2HB       HIS  59   8.633  10.424   1.111
  452    HD1  HIS  59           HD1      HIS  59   8.578   9.453   3.381
  453    HD2  HIS  59           HD2      HIS  59  10.287   6.847   0.621
  454    HE1  HIS  59           HE1      HIS  59   9.386   7.482   4.716
  455    HE2  HIS  59           HE2      HIS  59  10.591   6.013   3.059
  456    H    SER  60           H        SER  60   9.724   9.182  -1.998
  457    HA   SER  60           HA       SER  60   9.257   6.502  -3.084
  458   1HB   SER  60          1HB       SER  60   9.614   8.418  -4.646
  459   2HB   SER  60          2HB       SER  60  11.224   8.639  -3.963
  460    HG   SER  60           HG       SER  60  11.898   6.796  -4.881
  461    H    GLU  61           H        GLU  61  10.698   4.813  -2.752
  462    HA   GLU  61           HA       GLU  61  13.046   5.426  -1.099
  463   1HB   GLU  61          1HB       GLU  61  11.171   4.809   0.397
  464   2HB   GLU  61          2HB       GLU  61  11.016   3.278  -0.450
  465   1HG   GLU  61          1HG       GLU  61  12.206   3.083   1.692
  466   2HG   GLU  61          2HG       GLU  61  13.182   2.573   0.316
  467    H    LYS  62           H        LYS  62  14.626   3.749  -1.034
  468    HA   LYS  62           HA       LYS  62  15.182   2.489  -3.477
  469   1HB   LYS  62          1HB       LYS  62  16.220   1.926  -0.689
  470   2HB   LYS  62          2HB       LYS  62  16.930   1.280  -2.164
  471   1HG   LYS  62          1HG       LYS  62  17.532   3.471  -2.911
  472   2HG   LYS  62          2HG       LYS  62  16.644   4.219  -1.585
  473   1HD   LYS  62          1HD       LYS  62  18.717   2.275  -0.800
  474   2HD   LYS  62          2HD       LYS  62  19.305   3.754  -1.557
  475   1HE   LYS  62          1HE       LYS  62  19.235   4.009   0.856
  476   2HE   LYS  62          2HE       LYS  62  18.068   5.083   0.091
  477   1HZ   LYS  62          1HZ       LYS  62  17.369   2.447   1.269
  478   2HZ   LYS  62          2HZ       LYS  62  17.222   3.924   2.091
  479   3HZ   LYS  62          3HZ       LYS  62  16.294   3.635   0.704
  480    H    ALA  63           H        ALA  63  14.672   0.531  -4.286
  481    HA   ALA  63           HA       ALA  63  12.557  -0.897  -2.870
  482   1HB   ALA  63          1HB       ALA  63  13.483  -1.192  -5.722
  483   2HB   ALA  63          2HB       ALA  63  12.024  -1.883  -5.009
  484   3HB   ALA  63          3HB       ALA  63  12.179  -0.134  -5.181
  485    HA   PRO  64           HA       PRO  64  15.473  -4.223  -1.967
  486   1HB   PRO  64          1HB       PRO  64  13.187  -5.405  -0.585
  487   2HB   PRO  64          2HB       PRO  64  14.733  -4.873   0.081
  488   1HG   PRO  64          1HG       PRO  64  12.409  -3.583   0.583
  489   2HG   PRO  64          2HG       PRO  64  13.971  -2.749   0.503
  490   1HD   PRO  64          1HD       PRO  64  11.807  -2.923  -1.562
  491   2HD   PRO  64          2HD       PRO  64  12.805  -1.530  -1.089
  492    H    ASP  65           H        ASP  65  15.671  -6.303  -2.789
  493    HA   ASP  65           HA       ASP  65  14.293  -6.952  -5.115
  494   1HB   ASP  65          1HB       ASP  65  15.404  -9.150  -4.924
  495   2HB   ASP  65          2HB       ASP  65  16.509  -7.814  -4.658
  496    H    GLU  66           H        GLU  66  13.601  -7.728  -1.805
  497    HA   GLU  66           HA       GLU  66  11.885  -9.882  -1.991
  498   1HB   GLU  66          1HB       GLU  66  11.681  -7.464  -0.191
  499   2HB   GLU  66          2HB       GLU  66  10.793  -8.962   0.046
  500   1HG   GLU  66          1HG       GLU  66  12.802 -10.166   0.447
  501   2HG   GLU  66          2HG       GLU  66  13.791  -8.778   0.001
  502    H    VAL  67           H        VAL  67  11.253  -6.492  -2.686
  503    HA   VAL  67           HA       VAL  67   8.396  -7.061  -2.927
  504    HB   VAL  67           HB       VAL  67   8.019  -4.692  -2.837
  505   1HG1  VAL  67          1HG1      VAL  67  10.074  -5.594  -0.818
  506   2HG1  VAL  67          2HG1      VAL  67   9.047  -4.169  -0.639
  507   3HG1  VAL  67          3HG1      VAL  67   8.323  -5.776  -0.707
  508   1HG2  VAL  67          1HG2      VAL  67   9.832  -3.067  -2.674
  509   2HG2  VAL  67          2HG2      VAL  67  11.017  -4.356  -2.887
  510   3HG2  VAL  67          3HG2      VAL  67   9.910  -3.950  -4.199
  511    H    ILE  68           H        ILE  68  11.149  -6.647  -4.866
  512    HA   ILE  68           HA       ILE  68  10.026  -5.368  -7.116
  513    HB   ILE  68           HB       ILE  68  12.363  -7.277  -6.954
  514   1HG1  ILE  68          1HG1      ILE  68  12.661  -5.212  -5.668
  515   2HG1  ILE  68          2HG1      ILE  68  13.722  -5.234  -7.072
  516   1HG2  ILE  68          1HG2      ILE  68  13.030  -6.409  -9.145
  517   2HG2  ILE  68          2HG2      ILE  68  11.474  -7.235  -9.220
  518   3HG2  ILE  68          3HG2      ILE  68  11.538  -5.473  -9.227
  519   1HD1  ILE  68          1HD1      ILE  68  11.124  -3.731  -6.851
  520   2HD1  ILE  68          2HD1      ILE  68  12.742  -3.038  -6.727
  521   3HD1  ILE  68          3HD1      ILE  68  12.198  -3.742  -8.251
  522    H    GLU  69           H        GLU  69  10.562  -8.843  -6.452
  523    HA   GLU  69           HA       GLU  69   9.174  -9.583  -8.851
  524   1HB   GLU  69          1HB       GLU  69   9.601 -11.860  -8.227
  525   2HB   GLU  69          2HB       GLU  69  11.047 -10.918  -7.911
  526   1HG   GLU  69          1HG       GLU  69  10.997 -12.145  -6.012
  527   2HG   GLU  69          2HG       GLU  69   9.986 -10.799  -5.485
  528    H    ALA  70           H        ALA  70   8.286  -8.863  -5.644
  529    HA   ALA  70           HA       ALA  70   5.810 -10.265  -5.537
  530   1HB   ALA  70          1HB       ALA  70   6.906  -9.423  -3.519
  531   2HB   ALA  70          2HB       ALA  70   6.672  -7.767  -4.076
  532   3HB   ALA  70          3HB       ALA  70   5.276  -8.768  -3.678
  533    H    ILE  71           H        ILE  71   6.646  -6.877  -6.288
  534    HA   ILE  71           HA       ILE  71   4.030  -6.129  -7.086
  535    HB   ILE  71           HB       ILE  71   6.695  -4.912  -7.867
  536   1HG1  ILE  71          1HG1      ILE  71   4.737  -4.096  -5.708
  537   2HG1  ILE  71          2HG1      ILE  71   6.229  -4.986  -5.424
  538   1HG2  ILE  71          1HG2      ILE  71   4.926  -4.236  -9.407
  539   2HG2  ILE  71          2HG2      ILE  71   3.920  -3.740  -8.048
  540   3HG2  ILE  71          3HG2      ILE  71   5.424  -2.885  -8.389
  541   1HD1  ILE  71          1HD1      ILE  71   6.509  -2.639  -4.909
  542   2HD1  ILE  71          2HD1      ILE  71   7.510  -3.092  -6.289
  543   3HD1  ILE  71          3HD1      ILE  71   6.009  -2.202  -6.544
  544    H    LYS  72           H        LYS  72   6.632  -7.769  -8.672
  545    HA   LYS  72           HA       LYS  72   5.668  -7.522 -11.342
  546   1HB   LYS  72          1HB       LYS  72   7.992  -8.152 -10.778
  547   2HB   LYS  72          2HB       LYS  72   7.407  -9.664 -10.099
  548   1HG   LYS  72          1HG       LYS  72   6.559 -10.300 -12.326
  549   2HG   LYS  72          2HG       LYS  72   7.242  -8.810 -12.980
  550   1HD   LYS  72          1HD       LYS  72   8.802 -10.995 -11.604
  551   2HD   LYS  72          2HD       LYS  72   8.717 -10.744 -13.348
  552   1HE   LYS  72          1HE       LYS  72   9.751  -8.710 -11.378
  553   2HE   LYS  72          2HE       LYS  72  10.772  -9.825 -12.284
  554   1HZ   LYS  72          1HZ       LYS  72  10.597  -7.601 -13.294
  555   2HZ   LYS  72          2HZ       LYS  72  10.060  -8.837 -14.329
  556   3HZ   LYS  72          3HZ       LYS  72   8.937  -7.845 -13.528
  557    H    GLN  73           H        GLN  73   4.842  -9.483  -8.633
  558    HA   GLN  73           HA       GLN  73   3.372 -11.422 -10.236
  559   1HB   GLN  73          1HB       GLN  73   4.712 -12.236  -8.362
  560   2HB   GLN  73          2HB       GLN  73   3.813 -11.211  -7.253
  561   1HG   GLN  73          1HG       GLN  73   1.758 -12.484  -7.874
  562   2HG   GLN  73          2HG       GLN  73   2.793 -13.589  -8.780
  563   1HE2  GLN  73          2HE2      GLN  73   4.223 -14.928  -7.657
  564   2HE2  GLN  73          1HE2      GLN  73   4.050 -15.232  -5.961
  565    H    ASN  74           H        ASN  74   2.628  -9.431  -7.361
  566    HA   ASN  74           HA       ASN  74  -0.190  -9.537  -8.148
  567   1HB   ASN  74          1HB       ASN  74  -0.626  -8.744  -5.800
  568   2HB   ASN  74          2HB       ASN  74   0.116 -10.330  -5.931
  569   1HD2  ASN  74          2HD2      ASN  74   1.035 -10.389  -3.956
  570   2HD2  ASN  74          1HD2      ASN  74   2.295  -9.318  -3.443
  571    H    GLY  75           H        GLY  75   2.363  -7.243  -7.383
  572   1HA   GLY  75          1HA       GLY  75   2.508  -5.177  -8.576
  573   2HA   GLY  75          2HA       GLY  75   0.760  -5.188  -8.741
  574    H    TYR  76           H        TYR  76   1.425  -6.093  -5.630
  575    HA   TYR  76           HA       TYR  76   1.778  -3.454  -4.526
  576   1HB   TYR  76          1HB       TYR  76  -0.386  -3.431  -3.313
  577   2HB   TYR  76          2HB       TYR  76  -0.581  -3.316  -5.055
  578    HD1  TYR  76           HD1      TYR  76  -1.751  -4.879  -2.146
  579    HD2  TYR  76           HD2      TYR  76  -1.003  -5.659  -6.259
  580    HE1  TYR  76           HE1      TYR  76  -3.337  -6.756  -2.074
  581    HE2  TYR  76           HE2      TYR  76  -2.585  -7.538  -6.196
  582    HH   TYR  76           HH       TYR  76  -4.840  -7.974  -4.011
  583    H    PHE  77           H        PHE  77   3.115  -3.766  -2.896
  584    HA   PHE  77           HA       PHE  77   2.875  -6.259  -1.346
  585   1HB   PHE  77          1HB       PHE  77   5.053  -5.902  -2.490
  586   2HB   PHE  77          2HB       PHE  77   5.260  -4.407  -1.586
  587    HD1  PHE  77           HD1      PHE  77   5.174  -8.067  -1.357
  588    HD2  PHE  77           HD2      PHE  77   5.932  -4.427   0.711
  589    HE1  PHE  77           HE1      PHE  77   6.241  -9.329   0.465
  590    HE2  PHE  77           HE2      PHE  77   7.000  -5.682   2.537
  591    HZ   PHE  77           HZ       PHE  77   7.155  -8.137   2.416
  592    H    ILE  78           H        ILE  78   1.895  -6.024   0.541
  593    HA   ILE  78           HA       ILE  78   1.816  -3.414   1.822
  594    HB   ILE  78           HB       ILE  78   0.383  -5.998   2.445
  595   1HG1  ILE  78          1HG1      ILE  78  -1.629  -4.458   2.087
  596   2HG1  ILE  78          2HG1      ILE  78  -0.488  -3.300   1.414
  597   1HG2  ILE  78          1HG2      ILE  78   0.279  -3.411   3.990
  598   2HG2  ILE  78          2HG2      ILE  78  -0.787  -4.794   4.237
  599   3HG2  ILE  78          3HG2      ILE  78   0.941  -4.945   4.558
  600   1HD1  ILE  78          1HD1      ILE  78  -1.012  -6.072   0.372
  601   2HD1  ILE  78          2HD1      ILE  78  -1.595  -4.563  -0.329
  602   3HD1  ILE  78          3HD1      ILE  78   0.132  -4.913  -0.305
  603    H    TYR  79           H        TYR  79   3.537  -2.915   2.971
  604    HA   TYR  79           HA       TYR  79   4.847  -4.939   4.624
  605   1HB   TYR  79          1HB       TYR  79   6.402  -3.568   3.456
  606   2HB   TYR  79          2HB       TYR  79   5.539  -2.096   3.882
  607    HD1  TYR  79           HD1      TYR  79   6.204  -0.845   5.722
  608    HD2  TYR  79           HD2      TYR  79   7.502  -4.884   5.400
  609    HE1  TYR  79           HE1      TYR  79   7.677  -0.517   7.658
  610    HE2  TYR  79           HE2      TYR  79   8.981  -4.565   7.342
  611    HH   TYR  79           HH       TYR  79   8.775  -1.835   9.381
  612    H    LYS  80           H        LYS  80   4.325  -5.175   6.695
  613    HA   LYS  80           HA       LYS  80   2.345  -3.460   7.850
  614   1HB   LYS  80          1HB       LYS  80   3.875  -5.738   9.121
  615   2HB   LYS  80          2HB       LYS  80   2.424  -4.976   9.765
  616   1HG   LYS  80          1HG       LYS  80   1.205  -5.702   7.731
  617   2HG   LYS  80          2HG       LYS  80   2.651  -6.573   7.223
  618   1HD   LYS  80          1HD       LYS  80   2.534  -7.874   9.344
  619   2HD   LYS  80          2HD       LYS  80   1.000  -7.074   9.700
  620   1HE   LYS  80          1HE       LYS  80   0.127  -7.943   7.533
  621   2HE   LYS  80          2HE       LYS  80   1.624  -8.851   7.344
  622   1HZ   LYS  80          1HZ       LYS  80   0.033 -10.317   8.238
  623   2HZ   LYS  80          2HZ       LYS  80   1.068  -9.933   9.522
  624   3HZ   LYS  80          3HZ       LYS  80  -0.465  -9.207   9.421
  625    H    MET  81           H        MET  81   3.214  -1.472   8.063
  626    HA   MET  81           HA       MET  81   5.641  -0.698   9.124
  627   1HB   MET  81          1HB       MET  81   4.053   0.831   8.043
  628   2HB   MET  81          2HB       MET  81   2.952   0.660   9.400
  629   1HG   MET  81          1HG       MET  81   4.749   1.633  10.852
  630   2HG   MET  81          2HG       MET  81   5.643   1.990   9.374
  631   1HE   MET  81          1HE       MET  81   3.120   4.403   7.532
  632   2HE   MET  81          2HE       MET  81   3.165   2.645   7.399
  633   3HE   MET  81          3HE       MET  81   4.670   3.566   7.421
  634    H    GLU  82           H        GLU  82   2.628  -0.370  10.961
  635    HA   GLU  82           HA       GLU  82   3.892  -1.709  13.243
  636   1HB   GLU  82          1HB       GLU  82   3.901   0.926  13.280
  637   2HB   GLU  82          2HB       GLU  82   2.205   0.731  13.696
  638   1HG   GLU  82          1HG       GLU  82   3.438   0.989  15.709
  639   2HG   GLU  82          2HG       GLU  82   2.903  -0.688  15.614
  640    H    GLY  83           H        GLY  83   1.633  -1.827  11.051
  641   1HA   GLY  83          1HA       GLY  83  -0.665  -2.351  12.786
  642   2HA   GLY  83          2HA       GLY  83  -0.717  -2.139  11.042
  643    H    CYS  84           H        CYS  84   0.071  -4.319  13.636
  644    HA   CYS  84           HA       CYS  84  -0.564  -6.561  11.878
  645   1HB   CYS  84          1HB       CYS  84   1.355  -7.848  12.921
  646   2HB   CYS  84          2HB       CYS  84   1.824  -6.583  11.791
  647    HG   CYS  84           HG       CYS  84   3.250  -5.181  13.407
  648    H    ASN  85           H        ASN  85  -2.059  -5.200  13.853
  649    HA   ASN  85           HA       ASN  85  -1.904  -6.620  16.349
  650   1HB   ASN  85          1HB       ASN  85  -2.673  -4.183  15.969
  651   2HB   ASN  85          2HB       ASN  85  -4.203  -4.887  15.461
  652   1HD2  ASN  85          2HD2      ASN  85  -3.820  -7.115  17.446
  653   2HD2  ASN  85          1HD2      ASN  85  -4.231  -6.408  18.973
  Start of MODEL    3
    1    H    MET   1           H        MET   1  12.863  -0.790 -10.602
    2    HA   MET   1           HA       MET   1  10.491   0.862 -11.228
    3   1HB   MET   1          1HB       MET   1  10.015  -1.566 -11.320
    4   2HB   MET   1          2HB       MET   1  10.667  -1.741  -9.696
    5   1HG   MET   1          1HG       MET   1   8.908  -0.352  -8.798
    6   2HG   MET   1          2HG       MET   1   8.287  -0.044 -10.419
    7   1HE   MET   1          1HE       MET   1   8.702  -2.661  -7.532
    8   2HE   MET   1          2HE       MET   1   9.650  -3.381  -8.834
    9   3HE   MET   1          3HE       MET   1   8.150  -4.147  -8.308
   10    H    GLN   2           H        GLN   2  10.095   2.378  -9.775
   11    HA   GLN   2           HA       GLN   2  11.651   2.352  -7.277
   12   1HB   GLN   2          1HB       GLN   2  10.224   4.625  -8.674
   13   2HB   GLN   2          2HB       GLN   2  11.131   4.767  -7.172
   14   1HG   GLN   2          1HG       GLN   2  13.173   4.144  -8.314
   15   2HG   GLN   2          2HG       GLN   2  12.284   3.901  -9.816
   16   1HE2  GLN   2          2HE2      GLN   2  11.606   6.507  -7.604
   17   2HE2  GLN   2          1HE2      GLN   2  12.182   7.786  -8.623
   18    H    ILE   3           H        ILE   3  10.649   2.215  -5.344
   19    HA   ILE   3           HA       ILE   3   7.869   1.455  -5.421
   20    HB   ILE   3           HB       ILE   3   8.174   1.048  -2.954
   21   1HG1  ILE   3          1HG1      ILE   3  11.079   1.563  -3.626
   22   2HG1  ILE   3          2HG1      ILE   3  10.072   2.605  -2.627
   23   1HG2  ILE   3          1HG2      ILE   3   9.458  -0.996  -3.309
   24   2HG2  ILE   3          2HG2      ILE   3   8.304  -0.718  -4.613
   25   3HG2  ILE   3          3HG2      ILE   3  10.017  -0.374  -4.862
   26   1HD1  ILE   3          1HD1      ILE   3  11.515   1.219  -1.264
   27   2HD1  ILE   3          2HD1      ILE   3   9.823   0.795  -1.004
   28   3HD1  ILE   3          3HD1      ILE   3  10.849  -0.236  -2.006
   29    H    HIS   4           H        HIS   4   6.210   2.639  -4.976
   30    HA   HIS   4           HA       HIS   4   6.561   5.317  -3.886
   31   1HB   HIS   4          1HB       HIS   4   4.091   3.906  -4.931
   32   2HB   HIS   4          2HB       HIS   4   4.154   5.584  -4.414
   33    HD1  HIS   4           HD1      HIS   4   3.809   6.838  -6.532
   34    HD2  HIS   4           HD2      HIS   4   6.624   3.812  -6.952
   35    HE1  HIS   4           HE1      HIS   4   4.744   7.098  -8.853
   36    HE2  HIS   4           HE2      HIS   4   6.302   5.135  -9.146
   37    H    VAL   5           H        VAL   5   6.398   5.658  -1.780
   38    HA   VAL   5           HA       VAL   5   5.361   3.530  -0.090
   39    HB   VAL   5           HB       VAL   5   6.728   6.097   0.733
   40   1HG1  VAL   5          1HG1      VAL   5   6.184   3.555   2.266
   41   2HG1  VAL   5          2HG1      VAL   5   7.103   4.939   2.860
   42   3HG1  VAL   5          3HG1      VAL   5   5.384   5.109   2.505
   43   1HG2  VAL   5          1HG2      VAL   5   7.881   3.337   0.326
   44   2HG2  VAL   5          2HG2      VAL   5   8.225   4.772  -0.639
   45   3HG2  VAL   5          3HG2      VAL   5   8.735   4.702   1.048
   46    H    TYR   6           H        TYR   6   3.218   3.581   0.118
   47    HA   TYR   6           HA       TYR   6   1.938   6.146   0.764
   48   1HB   TYR   6          1HB       TYR   6   0.690   3.515  -0.076
   49   2HB   TYR   6          2HB       TYR   6  -0.205   4.979   0.314
   50    HD1  TYR   6           HD1      TYR   6   2.087   3.419  -2.113
   51    HD2  TYR   6           HD2      TYR   6  -0.422   6.752  -1.286
   52    HE1  TYR   6           HE1      TYR   6   2.242   4.112  -4.461
   53    HE2  TYR   6           HE2      TYR   6  -0.269   7.457  -3.640
   54    HH   TYR   6           HH       TYR   6   0.964   5.438  -6.081
   55    H    ASP   7           H        ASP   7   2.439   6.332   2.925
   56    HA   ASP   7           HA       ASP   7   2.163   4.342   4.879
   57   1HB   ASP   7          1HB       ASP   7   1.863   7.347   5.075
   58   2HB   ASP   7          2HB       ASP   7   1.950   6.270   6.457
   59    H    THR   8           H        THR   8   0.332   3.219   5.181
   60    HA   THR   8           HA       THR   8  -2.215   4.620   4.753
   61    HB   THR   8           HB       THR   8  -1.746   1.636   4.758
   62    HG1  THR   8           HG1      THR   8  -0.652   3.037   3.056
   63   1HG2  THR   8          1HG2      THR   8  -4.066   2.301   5.134
   64   2HG2  THR   8          2HG2      THR   8  -4.011   3.337   3.707
   65   3HG2  THR   8          3HG2      THR   8  -3.877   1.587   3.531
   66    H    TYR   9           H        TYR   9  -3.340   5.129   6.468
   67    HA   TYR   9           HA       TYR   9  -2.969   3.586   8.953
   68   1HB   TYR   9          1HB       TYR   9  -4.069   6.391   8.762
   69   2HB   TYR   9          2HB       TYR   9  -3.483   5.554  10.195
   70    HD1  TYR   9           HD1      TYR   9  -0.984   4.989  10.286
   71    HD2  TYR   9           HD2      TYR   9  -2.642   7.760   7.525
   72    HE1  TYR   9           HE1      TYR   9   1.235   5.985   9.971
   73    HE2  TYR   9           HE2      TYR   9  -0.425   8.769   7.194
   74    HH   TYR   9           HH       TYR   9   2.436   7.310   8.238
   75    H    VAL  10           H        VAL  10  -4.565   2.040   8.197
   76    HA   VAL  10           HA       VAL  10  -7.250   2.952   7.663
   77    HB   VAL  10           HB       VAL  10  -6.230   0.139   8.115
   78   1HG1  VAL  10          1HG1      VAL  10  -8.340  -0.562   7.056
   79   2HG1  VAL  10          2HG1      VAL  10  -8.607   0.289   8.577
   80   3HG1  VAL  10          3HG1      VAL  10  -8.874   1.118   7.043
   81   1HG2  VAL  10          1HG2      VAL  10  -5.230   1.179   6.153
   82   2HG2  VAL  10          2HG2      VAL  10  -6.382  -0.067   5.673
   83   3HG2  VAL  10          3HG2      VAL  10  -6.828   1.636   5.564
   84    H    LYS  11           H        LYS  11  -8.675   3.471   9.159
   85    HA   LYS  11           HA       LYS  11  -8.093   2.789  11.929
   86   1HB   LYS  11          1HB       LYS  11 -10.293   4.613  10.967
   87   2HB   LYS  11          2HB       LYS  11  -9.509   4.584  12.542
   88   1HG   LYS  11          1HG       LYS  11  -7.390   5.275  11.403
   89   2HG   LYS  11          2HG       LYS  11  -8.332   5.507   9.932
   90   1HD   LYS  11          1HD       LYS  11  -9.789   7.083  11.252
   91   2HD   LYS  11          2HD       LYS  11  -8.596   6.974  12.548
   92   1HE   LYS  11          1HE       LYS  11  -8.254   8.099   9.780
   93   2HE   LYS  11          2HE       LYS  11  -8.026   8.910  11.328
   94   1HZ   LYS  11          1HZ       LYS  11  -6.109   7.457  11.740
   95   2HZ   LYS  11          2HZ       LYS  11  -6.314   6.757  10.212
   96   3HZ   LYS  11          3HZ       LYS  11  -5.903   8.394  10.340
   97    H    ALA  12           H        ALA  12  -8.733   0.675  12.097
   98    HA   ALA  12           HA       ALA  12 -11.284  -0.237  11.165
   99   1HB   ALA  12          1HB       ALA  12  -9.314  -1.560  13.024
  100   2HB   ALA  12          2HB       ALA  12 -10.692  -2.343  12.250
  101   3HB   ALA  12          3HB       ALA  12  -9.357  -1.738  11.271
  102    H    LYS  13           H        LYS  13 -13.158  -0.319  12.213
  103    HA   LYS  13           HA       LYS  13 -13.670   1.327  14.393
  104   1HB   LYS  13          1HB       LYS  13 -15.309  -1.016  13.408
  105   2HB   LYS  13          2HB       LYS  13 -15.894   0.279  14.443
  106   1HG   LYS  13          1HG       LYS  13 -14.856   0.664  11.643
  107   2HG   LYS  13          2HG       LYS  13 -16.560   0.526  12.083
  108   1HD   LYS  13          1HD       LYS  13 -16.355   2.506  13.502
  109   2HD   LYS  13          2HD       LYS  13 -14.649   2.640  13.071
  110   1HE   LYS  13          1HE       LYS  13 -15.229   3.020  10.755
  111   2HE   LYS  13          2HE       LYS  13 -16.938   2.769  11.110
  112   1HZ   LYS  13          1HZ       LYS  13 -16.858   4.719  12.562
  113   2HZ   LYS  13          2HZ       LYS  13 -15.238   4.977  12.144
  114   3HZ   LYS  13          3HZ       LYS  13 -16.448   5.105  10.964
  115    H    ASP  14           H        ASP  14 -13.964  -2.224  14.396
  116    HA   ASP  14           HA       ASP  14 -13.371  -2.159  17.273
  117   1HB   ASP  14          1HB       ASP  14 -14.841  -4.235  15.634
  118   2HB   ASP  14          2HB       ASP  14 -14.441  -4.418  17.341
  119    H    GLY  15           H        GLY  15 -11.203  -1.829  15.922
  120   1HA   GLY  15          1HA       GLY  15  -9.799  -4.347  16.363
  121   2HA   GLY  15          2HA       GLY  15  -9.639  -3.616  14.770
  122    H    HIS  16           H        HIS  16  -8.331  -1.892  14.488
  123    HA   HIS  16           HA       HIS  16  -7.336  -0.242  16.559
  124   1HB   HIS  16          1HB       HIS  16  -4.913  -1.003  16.335
  125   2HB   HIS  16          2HB       HIS  16  -5.965  -2.061  17.268
  126    HD1  HIS  16           HD1      HIS  16  -5.921  -4.457  16.637
  127    HD2  HIS  16           HD2      HIS  16  -4.520  -2.023  13.569
  128    HE1  HIS  16           HE1      HIS  16  -5.139  -6.020  14.834
  129    HE2  HIS  16           HE2      HIS  16  -4.568  -4.526  12.885
  130    H    VAL  17           H        VAL  17  -5.520   1.185  15.664
  131    HA   VAL  17           HA       VAL  17  -6.141   1.887  12.947
  132    HB   VAL  17           HB       VAL  17  -3.933   2.959  14.718
  133   1HG1  VAL  17          1HG1      VAL  17  -5.081   4.009  12.130
  134   2HG1  VAL  17          2HG1      VAL  17  -3.935   4.871  13.157
  135   3HG1  VAL  17          3HG1      VAL  17  -3.456   3.364  12.375
  136   1HG2  VAL  17          1HG2      VAL  17  -5.442   4.862  15.084
  137   2HG2  VAL  17          2HG2      VAL  17  -6.697   4.038  14.160
  138   3HG2  VAL  17          3HG2      VAL  17  -6.131   3.354  15.684
  139    H    MET  18           H        MET  18  -5.509   0.567  11.430
  140    HA   MET  18           HA       MET  18  -3.260  -1.156  11.640
  141   1HB   MET  18          1HB       MET  18  -4.933  -0.419   9.229
  142   2HB   MET  18          2HB       MET  18  -3.823  -1.781   9.327
  143   1HG   MET  18          1HG       MET  18  -5.175  -2.875  10.942
  144   2HG   MET  18          2HG       MET  18  -6.180  -1.445  11.158
  145   1HE   MET  18          1HE       MET  18  -6.178  -4.053   7.353
  146   2HE   MET  18          2HE       MET  18  -5.229  -4.424   8.792
  147   3HE   MET  18          3HE       MET  18  -4.828  -3.015   7.811
  148    H    HIS  19           H        HIS  19  -1.372  -0.098  11.848
  149    HA   HIS  19           HA       HIS  19  -0.630   2.001   9.975
  150   1HB   HIS  19          1HB       HIS  19   0.822   0.783  12.332
  151   2HB   HIS  19          2HB       HIS  19   1.500   2.043  11.313
  152    HD1  HIS  19           HD1      HIS  19  -0.069   1.690  14.449
  153    HD2  HIS  19           HD2      HIS  19  -0.445   4.397  11.313
  154    HE1  HIS  19           HE1      HIS  19  -1.124   3.738  15.442
  155    HE2  HIS  19           HE2      HIS  19  -1.085   5.443  13.589
  156    H    PHE  20           H        PHE  20  -0.176   1.170   7.992
  157    HA   PHE  20           HA       PHE  20   2.151  -0.549   7.836
  158   1HB   PHE  20          1HB       PHE  20   1.096  -2.162   6.309
  159   2HB   PHE  20          2HB       PHE  20   0.336  -2.178   7.895
  160    HD1  PHE  20           HD1      PHE  20  -1.921  -1.272   8.195
  161    HD2  PHE  20           HD2      PHE  20  -0.104  -1.497   4.355
  162    HE1  PHE  20           HE1      PHE  20  -4.123  -0.988   7.139
  163    HE2  PHE  20           HE2      PHE  20  -2.303  -1.209   3.293
  164    HZ   PHE  20           HZ       PHE  20  -4.316  -0.954   4.686
  165    H    ASP  21           H        ASP  21   3.057  -0.678   5.690
  166    HA   ASP  21           HA       ASP  21   2.538   1.790   4.180
  167   1HB   ASP  21          1HB       ASP  21   4.920  -0.072   3.985
  168   2HB   ASP  21          2HB       ASP  21   4.761   1.509   3.236
  169    H    VAL  22           H        VAL  22   1.586   1.665   2.228
  170    HA   VAL  22           HA       VAL  22   1.447  -0.952   0.919
  171    HB   VAL  22           HB       VAL  22  -0.018   1.622   0.290
  172   1HG1  VAL  22          1HG1      VAL  22  -1.310   0.279  -1.320
  173   2HG1  VAL  22          2HG1      VAL  22   0.396   0.380  -1.763
  174   3HG1  VAL  22          3HG1      VAL  22  -0.237  -1.090  -1.021
  175   1HG2  VAL  22          1HG2      VAL  22  -0.993  -1.004   1.412
  176   2HG2  VAL  22          2HG2      VAL  22  -0.792   0.500   2.315
  177   3HG2  VAL  22          3HG2      VAL  22  -1.996   0.398   1.031
  178    H    PHE  23           H        PHE  23   3.283  -1.321  -0.148
  179    HA   PHE  23           HA       PHE  23   4.583   0.808  -1.642
  180   1HB   PHE  23          1HB       PHE  23   5.299  -2.098  -1.206
  181   2HB   PHE  23          2HB       PHE  23   6.242  -1.003  -2.209
  182    HD1  PHE  23           HD1      PHE  23   5.541  -2.130   1.131
  183    HD2  PHE  23           HD2      PHE  23   7.321   0.987  -1.152
  184    HE1  PHE  23           HE1      PHE  23   6.802  -1.404   3.113
  185    HE2  PHE  23           HE2      PHE  23   8.584   1.719   0.827
  186    HZ   PHE  23           HZ       PHE  23   8.326   0.522   2.963
  187    H    THR  24           H        THR  24   3.922   1.284  -3.602
  188    HA   THR  24           HA       THR  24   3.217  -0.910  -5.428
  189    HB   THR  24           HB       THR  24   1.515   0.758  -6.438
  190    HG1  THR  24           HG1      THR  24   1.490   1.717  -3.763
  191   1HG2  THR  24          1HG2      THR  24  -0.283  -0.046  -4.994
  192   2HG2  THR  24          2HG2      THR  24   0.856  -1.341  -5.364
  193   3HG2  THR  24          3HG2      THR  24   0.902  -0.550  -3.789
  194    H    ASP  25           H        ASP  25   3.492  -0.358  -7.690
  195    HA   ASP  25           HA       ASP  25   5.475   1.714  -8.171
  196   1HB   ASP  25          1HB       ASP  25   5.849  -0.351  -9.342
  197   2HB   ASP  25          2HB       ASP  25   4.200  -0.362  -9.959
  198    H    VAL  26           H        VAL  26   2.108   1.156  -8.451
  199    HA   VAL  26           HA       VAL  26   1.457   2.925 -10.533
  200    HB   VAL  26           HB       VAL  26  -0.319   2.146  -8.219
  201   1HG1  VAL  26          1HG1      VAL  26  -0.933   3.047 -11.028
  202   2HG1  VAL  26          2HG1      VAL  26  -2.125   2.469  -9.864
  203   3HG1  VAL  26          3HG1      VAL  26  -1.227   3.952  -9.543
  204   1HG2  VAL  26          1HG2      VAL  26  -1.064   0.281  -9.618
  205   2HG2  VAL  26          2HG2      VAL  26   0.140   0.712 -10.832
  206   3HG2  VAL  26          3HG2      VAL  26   0.655   0.156  -9.240
  207    H    ARG  27           H        ARG  27   1.352   5.044 -10.615
  208    HA   ARG  27           HA       ARG  27   1.782   6.577  -8.167
  209   1HB   ARG  27          1HB       ARG  27   2.264   8.454  -9.791
  210   2HB   ARG  27          2HB       ARG  27   3.364   7.084  -9.884
  211   1HG   ARG  27          1HG       ARG  27   2.131   6.228 -11.815
  212   2HG   ARG  27          2HG       ARG  27   1.041   7.612 -11.725
  213   1HD   ARG  27          1HD       ARG  27   2.864   9.124 -12.182
  214   2HD   ARG  27          2HD       ARG  27   4.019   7.792 -12.148
  215    HE   ARG  27           HE       ARG  27   2.070   7.207 -14.066
  216   1HH1  ARG  27          1HH1      ARG  27   4.640   9.526 -13.529
  217   2HH1  ARG  27          2HH1      ARG  27   4.965   9.755 -15.217
  218   1HH2  ARG  27          1HH2      ARG  27   2.500   7.498 -16.292
  219   2HH2  ARG  27          2HH2      ARG  27   3.750   8.597 -16.788
  220    H    ASP  28           H        ASP  28  -0.791   5.413  -9.089
  221    HA   ASP  28           HA       ASP  28  -2.378   7.863  -9.415
  222   1HB   ASP  28          1HB       ASP  28  -2.626   6.079 -11.166
  223   2HB   ASP  28          2HB       ASP  28  -3.257   5.012  -9.915
  224    H    ASP  29           H        ASP  29  -3.647   8.506  -7.792
  225    HA   ASP  29           HA       ASP  29  -3.301   7.340  -5.247
  226   1HB   ASP  29          1HB       ASP  29  -4.687   9.079  -4.390
  227   2HB   ASP  29          2HB       ASP  29  -3.739   9.774  -5.699
  228    H    LYS  30           H        LYS  30  -5.813   6.971  -7.648
  229    HA   LYS  30           HA       LYS  30  -7.691   5.793  -5.826
  230   1HB   LYS  30          1HB       LYS  30  -8.580   6.888  -7.769
  231   2HB   LYS  30          2HB       LYS  30  -7.595   5.905  -8.843
  232   1HG   LYS  30          1HG       LYS  30  -9.939   5.208  -8.843
  233   2HG   LYS  30          2HG       LYS  30  -8.872   3.930  -8.259
  234   1HD   LYS  30          1HD       LYS  30  -9.450   4.529  -5.947
  235   2HD   LYS  30          2HD       LYS  30 -10.541   5.776  -6.552
  236   1HE   LYS  30          1HE       LYS  30 -10.781   2.823  -7.126
  237   2HE   LYS  30          2HE       LYS  30 -11.717   3.700  -5.918
  238   1HZ   LYS  30          1HZ       LYS  30 -11.788   4.093  -8.859
  239   2HZ   LYS  30          2HZ       LYS  30 -13.027   3.484  -7.880
  240   3HZ   LYS  30          3HZ       LYS  30 -12.566   5.113  -7.752
  241    H    LYS  31           H        LYS  31  -5.517   4.554  -8.340
  242    HA   LYS  31           HA       LYS  31  -6.378   1.875  -8.044
  243   1HB   LYS  31          1HB       LYS  31  -5.326   2.809 -10.088
  244   2HB   LYS  31          2HB       LYS  31  -3.793   2.870  -9.232
  245   1HG   LYS  31          1HG       LYS  31  -3.503   0.609  -9.298
  246   2HG   LYS  31          2HG       LYS  31  -5.236   0.277  -9.345
  247   1HD   LYS  31          1HD       LYS  31  -3.969   1.677 -11.651
  248   2HD   LYS  31          2HD       LYS  31  -3.728  -0.061 -11.474
  249   1HE   LYS  31          1HE       LYS  31  -5.647   0.478 -12.925
  250   2HE   LYS  31          2HE       LYS  31  -6.117  -0.439 -11.499
  251   1HZ   LYS  31          1HZ       LYS  31  -6.346   2.516 -11.650
  252   2HZ   LYS  31          2HZ       LYS  31  -7.594   1.472 -12.116
  253   3HZ   LYS  31          3HZ       LYS  31  -7.048   1.469 -10.512
  254    H    ALA  32           H        ALA  32  -3.743   3.718  -6.588
  255    HA   ALA  32           HA       ALA  32  -2.465   1.625  -5.241
  256   1HB   ALA  32          1HB       ALA  32  -1.658   3.320  -3.691
  257   2HB   ALA  32          2HB       ALA  32  -1.571   3.906  -5.352
  258   3HB   ALA  32          3HB       ALA  32  -2.864   4.460  -4.289
  259    H    ILE  33           H        ILE  33  -5.258   3.605  -4.317
  260    HA   ILE  33           HA       ILE  33  -5.716   2.384  -1.812
  261    HB   ILE  33           HB       ILE  33  -7.602   3.837  -3.671
  262   1HG1  ILE  33          1HG1      ILE  33  -6.249   4.675  -1.102
  263   2HG1  ILE  33          2HG1      ILE  33  -5.750   5.160  -2.717
  264   1HG2  ILE  33          1HG2      ILE  33  -8.083   2.965  -0.823
  265   2HG2  ILE  33          2HG2      ILE  33  -9.146   4.001  -1.776
  266   3HG2  ILE  33          3HG2      ILE  33  -8.888   2.324  -2.256
  267   1HD1  ILE  33          1HD1      ILE  33  -6.996   6.915  -1.595
  268   2HD1  ILE  33          2HD1      ILE  33  -7.860   6.335  -3.021
  269   3HD1  ILE  33          3HD1      ILE  33  -8.376   5.830  -1.411
  270    H    GLU  34           H        GLU  34  -6.867   1.680  -5.074
  271    HA   GLU  34           HA       GLU  34  -8.746  -0.278  -4.473
  272   1HB   GLU  34          1HB       GLU  34  -6.900  -0.132  -6.861
  273   2HB   GLU  34          2HB       GLU  34  -8.322  -1.161  -6.749
  274   1HG   GLU  34          1HG       GLU  34  -9.721   0.849  -6.492
  275   2HG   GLU  34          2HG       GLU  34  -8.283   1.848  -6.693
  276    H    PHE  35           H        PHE  35  -5.243  -0.648  -5.047
  277    HA   PHE  35           HA       PHE  35  -5.217  -3.451  -4.675
  278   1HB   PHE  35          1HB       PHE  35  -3.050  -1.368  -4.487
  279   2HB   PHE  35          2HB       PHE  35  -2.731  -3.077  -4.208
  280    HD1  PHE  35           HD1      PHE  35  -3.848  -4.617  -6.142
  281    HD2  PHE  35           HD2      PHE  35  -2.533  -0.595  -6.578
  282    HE1  PHE  35           HE1      PHE  35  -3.567  -4.978  -8.557
  283    HE2  PHE  35           HE2      PHE  35  -2.254  -0.946  -8.997
  284    HZ   PHE  35           HZ       PHE  35  -2.771  -3.139  -9.989
  285    H    ALA  36           H        ALA  36  -4.898  -0.755  -2.444
  286    HA   ALA  36           HA       ALA  36  -4.216  -2.258  -0.148
  287   1HB   ALA  36          1HB       ALA  36  -3.984   0.177  -0.255
  288   2HB   ALA  36          2HB       ALA  36  -5.739   0.342  -0.320
  289   3HB   ALA  36          3HB       ALA  36  -4.967  -0.317   1.123
  290    H    LYS  37           H        LYS  37  -7.318  -1.285  -1.551
  291    HA   LYS  37           HA       LYS  37  -8.902  -2.435   0.518
  292   1HB   LYS  37          1HB       LYS  37  -9.668  -1.691  -2.311
  293   2HB   LYS  37          2HB       LYS  37 -10.798  -2.093  -1.023
  294   1HG   LYS  37          1HG       LYS  37  -9.922  -0.177   0.275
  295   2HG   LYS  37          2HG       LYS  37  -8.923   0.256  -1.111
  296   1HD   LYS  37          1HD       LYS  37 -10.900   1.609  -1.157
  297   2HD   LYS  37          2HD       LYS  37 -11.001   0.438  -2.472
  298   1HE   LYS  37          1HE       LYS  37 -12.518  -0.930  -1.206
  299   2HE   LYS  37          2HE       LYS  37 -12.311   0.087   0.219
  300   1HZ   LYS  37          1HZ       LYS  37 -13.545   0.922  -2.352
  301   2HZ   LYS  37          2HZ       LYS  37 -14.374   0.592  -0.913
  302   3HZ   LYS  37          3HZ       LYS  37 -13.320   1.923  -1.000
  303    H    GLN  38           H        GLN  38  -7.510  -3.647  -2.438
  304    HA   GLN  38           HA       GLN  38  -8.930  -6.049  -2.688
  305   1HB   GLN  38          1HB       GLN  38  -6.031  -5.431  -3.289
  306   2HB   GLN  38          2HB       GLN  38  -6.816  -6.937  -3.735
  307   1HG   GLN  38          1HG       GLN  38  -7.707  -4.219  -4.654
  308   2HG   GLN  38          2HG       GLN  38  -6.660  -5.294  -5.575
  309   1HE2  GLN  38          2HE2      GLN  38  -7.506  -7.117  -6.517
  310   2HE2  GLN  38          1HE2      GLN  38  -9.211  -7.385  -6.679
  311    H    TRP  39           H        TRP  39  -6.106  -5.224  -0.726
  312    HA   TRP  39           HA       TRP  39  -5.854  -7.817   0.425
  313   1HB   TRP  39          1HB       TRP  39  -3.965  -6.256   0.310
  314   2HB   TRP  39          2HB       TRP  39  -4.807  -5.141   1.378
  315    HD1  TRP  39           HD1      TRP  39  -3.610  -8.837   1.545
  316    HE1  TRP  39           HE1      TRP  39  -2.718  -9.266   3.920
  317    HE3  TRP  39           HE3      TRP  39  -4.541  -4.251   3.601
  318    HZ2  TRP  39           HZ2      TRP  39  -2.441  -7.844   6.343
  319    HZ3  TRP  39           HZ3      TRP  39  -3.928  -3.865   5.952
  320    HH2  TRP  39           HH2      TRP  39  -2.899  -5.627   7.293
  321    H    LEU  40           H        LEU  40  -7.393  -4.795   1.437
  322    HA   LEU  40           HA       LEU  40  -8.189  -5.578   4.000
  323   1HB   LEU  40          1HB       LEU  40  -9.494  -3.665   2.069
  324   2HB   LEU  40          2HB       LEU  40  -9.971  -3.840   3.748
  325    HG   LEU  40           HG       LEU  40  -7.259  -2.920   2.785
  326   1HD1  LEU  40          1HD1      LEU  40  -9.536  -1.399   4.046
  327   2HD1  LEU  40          2HD1      LEU  40  -7.939  -0.748   3.685
  328   3HD1  LEU  40          3HD1      LEU  40  -8.996  -1.266   2.372
  329   1HD2  LEU  40          1HD2      LEU  40  -6.866  -2.392   5.150
  330   2HD2  LEU  40          2HD2      LEU  40  -8.410  -3.135   5.564
  331   3HD2  LEU  40          3HD2      LEU  40  -7.111  -4.119   4.894
  332    H    SER  41           H        SER  41  -9.910  -5.895   0.902
  333    HA   SER  41           HA       SER  41 -12.203  -7.110   2.049
  334   1HB   SER  41          1HB       SER  41 -12.641  -7.833  -0.360
  335   2HB   SER  41          2HB       SER  41 -12.500  -6.099  -0.069
  336    HG   SER  41           HG       SER  41 -10.437  -6.136  -0.909
  337    H    SER  42           H        SER  42  -9.093  -8.306   1.136
  338    HA   SER  42           HA       SER  42  -9.857 -11.063   1.000
  339   1HB   SER  42          1HB       SER  42  -7.149  -9.734   1.246
  340   2HB   SER  42          2HB       SER  42  -7.384 -11.469   1.031
  341    HG   SER  42           HG       SER  42  -7.847  -9.357  -0.769
  342    H    ILE  43           H        ILE  43  -8.614  -8.912   3.508
  343    HA   ILE  43           HA       ILE  43  -8.423 -11.122   5.393
  344    HB   ILE  43           HB       ILE  43  -7.664  -9.450   7.026
  345   1HG1  ILE  43          1HG1      ILE  43  -7.935  -7.463   4.757
  346   2HG1  ILE  43          2HG1      ILE  43  -8.977  -7.531   6.175
  347   1HG2  ILE  43          1HG2      ILE  43  -5.536  -8.906   5.940
  348   2HG2  ILE  43          2HG2      ILE  43  -6.039 -10.561   5.603
  349   3HG2  ILE  43          3HG2      ILE  43  -6.237  -9.311   4.376
  350   1HD1  ILE  43          1HD1      ILE  43  -7.072  -7.014   7.603
  351   2HD1  ILE  43          2HD1      ILE  43  -6.022  -6.961   6.187
  352   3HD1  ILE  43          3HD1      ILE  43  -7.312  -5.773   6.374
  353    H    GLY  44           H        GLY  44 -10.968  -9.839   4.154
  354   1HA   GLY  44          1HA       GLY  44 -13.166  -9.925   4.827
  355   2HA   GLY  44          2HA       GLY  44 -12.608 -10.503   6.386
  356    H    GLU  45           H        GLU  45 -11.281  -7.517   5.283
  357    HA   GLU  45           HA       GLU  45 -12.687  -6.181   7.462
  358   1HB   GLU  45          1HB       GLU  45 -10.134  -6.088   7.010
  359   2HB   GLU  45          2HB       GLU  45 -10.554  -4.921   5.762
  360   1HG   GLU  45          1HG       GLU  45  -9.910  -3.846   7.862
  361   2HG   GLU  45          2HG       GLU  45 -11.574  -3.475   7.409
  362    H    GLU  46           H        GLU  46 -12.955  -6.578   4.160
  363    HA   GLU  46           HA       GLU  46 -14.397  -5.778   2.606
  364   1HB   GLU  46          1HB       GLU  46 -15.601  -4.275   4.933
  365   2HB   GLU  46          2HB       GLU  46 -16.337  -4.456   3.347
  366   1HG   GLU  46          1HG       GLU  46 -16.437  -6.878   3.675
  367   2HG   GLU  46          2HG       GLU  46 -15.718  -6.682   5.274
  368    H    GLY  47           H        GLY  47 -15.607  -3.224   2.383
  369   1HA   GLY  47          1HA       GLY  47 -13.260  -1.723   1.535
  370   2HA   GLY  47          2HA       GLY  47 -14.928  -1.392   1.097
  371    H    ALA  48           H        ALA  48 -12.643  -1.253   3.769
  372    HA   ALA  48           HA       ALA  48 -14.189   0.428   5.431
  373   1HB   ALA  48          1HB       ALA  48 -11.189   0.110   5.348
  374   2HB   ALA  48          2HB       ALA  48 -12.131   0.792   6.674
  375   3HB   ALA  48          3HB       ALA  48 -12.305  -0.913   6.256
  376    H    THR  49           H        THR  49 -13.569   2.670   6.027
  377    HA   THR  49           HA       THR  49 -13.599   4.386   3.791
  378    HB   THR  49           HB       THR  49 -12.885   5.167   6.621
  379    HG1  THR  49           HG1      THR  49 -15.509   5.058   5.524
  380   1HG2  THR  49          1HG2      THR  49 -12.601   6.920   4.919
  381   2HG2  THR  49          2HG2      THR  49 -14.266   6.677   4.395
  382   3HG2  THR  49          3HG2      THR  49 -13.932   7.296   6.013
  383    H    VAL  50           H        VAL  50 -11.826   4.156   2.484
  384    HA   VAL  50           HA       VAL  50  -9.262   5.027   3.631
  385    HB   VAL  50           HB       VAL  50  -9.605   2.873   1.532
  386   1HG1  VAL  50          1HG1      VAL  50  -7.098   3.972   2.804
  387   2HG1  VAL  50          2HG1      VAL  50  -7.176   2.617   1.678
  388   3HG1  VAL  50          3HG1      VAL  50  -7.618   4.237   1.139
  389   1HG2  VAL  50          1HG2      VAL  50  -8.650   2.684   4.389
  390   2HG2  VAL  50          2HG2      VAL  50 -10.167   2.050   3.751
  391   3HG2  VAL  50          3HG2      VAL  50  -8.629   1.369   3.215
  392    H    THR  51           H        THR  51  -9.027   7.018   2.839
  393    HA   THR  51           HA       THR  51  -8.960   7.231  -0.093
  394    HB   THR  51           HB       THR  51 -10.938   8.463   0.675
  395    HG1  THR  51           HG1      THR  51  -9.646   9.310  -1.083
  396   1HG2  THR  51          1HG2      THR  51  -9.068  10.178   2.284
  397   2HG2  THR  51          2HG2      THR  51 -10.807  10.388   2.118
  398   3HG2  THR  51          3HG2      THR  51 -10.165   8.977   2.959
  399    H    SER  52           H        SER  52  -7.963   9.851  -0.100
  400    HA   SER  52           HA       SER  52  -5.222   9.398  -0.014
  401   1HB   SER  52          1HB       SER  52  -6.931  11.867  -0.142
  402   2HB   SER  52          2HB       SER  52  -5.169  11.926  -0.326
  403    HG   SER  52           HG       SER  52  -6.153   9.995  -1.894
  404    H    GLU  53           H        GLU  53  -7.314  10.249   2.577
  405    HA   GLU  53           HA       GLU  53  -5.305  11.528   4.184
  406   1HB   GLU  53          1HB       GLU  53  -8.090  10.540   4.805
  407   2HB   GLU  53          2HB       GLU  53  -7.062  11.367   5.957
  408   1HG   GLU  53          1HG       GLU  53  -8.124  12.484   3.378
  409   2HG   GLU  53          2HG       GLU  53  -8.643  12.909   5.009
  410    H    GLU  54           H        GLU  54  -6.603   8.331   3.725
  411    HA   GLU  54           HA       GLU  54  -5.387   7.280   6.127
  412   1HB   GLU  54          1HB       GLU  54  -6.917   6.011   3.861
  413   2HB   GLU  54          2HB       GLU  54  -6.145   5.055   5.116
  414   1HG   GLU  54          1HG       GLU  54  -8.505   5.366   5.577
  415   2HG   GLU  54          2HG       GLU  54  -7.514   6.142   6.809
  416    H    CYS  55           H        CYS  55  -4.958   6.841   2.617
  417    HA   CYS  55           HA       CYS  55  -2.299   5.725   3.156
  418   1HB   CYS  55          1HB       CYS  55  -2.388   5.069   0.724
  419   2HB   CYS  55          2HB       CYS  55  -3.617   4.312   1.735
  420    HG   CYS  55           HG       CYS  55  -4.045   6.843  -0.511
  421    H    ARG  56           H        ARG  56  -0.953   7.400   3.438
  422    HA   ARG  56           HA       ARG  56  -1.147   9.714   1.660
  423   1HB   ARG  56          1HB       ARG  56  -0.997  10.068   4.110
  424   2HB   ARG  56          2HB       ARG  56   0.581   9.294   4.102
  425   1HG   ARG  56          1HG       ARG  56   1.280  11.091   2.444
  426   2HG   ARG  56          2HG       ARG  56  -0.208  11.924   2.898
  427   1HD   ARG  56          1HD       ARG  56   2.065  11.142   4.713
  428   2HD   ARG  56          2HD       ARG  56   1.615  12.774   4.220
  429    HE   ARG  56           HE       ARG  56  -0.510  12.375   5.473
  430   1HH1  ARG  56          1HH1      ARG  56   2.357  10.521   6.234
  431   2HH1  ARG  56          2HH1      ARG  56   1.908  10.248   7.888
  432   1HH2  ARG  56          1HH2      ARG  56  -1.121  12.028   7.632
  433   2HH2  ARG  56          2HH2      ARG  56  -0.091  11.118   8.691
  434    H    PHE  57           H        PHE  57   0.085   9.777  -0.110
  435    HA   PHE  57           HA       PHE  57   2.429   8.157  -0.413
  436   1HB   PHE  57          1HB       PHE  57   1.097   8.728  -2.379
  437   2HB   PHE  57          2HB       PHE  57   1.365  10.443  -2.094
  438    HD1  PHE  57           HD1      PHE  57   3.082  11.513  -3.197
  439    HD2  PHE  57           HD2      PHE  57   3.250   7.290  -2.717
  440    HE1  PHE  57           HE1      PHE  57   5.100  11.440  -4.601
  441    HE2  PHE  57           HE2      PHE  57   5.269   7.210  -4.121
  442    HZ   PHE  57           HZ       PHE  57   6.196   9.285  -5.063
  443    H    CYS  58           H        CYS  58   4.007   8.639   1.015
  444    HA   CYS  58           HA       CYS  58   4.598  11.405   1.627
  445   1HB   CYS  58          1HB       CYS  58   5.887   8.858   2.617
  446   2HB   CYS  58          2HB       CYS  58   6.218  10.473   3.232
  447    HG   CYS  58           HG       CYS  58   4.001   8.362   4.251
  448    H    HIS  59           H        HIS  59   6.246   8.659   0.067
  449    HA   HIS  59           HA       HIS  59   7.750  10.398  -1.606
  450   1HB   HIS  59          1HB       HIS  59   9.988   9.963  -0.760
  451   2HB   HIS  59          2HB       HIS  59   9.018  10.726   0.487
  452    HD1  HIS  59           HD1      HIS  59   8.671   9.436   2.661
  453    HD2  HIS  59           HD2      HIS  59  10.629   7.233  -0.278
  454    HE1  HIS  59           HE1      HIS  59   9.484   7.343   3.802
  455    HE2  HIS  59           HE2      HIS  59  10.583   5.975   1.982
  456    H    SER  60           H        SER  60   9.656   9.114  -2.599
  457    HA   SER  60           HA       SER  60   9.044   6.241  -2.812
  458   1HB   SER  60          1HB       SER  60   9.966   8.039  -5.077
  459   2HB   SER  60          2HB       SER  60   9.643   6.308  -5.187
  460    HG   SER  60           HG       SER  60   7.571   7.806  -4.162
  461    H    GLU  61           H        GLU  61  10.947   4.911  -3.016
  462    HA   GLU  61           HA       GLU  61  13.483   6.286  -2.529
  463   1HB   GLU  61          1HB       GLU  61  13.907   4.876  -0.514
  464   2HB   GLU  61          2HB       GLU  61  12.607   6.041  -0.300
  465   1HG   GLU  61          1HG       GLU  61  10.962   4.283  -0.667
  466   2HG   GLU  61          2HG       GLU  61  12.258   3.111  -0.898
  467    H    LYS  62           H        LYS  62  15.183   4.385  -1.989
  468    HA   LYS  62           HA       LYS  62  15.467   2.860  -4.327
  469   1HB   LYS  62          1HB       LYS  62  17.388   3.422  -2.924
  470   2HB   LYS  62          2HB       LYS  62  16.740   2.443  -1.611
  471   1HG   LYS  62          1HG       LYS  62  16.914   0.455  -3.097
  472   2HG   LYS  62          2HG       LYS  62  17.720   1.477  -4.287
  473   1HD   LYS  62          1HD       LYS  62  19.514   1.931  -2.714
  474   2HD   LYS  62          2HD       LYS  62  18.690   0.983  -1.472
  475   1HE   LYS  62          1HE       LYS  62  18.842  -0.999  -2.945
  476   2HE   LYS  62          2HE       LYS  62  19.764  -0.038  -4.099
  477   1HZ   LYS  62          1HZ       LYS  62  21.211  -1.365  -2.709
  478   2HZ   LYS  62          2HZ       LYS  62  21.467   0.283  -2.409
  479   3HZ   LYS  62          3HZ       LYS  62  20.574  -0.652  -1.308
  480    H    ALA  63           H        ALA  63  14.608   1.000  -4.937
  481    HA   ALA  63           HA       ALA  63  12.802  -0.350  -3.109
  482   1HB   ALA  63          1HB       ALA  63  13.267  -0.790  -6.053
  483   2HB   ALA  63          2HB       ALA  63  11.966  -1.485  -5.084
  484   3HB   ALA  63          3HB       ALA  63  12.033   0.258  -5.353
  485    HA   PRO  64           HA       PRO  64  15.939  -3.546  -2.427
  486   1HB   PRO  64          1HB       PRO  64  13.881  -4.593  -0.610
  487   2HB   PRO  64          2HB       PRO  64  15.537  -4.097  -0.254
  488   1HG   PRO  64          1HG       PRO  64  13.409  -2.669   0.568
  489   2HG   PRO  64          2HG       PRO  64  14.943  -1.902   0.112
  490   1HD   PRO  64          1HD       PRO  64  12.405  -2.154  -1.462
  491   2HD   PRO  64          2HD       PRO  64  13.508  -0.769  -1.314
  492    H    ASP  65           H        ASP  65  15.954  -5.812  -2.852
  493    HA   ASP  65           HA       ASP  65  14.415  -6.558  -5.065
  494   1HB   ASP  65          1HB       ASP  65  16.671  -7.468  -4.435
  495   2HB   ASP  65          2HB       ASP  65  15.872  -8.444  -3.208
  496    H    GLU  66           H        GLU  66  13.952  -7.155  -1.647
  497    HA   GLU  66           HA       GLU  66  12.017  -9.136  -1.668
  498   1HB   GLU  66          1HB       GLU  66  12.280  -6.737   0.149
  499   2HB   GLU  66          2HB       GLU  66  11.178  -8.073   0.450
  500   1HG   GLU  66          1HG       GLU  66  14.169  -8.285   0.244
  501   2HG   GLU  66          2HG       GLU  66  13.240  -8.255   1.742
  502    H    VAL  67           H        VAL  67  11.499  -5.613  -1.848
  503    HA   VAL  67           HA       VAL  67   8.661  -5.926  -2.065
  504    HB   VAL  67           HB       VAL  67   8.537  -3.534  -2.340
  505   1HG1  VAL  67          1HG1      VAL  67   9.746  -2.800  -0.313
  506   2HG1  VAL  67          2HG1      VAL  67   8.866  -4.312  -0.085
  507   3HG1  VAL  67          3HG1      VAL  67  10.614  -4.336  -0.310
  508   1HG2  VAL  67          1HG2      VAL  67  11.540  -3.571  -2.607
  509   2HG2  VAL  67          2HG2      VAL  67  10.385  -3.216  -3.894
  510   3HG2  VAL  67          3HG2      VAL  67  10.528  -2.130  -2.512
  511    H    ILE  68           H        ILE  68  11.329  -5.706  -4.274
  512    HA   ILE  68           HA       ILE  68   9.938  -5.085  -6.634
  513    HB   ILE  68           HB       ILE  68  12.349  -6.884  -6.306
  514   1HG1  ILE  68          1HG1      ILE  68  12.745  -4.623  -5.452
  515   2HG1  ILE  68          2HG1      ILE  68  13.659  -4.899  -6.931
  516   1HG2  ILE  68          1HG2      ILE  68  12.781  -6.413  -8.677
  517   2HG2  ILE  68          2HG2      ILE  68  11.254  -7.265  -8.439
  518   3HG2  ILE  68          3HG2      ILE  68  11.257  -5.532  -8.770
  519   1HD1  ILE  68          1HD1      ILE  68  11.079  -3.366  -6.703
  520   2HD1  ILE  68          2HD1      ILE  68  12.692  -2.679  -6.890
  521   3HD1  ILE  68          3HD1      ILE  68  11.989  -3.640  -8.190
  522    H    GLU  69           H        GLU  69  10.667  -8.170  -5.072
  523    HA   GLU  69           HA       GLU  69   9.528  -9.901  -6.934
  524   1HB   GLU  69          1HB       GLU  69  10.941 -10.464  -4.890
  525   2HB   GLU  69          2HB       GLU  69   9.467 -10.309  -3.944
  526   1HG   GLU  69          1HG       GLU  69   9.714 -12.599  -4.366
  527   2HG   GLU  69          2HG       GLU  69   8.458 -12.046  -5.476
  528    H    ALA  70           H        ALA  70   8.081  -8.414  -4.059
  529    HA   ALA  70           HA       ALA  70   5.581  -9.662  -4.244
  530   1HB   ALA  70          1HB       ALA  70   6.374  -8.593  -2.210
  531   2HB   ALA  70          2HB       ALA  70   6.270  -7.012  -2.987
  532   3HB   ALA  70          3HB       ALA  70   4.804  -7.946  -2.690
  533    H    ILE  71           H        ILE  71   6.594  -6.425  -5.374
  534    HA   ILE  71           HA       ILE  71   4.012  -5.799  -6.418
  535    HB   ILE  71           HB       ILE  71   6.662  -4.497  -7.076
  536   1HG1  ILE  71          1HG1      ILE  71   4.609  -3.750  -4.981
  537   2HG1  ILE  71          2HG1      ILE  71   6.152  -4.529  -4.646
  538   1HG2  ILE  71          1HG2      ILE  71   4.937  -3.918  -8.681
  539   2HG2  ILE  71          2HG2      ILE  71   3.830  -3.497  -7.374
  540   3HG2  ILE  71          3HG2      ILE  71   5.284  -2.536  -7.643
  541   1HD1  ILE  71          1HD1      ILE  71   7.326  -2.574  -5.510
  542   2HD1  ILE  71          2HD1      ILE  71   5.781  -1.795  -5.850
  543   3HD1  ILE  71          3HD1      ILE  71   6.243  -2.148  -4.186
  544    H    LYS  72           H        LYS  72   6.671  -7.602  -7.598
  545    HA   LYS  72           HA       LYS  72   6.019  -7.297 -10.391
  546   1HB   LYS  72          1HB       LYS  72   8.333  -7.636  -9.687
  547   2HB   LYS  72          2HB       LYS  72   7.909  -9.180  -8.970
  548   1HG   LYS  72          1HG       LYS  72   7.558 -10.172 -11.087
  549   2HG   LYS  72          2HG       LYS  72   7.598  -8.606 -11.903
  550   1HD   LYS  72          1HD       LYS  72   9.695  -9.889 -12.185
  551   2HD   LYS  72          2HD       LYS  72   9.940  -8.340 -11.377
  552   1HE   LYS  72          1HE       LYS  72  11.241  -9.929 -10.198
  553   2HE   LYS  72          2HE       LYS  72   9.834  -9.587  -9.194
  554   1HZ   LYS  72          1HZ       LYS  72  10.527 -12.029 -10.663
  555   2HZ   LYS  72          2HZ       LYS  72   9.909 -11.855  -9.095
  556   3HZ   LYS  72          3HZ       LYS  72   8.885 -11.668 -10.439
  557    H    GLN  73           H        GLN  73   5.186  -9.482  -7.805
  558    HA   GLN  73           HA       GLN  73   3.937 -11.295  -9.751
  559   1HB   GLN  73          1HB       GLN  73   4.704 -11.731  -6.867
  560   2HB   GLN  73          2HB       GLN  73   3.785 -12.890  -7.816
  561   1HG   GLN  73          1HG       GLN  73   6.507 -11.901  -8.619
  562   2HG   GLN  73          2HG       GLN  73   6.255 -13.322  -7.611
  563   1HE2  GLN  73          2HE2      GLN  73   4.130 -12.450 -10.283
  564   2HE2  GLN  73          1HE2      GLN  73   4.568 -13.780 -11.296
  565    H    ASN  74           H        ASN  74   3.209  -9.286  -6.951
  566    HA   ASN  74           HA       ASN  74   0.395 -10.125  -7.126
  567   1HB   ASN  74          1HB       ASN  74   1.847  -8.602  -4.951
  568   2HB   ASN  74          2HB       ASN  74   0.135  -9.005  -4.923
  569   1HD2  ASN  74          2HD2      ASN  74   2.273  -9.742  -3.090
  570   2HD2  ASN  74          1HD2      ASN  74   2.282 -11.471  -3.037
  571    H    GLY  75           H        GLY  75   2.526  -7.458  -7.638
  572   1HA   GLY  75          1HA       GLY  75   2.014  -5.506  -8.840
  573   2HA   GLY  75          2HA       GLY  75   0.302  -5.824  -8.588
  574    H    TYR  76           H        TYR  76   1.337  -6.357  -5.666
  575    HA   TYR  76           HA       TYR  76   1.739  -3.629  -4.765
  576   1HB   TYR  76          1HB       TYR  76  -0.166  -3.741  -3.180
  577   2HB   TYR  76          2HB       TYR  76  -0.693  -3.763  -4.859
  578    HD1  TYR  76           HD1      TYR  76  -0.208  -5.856  -1.845
  579    HD2  TYR  76           HD2      TYR  76  -1.937  -5.604  -5.721
  580    HE1  TYR  76           HE1      TYR  76  -1.510  -7.888  -1.386
  581    HE2  TYR  76           HE2      TYR  76  -3.241  -7.640  -5.277
  582    HH   TYR  76           HH       TYR  76  -3.340  -9.107  -2.097
  583    H    PHE  77           H        PHE  77   2.382  -3.514  -2.528
  584    HA   PHE  77           HA       PHE  77   2.841  -6.073  -1.193
  585   1HB   PHE  77          1HB       PHE  77   4.969  -5.574  -2.277
  586   2HB   PHE  77          2HB       PHE  77   4.970  -3.956  -1.580
  587    HD1  PHE  77           HD1      PHE  77   6.363  -3.646   0.206
  588    HD2  PHE  77           HD2      PHE  77   4.601  -7.474  -0.372
  589    HE1  PHE  77           HE1      PHE  77   7.555  -4.487   2.185
  590    HE2  PHE  77           HE2      PHE  77   5.790  -8.324   1.608
  591    HZ   PHE  77           HZ       PHE  77   7.269  -6.830   2.889
  592    H    ILE  78           H        ILE  78   1.758  -5.914   0.639
  593    HA   ILE  78           HA       ILE  78   1.583  -3.346   2.018
  594    HB   ILE  78           HB       ILE  78   0.124  -5.962   2.368
  595   1HG1  ILE  78          1HG1      ILE  78  -1.874  -4.450   2.224
  596   2HG1  ILE  78          2HG1      ILE  78  -0.778  -3.114   1.896
  597   1HG2  ILE  78          1HG2      ILE  78  -0.997  -5.042   4.346
  598   2HG2  ILE  78          2HG2      ILE  78   0.732  -5.268   4.611
  599   3HG2  ILE  78          3HG2      ILE  78   0.090  -3.653   4.308
  600   1HD1  ILE  78          1HD1      ILE  78  -0.027  -4.254  -0.139
  601   2HD1  ILE  78          2HD1      ILE  78  -1.161  -5.563   0.194
  602   3HD1  ILE  78          3HD1      ILE  78  -1.763  -3.942  -0.146
  603    H    TYR  79           H        TYR  79   3.282  -2.903   3.260
  604    HA   TYR  79           HA       TYR  79   4.525  -5.074   4.790
  605   1HB   TYR  79          1HB       TYR  79   6.149  -3.734   3.637
  606   2HB   TYR  79          2HB       TYR  79   5.429  -2.242   4.236
  607    HD1  TYR  79           HD1      TYR  79   7.219  -5.311   5.346
  608    HD2  TYR  79           HD2      TYR  79   6.152  -1.296   6.256
  609    HE1  TYR  79           HE1      TYR  79   8.716  -5.361   7.296
  610    HE2  TYR  79           HE2      TYR  79   7.646  -1.331   8.208
  611    HH   TYR  79           HH       TYR  79   9.937  -3.817   8.725
  612    H    LYS  80           H        LYS  80   3.687  -5.440   6.707
  613    HA   LYS  80           HA       LYS  80   2.131  -3.509   8.107
  614   1HB   LYS  80          1HB       LYS  80   3.239  -6.197   8.924
  615   2HB   LYS  80          2HB       LYS  80   2.191  -5.223   9.954
  616   1HG   LYS  80          1HG       LYS  80   0.418  -5.322   8.329
  617   2HG   LYS  80          2HG       LYS  80   1.463  -6.173   7.192
  618   1HD   LYS  80          1HD       LYS  80   1.574  -8.082   8.662
  619   2HD   LYS  80          2HD       LYS  80   0.652  -7.219   9.899
  620   1HE   LYS  80          1HE       LYS  80  -1.285  -7.144   8.472
  621   2HE   LYS  80          2HE       LYS  80  -0.376  -7.849   7.136
  622   1HZ   LYS  80          1HZ       LYS  80  -1.799  -9.457   8.305
  623   2HZ   LYS  80          2HZ       LYS  80  -0.158  -9.883   8.346
  624   3HZ   LYS  80          3HZ       LYS  80  -0.894  -9.214   9.720
  625    H    MET  81           H        MET  81   3.099  -1.758   8.715
  626    HA   MET  81           HA       MET  81   5.805  -1.492   9.457
  627   1HB   MET  81          1HB       MET  81   4.477   0.335   8.505
  628   2HB   MET  81          2HB       MET  81   3.434   0.330   9.920
  629   1HG   MET  81          1HG       MET  81   5.562   0.843  11.250
  630   2HG   MET  81          2HG       MET  81   6.277   1.234   9.685
  631   1HE   MET  81          1HE       MET  81   3.574   2.363   8.225
  632   2HE   MET  81          2HE       MET  81   5.162   3.103   8.015
  633   3HE   MET  81          3HE       MET  81   3.780   4.096   8.486
  634    H    GLU  82           H        GLU  82   2.807  -1.682  11.294
  635    HA   GLU  82           HA       GLU  82   4.356  -2.025  13.766
  636   1HB   GLU  82          1HB       GLU  82   3.719   0.302  13.712
  637   2HB   GLU  82          2HB       GLU  82   2.062  -0.118  13.310
  638   1HG   GLU  82          1HG       GLU  82   1.943  -1.292  15.532
  639   2HG   GLU  82          2HG       GLU  82   3.491  -0.534  15.915
  640    H    GLY  83           H        GLY  83   1.029  -1.968  12.496
  641   1HA   GLY  83          1HA       GLY  83   0.069  -3.780  14.481
  642   2HA   GLY  83          2HA       GLY  83  -0.808  -3.233  13.060
  643    H    CYS  84           H        CYS  84  -0.384  -5.930  14.361
  644    HA   CYS  84           HA       CYS  84   1.090  -7.450  12.409
  645   1HB   CYS  84          1HB       CYS  84  -0.820  -8.456  14.525
  646   2HB   CYS  84          2HB       CYS  84   0.402  -9.395  13.672
  647    HG   CYS  84           HG       CYS  84   2.125  -9.117  15.540
  648    H    ASN  85           H        ASN  85  -1.866  -6.011  12.405
  649    HA   ASN  85           HA       ASN  85  -2.637  -7.288   9.972
  650   1HB   ASN  85          1HB       ASN  85  -3.582  -8.877  11.649
  651   2HB   ASN  85          2HB       ASN  85  -4.508  -7.551  12.344
  652   1HD2  ASN  85          2HD2      ASN  85  -6.260  -6.715  11.209
  653   2HD2  ASN  85          1HD2      ASN  85  -6.991  -7.562   9.888
  Start of MODEL    4
    1    H    MET   1           H        MET   1  13.735   0.670  -9.560
    2    HA   MET   1           HA       MET   1  11.158   1.264 -10.869
    3   1HB   MET   1          1HB       MET   1  11.609  -1.153 -10.712
    4   2HB   MET   1          2HB       MET   1  11.949  -0.980  -8.997
    5   1HG   MET   1          1HG       MET   1   9.653  -0.336  -8.578
    6   2HG   MET   1          2HG       MET   1   9.295  -0.417 -10.303
    7   1HE   MET   1          1HE       MET   1   7.227  -2.021  -9.722
    8   2HE   MET   1          2HE       MET   1   7.636  -1.969  -8.006
    9   3HE   MET   1          3HE       MET   1   7.387  -3.521  -8.807
   10    H    GLN   2           H        GLN   2  10.187   2.865  -9.862
   11    HA   GLN   2           HA       GLN   2  11.079   3.802  -7.290
   12   1HB   GLN   2          1HB       GLN   2   8.627   4.702  -8.804
   13   2HB   GLN   2          2HB       GLN   2   9.537   5.603  -7.601
   14   1HG   GLN   2          1HG       GLN   2  11.412   5.787  -9.125
   15   2HG   GLN   2          2HG       GLN   2  10.549   4.826 -10.326
   16   1HE2  GLN   2          2HE2      GLN   2  10.476   6.388 -11.879
   17   2HE2  GLN   2          1HE2      GLN   2   9.544   7.844 -11.736
   18    H    ILE   3           H        ILE   3  10.486   2.637  -5.509
   19    HA   ILE   3           HA       ILE   3   7.885   1.419  -5.350
   20    HB   ILE   3           HB       ILE   3   8.480   1.155  -2.871
   21   1HG1  ILE   3          1HG1      ILE   3  11.256   1.786  -3.883
   22   2HG1  ILE   3          2HG1      ILE   3  10.283   2.914  -2.944
   23   1HG2  ILE   3          1HG2      ILE   3  10.103  -0.177  -5.022
   24   2HG2  ILE   3          2HG2      ILE   3   9.950  -0.764  -3.366
   25   3HG2  ILE   3          3HG2      ILE   3   8.530  -0.678  -4.406
   26   1HD1  ILE   3          1HD1      ILE   3  11.873   1.768  -1.531
   27   2HD1  ILE   3          2HD1      ILE   3  10.226   1.310  -1.097
   28   3HD1  ILE   3          3HD1      ILE   3  11.232   0.206  -2.037
   29    H    HIS   4           H        HIS   4   6.210   2.705  -5.312
   30    HA   HIS   4           HA       HIS   4   6.199   5.227  -3.948
   31   1HB   HIS   4          1HB       HIS   4   4.152   3.584  -5.392
   32   2HB   HIS   4          2HB       HIS   4   3.634   4.918  -4.370
   33    HD1  HIS   4           HD1      HIS   4   2.973   6.686  -5.952
   34    HD2  HIS   4           HD2      HIS   4   6.594   4.933  -7.008
   35    HE1  HIS   4           HE1      HIS   4   3.846   8.045  -7.878
   36    HE2  HIS   4           HE2      HIS   4   5.948   6.870  -8.607
   37    H    VAL   5           H        VAL   5   6.469   5.108  -1.812
   38    HA   VAL   5           HA       VAL   5   5.240   3.018  -0.247
   39    HB   VAL   5           HB       VAL   5   6.800   5.442   0.672
   40   1HG1  VAL   5          1HG1      VAL   5   6.053   2.915   2.141
   41   2HG1  VAL   5          2HG1      VAL   5   7.092   4.200   2.761
   42   3HG1  VAL   5          3HG1      VAL   5   5.390   4.524   2.432
   43   1HG2  VAL   5          1HG2      VAL   5   7.701   2.606   0.187
   44   2HG2  VAL   5          2HG2      VAL   5   8.158   4.025  -0.752
   45   3HG2  VAL   5          3HG2      VAL   5   8.678   3.874   0.926
   46    H    TYR   6           H        TYR   6   3.069   3.245  -0.215
   47    HA   TYR   6           HA       TYR   6   1.947   5.838   0.522
   48   1HB   TYR   6          1HB       TYR   6   0.696   3.314  -0.551
   49   2HB   TYR   6          2HB       TYR   6  -0.272   4.632   0.105
   50    HD1  TYR   6           HD1      TYR   6  -0.336   6.807  -1.027
   51    HD2  TYR   6           HD2      TYR   6   1.784   3.519  -2.692
   52    HE1  TYR   6           HE1      TYR   6  -0.226   7.977  -3.187
   53    HE2  TYR   6           HE2      TYR   6   1.894   4.679  -4.855
   54    HH   TYR   6           HH       TYR   6   0.932   8.014  -5.203
   55    H    ASP   7           H        ASP   7   2.164   6.161   2.578
   56    HA   ASP   7           HA       ASP   7   1.922   4.139   4.595
   57   1HB   ASP   7          1HB       ASP   7   3.388   6.175   4.734
   58   2HB   ASP   7          2HB       ASP   7   1.936   7.156   4.864
   59    H    THR   8           H        THR   8  -0.029   3.302   5.073
   60    HA   THR   8           HA       THR   8  -2.383   4.971   4.506
   61    HB   THR   8           HB       THR   8  -2.346   1.962   4.742
   62    HG1  THR   8           HG1      THR   8  -0.904   2.942   3.046
   63   1HG2  THR   8          1HG2      THR   8  -4.357   2.137   3.331
   64   2HG2  THR   8          2HG2      THR   8  -4.550   3.003   4.856
   65   3HG2  THR   8          3HG2      THR   8  -4.222   3.896   3.371
   66    H    TYR   9           H        TYR   9  -3.675   5.581   6.090
   67    HA   TYR   9           HA       TYR   9  -3.481   4.275   8.720
   68   1HB   TYR   9          1HB       TYR   9  -4.578   6.960   7.865
   69   2HB   TYR   9          2HB       TYR   9  -4.860   6.289   9.465
   70    HD1  TYR   9           HD1      TYR   9  -3.142   6.268  11.118
   71    HD2  TYR   9           HD2      TYR   9  -2.314   7.659   7.187
   72    HE1  TYR   9           HE1      TYR   9  -1.029   7.238  11.916
   73    HE2  TYR   9           HE2      TYR   9  -0.195   8.632   7.970
   74    HH   TYR   9           HH       TYR   9   0.818   9.412  10.044
   75    H    VAL  10           H        VAL  10  -4.786   2.443   8.323
   76    HA   VAL  10           HA       VAL  10  -7.505   2.935   7.363
   77    HB   VAL  10           HB       VAL  10  -6.167   0.300   8.008
   78   1HG1  VAL  10          1HG1      VAL  10  -8.778   0.900   6.624
   79   2HG1  VAL  10          2HG1      VAL  10  -8.050  -0.698   6.793
   80   3HG1  VAL  10          3HG1      VAL  10  -8.587   0.183   8.223
   81   1HG2  VAL  10          1HG2      VAL  10  -6.037   0.012   5.575
   82   2HG2  VAL  10          2HG2      VAL  10  -6.673   1.643   5.354
   83   3HG2  VAL  10          3HG2      VAL  10  -5.102   1.403   6.121
   84    H    LYS  11           H        LYS  11  -8.764   3.711   8.906
   85    HA   LYS  11           HA       LYS  11  -8.529   3.017  11.661
   86   1HB   LYS  11          1HB       LYS  11 -10.898   4.299  10.282
   87   2HB   LYS  11          2HB       LYS  11 -10.486   4.388  11.989
   88   1HG   LYS  11          1HG       LYS  11  -8.456   5.652  11.418
   89   2HG   LYS  11          2HG       LYS  11  -8.921   5.595   9.716
   90   1HD   LYS  11          1HD       LYS  11 -11.020   6.773  10.298
   91   2HD   LYS  11          2HD       LYS  11 -10.450   6.904  11.963
   92   1HE   LYS  11          1HE       LYS  11  -9.997   8.975  10.843
   93   2HE   LYS  11          2HE       LYS  11  -8.466   8.147  11.118
   94   1HZ   LYS  11          1HZ       LYS  11  -8.647   9.128   8.882
   95   2HZ   LYS  11          2HZ       LYS  11  -8.436   7.450   8.831
   96   3HZ   LYS  11          3HZ       LYS  11  -9.969   8.113   8.551
   97    H    ALA  12           H        ALA  12  -8.910   0.954  12.231
   98    HA   ALA  12           HA       ALA  12 -10.756  -0.701  10.789
   99   1HB   ALA  12          1HB       ALA  12 -10.058  -2.460  12.308
  100   2HB   ALA  12          2HB       ALA  12  -8.655  -1.580  11.699
  101   3HB   ALA  12          3HB       ALA  12  -9.244  -1.275  13.334
  102    H    LYS  13           H        LYS  13 -12.201  -2.176  12.265
  103    HA   LYS  13           HA       LYS  13 -14.273  -0.523  13.250
  104   1HB   LYS  13          1HB       LYS  13 -13.864  -3.490  13.695
  105   2HB   LYS  13          2HB       LYS  13 -15.368  -2.609  13.920
  106   1HG   LYS  13          1HG       LYS  13 -13.919  -2.973  11.305
  107   2HG   LYS  13          2HG       LYS  13 -15.358  -3.851  11.823
  108   1HD   LYS  13          1HD       LYS  13 -16.625  -1.772  11.880
  109   2HD   LYS  13          2HD       LYS  13 -15.179  -0.864  11.430
  110   1HE   LYS  13          1HE       LYS  13 -16.504  -2.993   9.751
  111   2HE   LYS  13          2HE       LYS  13 -16.674  -1.254   9.514
  112   1HZ   LYS  13          1HZ       LYS  13 -14.169  -2.835   9.267
  113   2HZ   LYS  13          2HZ       LYS  13 -15.038  -2.111   8.009
  114   3HZ   LYS  13          3HZ       LYS  13 -14.251  -1.148   9.159
  115    H    ASP  14           H        ASP  14 -12.286  -2.908  15.005
  116    HA   ASP  14           HA       ASP  14 -12.086  -1.014  17.231
  117   1HB   ASP  14          1HB       ASP  14 -12.742  -2.609  18.884
  118   2HB   ASP  14          2HB       ASP  14 -14.003  -2.610  17.655
  119    H    GLY  15           H        GLY  15 -10.636  -3.074  15.110
  120   1HA   GLY  15          1HA       GLY  15  -8.695  -4.244  16.916
  121   2HA   GLY  15          2HA       GLY  15  -8.805  -4.509  15.184
  122    H    HIS  16           H        HIS  16  -8.675  -1.345  16.702
  123    HA   HIS  16           HA       HIS  16  -7.043   0.231  16.912
  124   1HB   HIS  16          1HB       HIS  16  -5.574  -1.618  17.672
  125   2HB   HIS  16          2HB       HIS  16  -5.140  -1.943  16.003
  126    HD1  HIS  16           HD1      HIS  16  -4.605   0.559  18.753
  127    HD2  HIS  16           HD2      HIS  16  -3.160  -0.321  14.958
  128    HE1  HIS  16           HE1      HIS  16  -2.552   1.984  18.462
  129    HE2  HIS  16           HE2      HIS  16  -1.557   1.223  16.275
  130    H    VAL  17           H        VAL  17  -6.072   1.800  15.582
  131    HA   VAL  17           HA       VAL  17  -6.851   1.793  12.853
  132    HB   VAL  17           HB       VAL  17  -4.840   3.571  14.257
  133   1HG1  VAL  17          1HG1      VAL  17  -5.135   5.108  12.399
  134   2HG1  VAL  17          2HG1      VAL  17  -4.548   3.554  11.812
  135   3HG1  VAL  17          3HG1      VAL  17  -6.247   3.984  11.617
  136   1HG2  VAL  17          1HG2      VAL  17  -7.094   3.675  15.215
  137   2HG2  VAL  17          2HG2      VAL  17  -6.667   5.177  14.395
  138   3HG2  VAL  17          3HG2      VAL  17  -7.754   4.026  13.618
  139    H    MET  18           H        MET  18  -6.033   0.431  11.446
  140    HA   MET  18           HA       MET  18  -3.513  -0.833  11.713
  141   1HB   MET  18          1HB       MET  18  -5.308  -0.629   9.284
  142   2HB   MET  18          2HB       MET  18  -3.981  -1.761   9.484
  143   1HG   MET  18          1HG       MET  18  -6.432  -1.672  11.232
  144   2HG   MET  18          2HG       MET  18  -6.214  -2.755   9.858
  145   1HE   MET  18          1HE       MET  18  -3.270  -5.025  11.026
  146   2HE   MET  18          2HE       MET  18  -3.175  -3.565  10.044
  147   3HE   MET  18          3HE       MET  18  -4.478  -4.723   9.775
  148    H    HIS  19           H        HIS  19  -1.754   0.433  11.657
  149    HA   HIS  19           HA       HIS  19  -1.512   2.354   9.455
  150   1HB   HIS  19          1HB       HIS  19  -1.165   3.207  11.776
  151   2HB   HIS  19          2HB       HIS  19   0.209   2.117  11.934
  152    HD1  HIS  19           HD1      HIS  19   2.167   3.691  11.965
  153    HD2  HIS  19           HD2      HIS  19  -0.528   4.541   8.909
  154    HE1  HIS  19           HE1      HIS  19   3.240   5.502  10.589
  155    HE2  HIS  19           HE2      HIS  19   1.668   5.879   8.654
  156    H    PHE  20           H        PHE  20  -0.737   1.358   7.746
  157    HA   PHE  20           HA       PHE  20   1.815  -0.041   7.975
  158   1HB   PHE  20          1HB       PHE  20   1.000  -1.857   6.484
  159   2HB   PHE  20          2HB       PHE  20   0.174  -1.839   8.039
  160    HD1  PHE  20           HD1      PHE  20  -0.165  -1.229   4.445
  161    HD2  PHE  20           HD2      PHE  20  -2.161  -1.294   8.202
  162    HE1  PHE  20           HE1      PHE  20  -2.334  -1.163   3.289
  163    HE2  PHE  20           HE2      PHE  20  -4.334  -1.228   7.053
  164    HZ   PHE  20           HZ       PHE  20  -4.423  -1.163   4.593
  165    H    ASP  21           H        ASP  21   2.861  -0.275   5.820
  166    HA   ASP  21           HA       ASP  21   1.934   1.862   4.024
  167   1HB   ASP  21          1HB       ASP  21   4.243   2.191   3.333
  168   2HB   ASP  21          2HB       ASP  21   4.090   2.372   5.075
  169    H    VAL  22           H        VAL  22   1.818   1.513   1.874
  170    HA   VAL  22           HA       VAL  22   1.932  -1.312   1.057
  171    HB   VAL  22           HB       VAL  22   0.338   0.916  -0.222
  172   1HG1  VAL  22          1HG1      VAL  22   0.213  -2.077  -0.575
  173   2HG1  VAL  22          2HG1      VAL  22  -0.858  -0.903  -1.343
  174   3HG1  VAL  22          3HG1      VAL  22   0.862  -0.916  -1.736
  175   1HG2  VAL  22          1HG2      VAL  22  -0.466   0.516   2.042
  176   2HG2  VAL  22          2HG2      VAL  22  -1.631  -0.069   0.852
  177   3HG2  VAL  22          3HG2      VAL  22  -0.589  -1.211   1.705
  178    H    PHE  23           H        PHE  23   3.620  -1.803  -0.166
  179    HA   PHE  23           HA       PHE  23   5.021   0.199  -1.705
  180   1HB   PHE  23          1HB       PHE  23   5.405  -2.786  -1.420
  181   2HB   PHE  23          2HB       PHE  23   6.429  -1.763  -2.421
  182    HD1  PHE  23           HD1      PHE  23   5.800  -3.013   0.874
  183    HD2  PHE  23           HD2      PHE  23   7.724   0.087  -1.312
  184    HE1  PHE  23           HE1      PHE  23   7.227  -2.535   2.821
  185    HE2  PHE  23           HE2      PHE  23   9.156   0.575   0.629
  186    HZ   PHE  23           HZ       PHE  23   8.910  -0.738   2.702
  187    H    THR  24           H        THR  24   4.187   0.874  -3.544
  188    HA   THR  24           HA       THR  24   3.241  -1.141  -5.467
  189    HB   THR  24           HB       THR  24   1.621   0.702  -6.269
  190    HG1  THR  24           HG1      THR  24   2.177   1.584  -3.613
  191   1HG2  THR  24          1HG2      THR  24   1.127  -0.720  -3.650
  192   2HG2  THR  24          2HG2      THR  24  -0.119  -0.003  -4.672
  193   3HG2  THR  24          3HG2      THR  24   0.834  -1.364  -5.266
  194    H    ASP  25           H        ASP  25   3.521  -0.522  -7.704
  195    HA   ASP  25           HA       ASP  25   5.627   1.488  -8.082
  196   1HB   ASP  25          1HB       ASP  25   6.100   0.439 -10.177
  197   2HB   ASP  25          2HB       ASP  25   5.884  -0.859  -9.008
  198    H    VAL  26           H        VAL  26   2.387   1.288  -8.104
  199    HA   VAL  26           HA       VAL  26   1.699   2.652 -10.502
  200    HB   VAL  26           HB       VAL  26   0.067   2.433  -7.968
  201   1HG1  VAL  26          1HG1      VAL  26  -1.845   2.647  -9.477
  202   2HG1  VAL  26          2HG1      VAL  26  -0.784   4.053  -9.574
  203   3HG1  VAL  26          3HG1      VAL  26  -0.746   2.830 -10.844
  204   1HG2  VAL  26          1HG2      VAL  26  -0.922   0.424  -8.970
  205   2HG2  VAL  26          2HG2      VAL  26   0.231   0.526 -10.299
  206   3HG2  VAL  26          3HG2      VAL  26   0.801   0.222  -8.659
  207    H    ARG  27           H        ARG  27   1.112   4.799 -10.775
  208    HA   ARG  27           HA       ARG  27   2.414   6.608  -8.886
  209   1HB   ARG  27          1HB       ARG  27   2.465   8.199 -10.750
  210   2HB   ARG  27          2HB       ARG  27   3.182   6.663 -11.224
  211   1HG   ARG  27          1HG       ARG  27   0.936   6.062 -12.211
  212   2HG   ARG  27          2HG       ARG  27   0.483   7.749 -11.961
  213   1HD   ARG  27          1HD       ARG  27   2.456   8.415 -13.323
  214   2HD   ARG  27          2HD       ARG  27   2.735   6.706 -13.664
  215    HE   ARG  27           HE       ARG  27   0.352   8.228 -14.500
  216   1HH1  ARG  27          1HH1      ARG  27   2.635   5.599 -14.962
  217   2HH1  ARG  27          2HH1      ARG  27   1.888   5.046 -16.433
  218   1HH2  ARG  27          1HH2      ARG  27  -0.593   7.538 -16.445
  219   2HH2  ARG  27          2HH2      ARG  27   0.046   6.152 -17.281
  220    H    ASP  28           H        ASP  28  -0.317   5.418  -8.735
  221    HA   ASP  28           HA       ASP  28  -1.937   7.878  -8.763
  222   1HB   ASP  28          1HB       ASP  28  -2.858   5.047  -9.316
  223   2HB   ASP  28          2HB       ASP  28  -3.892   6.471  -9.278
  224    H    ASP  29           H        ASP  29  -2.658   8.469  -6.838
  225    HA   ASP  29           HA       ASP  29  -2.261   6.931  -4.488
  226   1HB   ASP  29          1HB       ASP  29  -4.055   9.340  -4.897
  227   2HB   ASP  29          2HB       ASP  29  -3.537   8.698  -3.343
  228    H    LYS  30           H        LYS  30  -5.073   7.678  -6.471
  229    HA   LYS  30           HA       LYS  30  -7.014   6.418  -4.847
  230   1HB   LYS  30          1HB       LYS  30  -7.474   8.105  -6.617
  231   2HB   LYS  30          2HB       LYS  30  -7.056   6.911  -7.833
  232   1HG   LYS  30          1HG       LYS  30  -9.451   7.129  -7.629
  233   2HG   LYS  30          2HG       LYS  30  -8.939   5.524  -7.107
  234   1HD   LYS  30          1HD       LYS  30  -9.227   6.075  -4.825
  235   2HD   LYS  30          2HD       LYS  30  -9.379   7.795  -5.185
  236   1HE   LYS  30          1HE       LYS  30 -11.540   6.701  -4.659
  237   2HE   LYS  30          2HE       LYS  30 -11.495   7.447  -6.254
  238   1HZ   LYS  30          1HZ       LYS  30 -12.530   5.292  -6.357
  239   2HZ   LYS  30          2HZ       LYS  30 -11.070   5.256  -7.213
  240   3HZ   LYS  30          3HZ       LYS  30 -11.164   4.552  -5.673
  241    H    LYS  31           H        LYS  31  -4.908   5.277  -7.399
  242    HA   LYS  31           HA       LYS  31  -6.157   2.714  -7.651
  243   1HB   LYS  31          1HB       LYS  31  -4.801   3.805  -9.451
  244   2HB   LYS  31          2HB       LYS  31  -3.364   3.533  -8.476
  245   1HG   LYS  31          1HG       LYS  31  -3.531   1.837 -10.174
  246   2HG   LYS  31          2HG       LYS  31  -3.783   1.107  -8.587
  247   1HD   LYS  31          1HD       LYS  31  -6.180   1.093  -8.940
  248   2HD   LYS  31          2HD       LYS  31  -5.983   1.923 -10.485
  249   1HE   LYS  31          1HE       LYS  31  -4.713   0.015 -11.343
  250   2HE   LYS  31          2HE       LYS  31  -4.910  -0.812  -9.800
  251   1HZ   LYS  31          1HZ       LYS  31  -7.143   0.001 -11.585
  252   2HZ   LYS  31          2HZ       LYS  31  -6.490  -1.563 -11.493
  253   3HZ   LYS  31          3HZ       LYS  31  -7.278  -0.892 -10.145
  254    H    ALA  32           H        ALA  32  -3.377   4.019  -5.892
  255    HA   ALA  32           HA       ALA  32  -2.451   1.635  -4.756
  256   1HB   ALA  32          1HB       ALA  32  -1.222   3.756  -4.648
  257   2HB   ALA  32          2HB       ALA  32  -2.437   4.397  -3.541
  258   3HB   ALA  32          3HB       ALA  32  -1.428   3.039  -3.048
  259    H    ILE  33           H        ILE  33  -4.944   3.913  -3.684
  260    HA   ILE  33           HA       ILE  33  -5.770   2.730  -1.323
  261    HB   ILE  33           HB       ILE  33  -7.503   3.980  -3.470
  262   1HG1  ILE  33          1HG1      ILE  33  -6.385   5.174  -0.924
  263   2HG1  ILE  33          2HG1      ILE  33  -5.724   5.444  -2.535
  264   1HG2  ILE  33          1HG2      ILE  33  -8.850   2.613  -1.986
  265   2HG2  ILE  33          2HG2      ILE  33  -8.141   3.407  -0.581
  266   3HG2  ILE  33          3HG2      ILE  33  -9.159   4.324  -1.691
  267   1HD1  ILE  33          1HD1      ILE  33  -8.483   6.214  -1.612
  268   2HD1  ILE  33          2HD1      ILE  33  -7.111   7.304  -1.816
  269   3HD1  ILE  33          3HD1      ILE  33  -7.811   6.496  -3.219
  270    H    GLU  34           H        GLU  34  -6.730   1.974  -4.643
  271    HA   GLU  34           HA       GLU  34  -8.602  -0.021  -4.071
  272   1HB   GLU  34          1HB       GLU  34  -8.290   1.064  -6.282
  273   2HB   GLU  34          2HB       GLU  34  -6.799   0.158  -6.487
  274   1HG   GLU  34          1HG       GLU  34  -8.027  -1.927  -6.468
  275   2HG   GLU  34          2HG       GLU  34  -9.534  -1.059  -6.170
  276    H    PHE  35           H        PHE  35  -5.088  -0.247  -4.557
  277    HA   PHE  35           HA       PHE  35  -4.970  -3.078  -4.381
  278   1HB   PHE  35          1HB       PHE  35  -2.897  -0.920  -4.035
  279   2HB   PHE  35          2HB       PHE  35  -2.509  -2.623  -3.806
  280    HD1  PHE  35           HD1      PHE  35  -2.970  -4.212  -5.739
  281    HD2  PHE  35           HD2      PHE  35  -2.899   0.019  -6.165
  282    HE1  PHE  35           HE1      PHE  35  -2.618  -4.468  -8.159
  283    HE2  PHE  35           HE2      PHE  35  -2.555  -0.231  -8.587
  284    HZ   PHE  35           HZ       PHE  35  -2.408  -2.473  -9.587
  285    H    ALA  36           H        ALA  36  -4.604  -0.494  -1.986
  286    HA   ALA  36           HA       ALA  36  -3.993  -2.152   0.214
  287   1HB   ALA  36          1HB       ALA  36  -3.661   0.268   0.260
  288   2HB   ALA  36          2HB       ALA  36  -5.406   0.514   0.196
  289   3HB   ALA  36          3HB       ALA  36  -4.675  -0.262   1.602
  290    H    LYS  37           H        LYS  37  -7.061  -0.989  -1.109
  291    HA   LYS  37           HA       LYS  37  -8.679  -2.135   0.914
  292   1HB   LYS  37          1HB       LYS  37  -9.345  -1.251  -1.893
  293   2HB   LYS  37          2HB       LYS  37 -10.547  -1.781  -0.720
  294   1HG   LYS  37          1HG       LYS  37  -9.747   0.025   0.796
  295   2HG   LYS  37          2HG       LYS  37  -8.735   0.607  -0.522
  296   1HD   LYS  37          1HD       LYS  37 -10.818   1.866  -0.419
  297   2HD   LYS  37          2HD       LYS  37 -10.729   0.929  -1.910
  298   1HE   LYS  37          1HE       LYS  37 -12.186  -0.761  -0.969
  299   2HE   LYS  37          2HE       LYS  37 -12.210   0.084   0.576
  300   1HZ   LYS  37          1HZ       LYS  37 -13.412   1.864  -0.362
  301   2HZ   LYS  37          2HZ       LYS  37 -13.180   1.296  -1.942
  302   3HZ   LYS  37          3HZ       LYS  37 -14.188   0.449  -0.880
  303    H    GLN  38           H        GLN  38  -7.393  -3.369  -2.100
  304    HA   GLN  38           HA       GLN  38  -8.905  -5.723  -2.273
  305   1HB   GLN  38          1HB       GLN  38  -6.115  -5.025  -3.141
  306   2HB   GLN  38          2HB       GLN  38  -6.722  -6.665  -3.324
  307   1HG   GLN  38          1HG       GLN  38  -8.555  -5.845  -4.703
  308   2HG   GLN  38          2HG       GLN  38  -7.968  -4.193  -4.505
  309   1HE2  GLN  38          2HE2      GLN  38  -6.167  -3.526  -5.628
  310   2HE2  GLN  38          1HE2      GLN  38  -5.469  -4.450  -6.914
  311    H    TRP  39           H        TRP  39  -5.976  -4.984  -0.450
  312    HA   TRP  39           HA       TRP  39  -5.685  -7.559   0.709
  313   1HB   TRP  39          1HB       TRP  39  -3.852  -5.913   0.619
  314   2HB   TRP  39          2HB       TRP  39  -4.743  -4.860   1.710
  315    HD1  TRP  39           HD1      TRP  39  -3.311  -8.471   1.781
  316    HE1  TRP  39           HE1      TRP  39  -2.422  -8.923   4.155
  317    HE3  TRP  39           HE3      TRP  39  -4.619  -4.049   3.988
  318    HZ2  TRP  39           HZ2      TRP  39  -2.287  -7.578   6.630
  319    HZ3  TRP  39           HZ3      TRP  39  -4.068  -3.711   6.363
  320    HH2  TRP  39           HH2      TRP  39  -2.928  -5.441   7.655
  321    H    LEU  40           H        LEU  40  -7.149  -4.535   1.832
  322    HA   LEU  40           HA       LEU  40  -7.968  -5.373   4.358
  323   1HB   LEU  40          1HB       LEU  40  -9.246  -3.376   2.494
  324   2HB   LEU  40          2HB       LEU  40  -9.659  -3.554   4.188
  325    HG   LEU  40           HG       LEU  40  -6.937  -2.758   3.150
  326   1HD1  LEU  40          1HD1      LEU  40  -7.490  -0.544   4.040
  327   2HD1  LEU  40          2HD1      LEU  40  -8.583  -1.017   2.738
  328   3HD1  LEU  40          3HD1      LEU  40  -9.118  -1.106   4.417
  329   1HD2  LEU  40          1HD2      LEU  40  -6.850  -3.953   5.281
  330   2HD2  LEU  40          2HD2      LEU  40  -6.455  -2.246   5.489
  331   3HD2  LEU  40          3HD2      LEU  40  -8.047  -2.847   5.955
  332    H    SER  41           H        SER  41  -9.837  -5.390   1.318
  333    HA   SER  41           HA       SER  41 -12.220  -6.363   2.415
  334   1HB   SER  41          1HB       SER  41 -11.206  -6.775  -0.407
  335   2HB   SER  41          2HB       SER  41 -12.886  -6.846   0.125
  336    HG   SER  41           HG       SER  41 -11.166  -4.604  -0.027
  337    H    SER  42           H        SER  42  -9.321  -8.018   1.431
  338    HA   SER  42           HA       SER  42 -10.520 -10.622   1.391
  339   1HB   SER  42          1HB       SER  42  -7.600  -9.825   1.492
  340   2HB   SER  42          2HB       SER  42  -8.221 -11.435   1.125
  341    HG   SER  42           HG       SER  42  -8.267  -9.096  -0.428
  342    H    ILE  43           H        ILE  43  -8.630  -8.728   3.730
  343    HA   ILE  43           HA       ILE  43  -8.426 -10.936   5.559
  344    HB   ILE  43           HB       ILE  43  -7.408  -9.370   7.131
  345   1HG1  ILE  43          1HG1      ILE  43  -7.940  -7.246   5.039
  346   2HG1  ILE  43          2HG1      ILE  43  -8.816  -7.398   6.558
  347   1HG2  ILE  43          1HG2      ILE  43  -6.011 -10.402   5.447
  348   2HG2  ILE  43          2HG2      ILE  43  -6.377  -9.105   4.310
  349   3HG2  ILE  43          3HG2      ILE  43  -5.451  -8.762   5.772
  350   1HD1  ILE  43          1HD1      ILE  43  -6.758  -6.976   7.791
  351   2HD1  ILE  43          2HD1      ILE  43  -5.872  -6.843   6.272
  352   3HD1  ILE  43          3HD1      ILE  43  -7.119  -5.663   6.671
  353    H    GLY  44           H        GLY  44 -10.759  -8.447   4.994
  354   1HA   GLY  44          1HA       GLY  44 -12.893  -9.392   6.191
  355   2HA   GLY  44          2HA       GLY  44 -11.988  -8.920   7.618
  356    H    GLU  45           H        GLU  45 -10.905  -6.593   5.947
  357    HA   GLU  45           HA       GLU  45 -13.027  -4.783   6.731
  358   1HB   GLU  45          1HB       GLU  45 -10.178  -4.355   5.862
  359   2HB   GLU  45          2HB       GLU  45 -11.301  -3.018   6.071
  360   1HG   GLU  45          1HG       GLU  45 -10.592  -5.007   8.215
  361   2HG   GLU  45          2HG       GLU  45  -9.849  -3.419   8.026
  362    H    GLU  46           H        GLU  46 -14.221  -5.928   4.902
  363    HA   GLU  46           HA       GLU  46 -13.791  -4.755   2.286
  364   1HB   GLU  46          1HB       GLU  46 -15.888  -5.976   1.704
  365   2HB   GLU  46          2HB       GLU  46 -14.627  -7.012   2.360
  366   1HG   GLU  46          1HG       GLU  46 -15.731  -7.006   4.528
  367   2HG   GLU  46          2HG       GLU  46 -16.984  -5.938   3.896
  368    H    GLY  47           H        GLY  47 -14.537  -3.283   4.870
  369   1HA   GLY  47          1HA       GLY  47 -16.232  -1.342   3.574
  370   2HA   GLY  47          2HA       GLY  47 -16.962  -2.123   4.971
  371    H    ALA  48           H        ALA  48 -14.155  -0.285   3.904
  372    HA   ALA  48           HA       ALA  48 -14.018   0.937   6.572
  373   1HB   ALA  48          1HB       ALA  48 -11.588   0.804   6.578
  374   2HB   ALA  48          2HB       ALA  48 -12.293  -0.809   6.472
  375   3HB   ALA  48          3HB       ALA  48 -11.614  -0.047   5.033
  376    H    THR  49           H        THR  49 -13.125   3.049   6.595
  377    HA   THR  49           HA       THR  49 -13.569   4.447   4.094
  378    HB   THR  49           HB       THR  49 -12.949   5.605   6.816
  379    HG1  THR  49           HG1      THR  49 -15.352   5.989   6.667
  380   1HG2  THR  49          1HG2      THR  49 -14.143   6.830   4.323
  381   2HG2  THR  49          2HG2      THR  49 -13.989   7.640   5.883
  382   3HG2  THR  49          3HG2      THR  49 -12.545   7.167   4.989
  383    H    VAL  50           H        VAL  50 -11.815   4.118   2.820
  384    HA   VAL  50           HA       VAL  50  -9.333   5.393   3.749
  385    HB   VAL  50           HB       VAL  50  -9.559   3.047   1.846
  386   1HG1  VAL  50          1HG1      VAL  50  -7.129   4.612   2.714
  387   2HG1  VAL  50          2HG1      VAL  50  -7.096   3.107   1.793
  388   3HG1  VAL  50          3HG1      VAL  50  -7.819   4.555   1.092
  389   1HG2  VAL  50          1HG2      VAL  50  -8.285   3.265   4.570
  390   2HG2  VAL  50          2HG2      VAL  50  -9.778   2.407   4.186
  391   3HG2  VAL  50          3HG2      VAL  50  -8.243   1.846   3.524
  392    H    THR  51           H        THR  51  -9.653   7.376   2.890
  393    HA   THR  51           HA       THR  51 -10.238   7.540   0.011
  394    HB   THR  51           HB       THR  51 -10.757   9.911   0.408
  395    HG1  THR  51           HG1      THR  51 -10.089   9.266   3.118
  396   1HG2  THR  51          1HG2      THR  51 -12.181   8.060   2.323
  397   2HG2  THR  51          2HG2      THR  51 -12.786   9.618   1.759
  398   3HG2  THR  51          3HG2      THR  51 -12.568   8.292   0.617
  399    H    SER  52           H        SER  52  -9.128   9.984  -0.596
  400    HA   SER  52           HA       SER  52  -6.361   9.355  -0.851
  401   1HB   SER  52          1HB       SER  52  -7.736  10.706  -2.487
  402   2HB   SER  52          2HB       SER  52  -7.677  12.038  -1.336
  403    HG   SER  52           HG       SER  52  -5.370  11.950  -1.514
  404    H    GLU  53           H        GLU  53  -8.065  10.420   1.731
  405    HA   GLU  53           HA       GLU  53  -6.040  12.172   2.859
  406   1HB   GLU  53          1HB       GLU  53  -8.526  12.511   3.170
  407   2HB   GLU  53          2HB       GLU  53  -8.534  11.059   4.158
  408   1HG   GLU  53          1HG       GLU  53  -8.487  12.971   5.583
  409   2HG   GLU  53          2HG       GLU  53  -6.930  12.149   5.691
  410    H    GLU  54           H        GLU  54  -7.233   8.882   3.133
  411    HA   GLU  54           HA       GLU  54  -5.719   8.309   5.520
  412   1HB   GLU  54          1HB       GLU  54  -7.440   6.645   3.698
  413   2HB   GLU  54          2HB       GLU  54  -6.471   5.908   4.964
  414   1HG   GLU  54          1HG       GLU  54  -8.765   6.240   5.685
  415   2HG   GLU  54          2HG       GLU  54  -7.649   7.203   6.650
  416    H    CYS  55           H        CYS  55  -5.311   7.912   2.079
  417    HA   CYS  55           HA       CYS  55  -2.950   6.251   2.471
  418   1HB   CYS  55          1HB       CYS  55  -2.896   6.145   0.000
  419   2HB   CYS  55          2HB       CYS  55  -4.444   5.626   0.660
  420    HG   CYS  55           HG       CYS  55  -4.071   8.841  -0.381
  421    H    ARG  56           H        ARG  56  -1.264   7.386   3.195
  422    HA   ARG  56           HA       ARG  56  -0.755  10.051   2.098
  423   1HB   ARG  56          1HB       ARG  56   0.158   8.591   4.549
  424   2HB   ARG  56          2HB       ARG  56   1.081   9.962   3.947
  425   1HG   ARG  56          1HG       ARG  56  -0.904  11.377   4.138
  426   2HG   ARG  56          2HG       ARG  56  -1.820  10.001   4.760
  427   1HD   ARG  56          1HD       ARG  56  -0.846  11.647   6.463
  428   2HD   ARG  56          2HD       ARG  56  -0.584   9.925   6.746
  429    HE   ARG  56           HE       ARG  56   1.669  10.234   6.441
  430   1HH1  ARG  56          1HH1      ARG  56  -0.024  13.121   5.403
  431   2HH1  ARG  56          2HH1      ARG  56   1.432  14.019   5.084
  432   1HH2  ARG  56          1HH2      ARG  56   3.575  11.406   6.038
  433   2HH2  ARG  56          2HH2      ARG  56   3.485  13.031   5.428
  434    H    PHE  57           H        PHE  57   0.362   9.956   0.238
  435    HA   PHE  57           HA       PHE  57   2.452   8.096  -0.275
  436   1HB   PHE  57          1HB       PHE  57   1.314   9.203  -2.123
  437   2HB   PHE  57          2HB       PHE  57   1.827  10.780  -1.535
  438    HD1  PHE  57           HD1      PHE  57   3.117   7.563  -2.855
  439    HD2  PHE  57           HD2      PHE  57   3.828  11.715  -2.260
  440    HE1  PHE  57           HE1      PHE  57   5.140   7.413  -4.244
  441    HE2  PHE  57           HE2      PHE  57   5.854  11.574  -3.648
  442    HZ   PHE  57           HZ       PHE  57   6.512   9.418  -4.643
  443    H    CYS  58           H        CYS  58   4.104   8.033   1.125
  444    HA   CYS  58           HA       CYS  58   5.144  10.429   2.333
  445   1HB   CYS  58          1HB       CYS  58   6.022   7.544   2.459
  446   2HB   CYS  58          2HB       CYS  58   6.835   8.843   3.326
  447    HG   CYS  58           HG       CYS  58   5.175   7.328   5.055
  448    H    HIS  59           H        HIS  59   6.453   7.969   0.096
  449    HA   HIS  59           HA       HIS  59   7.921   9.878  -1.388
  450   1HB   HIS  59          1HB       HIS  59  10.202   9.255  -0.741
  451   2HB   HIS  59          2HB       HIS  59   9.332   9.942   0.619
  452    HD1  HIS  59           HD1      HIS  59   8.875   8.397   2.636
  453    HD2  HIS  59           HD2      HIS  59  10.882   6.545  -0.497
  454    HE1  HIS  59           HE1      HIS  59   9.639   6.181   3.537
  455    HE2  HIS  59           HE2      HIS  59  11.103   5.225   1.715
  456    H    SER  60           H        SER  60   9.687   8.740  -2.698
  457    HA   SER  60           HA       SER  60   9.190   5.881  -3.109
  458   1HB   SER  60          1HB       SER  60   9.324   7.929  -5.344
  459   2HB   SER  60          2HB       SER  60   9.251   6.180  -5.562
  460    HG   SER  60           HG       SER  60   7.268   6.899  -3.948
  461    H    GLU  61           H        GLU  61  11.114   4.943  -2.751
  462    HA   GLU  61           HA       GLU  61  13.531   6.470  -3.449
  463   1HB   GLU  61          1HB       GLU  61  14.594   5.684  -1.410
  464   2HB   GLU  61          2HB       GLU  61  13.117   6.556  -1.030
  465   1HG   GLU  61          1HG       GLU  61  11.948   4.436  -0.690
  466   2HG   GLU  61          2HG       GLU  61  13.431   3.561  -1.075
  467    H    LYS  62           H        LYS  62  15.431   4.620  -2.767
  468    HA   LYS  62           HA       LYS  62  15.448   2.918  -4.996
  469   1HB   LYS  62          1HB       LYS  62  17.528   3.607  -4.022
  470   2HB   LYS  62          2HB       LYS  62  17.102   2.901  -2.469
  471   1HG   LYS  62          1HG       LYS  62  17.196   0.673  -3.441
  472   2HG   LYS  62          2HG       LYS  62  17.581   1.368  -5.015
  473   1HD   LYS  62          1HD       LYS  62  19.677   2.198  -4.208
  474   2HD   LYS  62          2HD       LYS  62  19.274   1.749  -2.548
  475   1HE   LYS  62          1HE       LYS  62  19.502  -0.228  -4.807
  476   2HE   LYS  62          2HE       LYS  62  20.838   0.182  -3.735
  477   1HZ   LYS  62          1HZ       LYS  62  18.277  -0.695  -2.575
  478   2HZ   LYS  62          2HZ       LYS  62  19.342  -1.853  -3.217
  479   3HZ   LYS  62          3HZ       LYS  62  19.848  -0.841  -1.953
  480    H    ALA  63           H        ALA  63  14.337   1.170  -5.335
  481    HA   ALA  63           HA       ALA  63  12.921  -0.177  -3.243
  482   1HB   ALA  63          1HB       ALA  63  11.992  -1.535  -5.014
  483   2HB   ALA  63          2HB       ALA  63  11.955   0.170  -5.472
  484   3HB   ALA  63          3HB       ALA  63  13.180  -0.900  -6.155
  485    HA   PRO  64           HA       PRO  64  16.084  -3.295  -2.537
  486   1HB   PRO  64          1HB       PRO  64  14.580  -4.775  -0.811
  487   2HB   PRO  64          2HB       PRO  64  15.457  -3.321  -0.326
  488   1HG   PRO  64          1HG       PRO  64  12.560  -3.659  -0.975
  489   2HG   PRO  64          2HG       PRO  64  13.317  -2.705   0.313
  490   1HD   PRO  64          1HD       PRO  64  12.395  -1.599  -1.986
  491   2HD   PRO  64          2HD       PRO  64  13.782  -0.943  -1.093
  492    H    ASP  65           H        ASP  65  16.413  -5.273  -3.471
  493    HA   ASP  65           HA       ASP  65  14.754  -6.070  -5.568
  494   1HB   ASP  65          1HB       ASP  65  16.244  -8.015  -5.735
  495   2HB   ASP  65          2HB       ASP  65  17.146  -6.522  -5.533
  496    H    GLU  66           H        GLU  66  14.686  -6.882  -2.232
  497    HA   GLU  66           HA       GLU  66  13.355  -9.325  -2.231
  498   1HB   GLU  66          1HB       GLU  66  14.276  -8.244  -0.220
  499   2HB   GLU  66          2HB       GLU  66  13.035  -7.006  -0.318
  500   1HG   GLU  66          1HG       GLU  66  12.411  -8.570   1.363
  501   2HG   GLU  66          2HG       GLU  66  11.321  -8.768  -0.010
  502    H    VAL  67           H        VAL  67  11.969  -6.027  -2.208
  503    HA   VAL  67           HA       VAL  67   9.285  -7.041  -2.249
  504    HB   VAL  67           HB       VAL  67   8.563  -4.708  -2.445
  505   1HG1  VAL  67          1HG1      VAL  67   9.467  -3.900  -0.319
  506   2HG1  VAL  67          2HG1      VAL  67   9.045  -5.610  -0.243
  507   3HG1  VAL  67          3HG1      VAL  67  10.733  -5.125  -0.396
  508   1HG2  VAL  67          1HG2      VAL  67  10.215  -2.891  -2.416
  509   2HG2  VAL  67          2HG2      VAL  67  11.504  -4.073  -2.633
  510   3HG2  VAL  67          3HG2      VAL  67  10.297  -3.841  -3.899
  511    H    ILE  68           H        ILE  68  11.611  -6.213  -4.637
  512    HA   ILE  68           HA       ILE  68   9.996  -5.488  -6.795
  513    HB   ILE  68           HB       ILE  68  12.553  -7.101  -6.881
  514   1HG1  ILE  68          1HG1      ILE  68  12.856  -4.988  -5.691
  515   2HG1  ILE  68          2HG1      ILE  68  13.660  -4.931  -7.255
  516   1HG2  ILE  68          1HG2      ILE  68  11.315  -7.209  -8.983
  517   2HG2  ILE  68          2HG2      ILE  68  11.239  -5.448  -9.034
  518   3HG2  ILE  68          3HG2      ILE  68  12.794  -6.267  -9.161
  519   1HD1  ILE  68          1HD1      ILE  68  12.523  -2.843  -6.753
  520   2HD1  ILE  68          2HD1      ILE  68  11.814  -3.633  -8.163
  521   3HD1  ILE  68          3HD1      ILE  68  10.991  -3.705  -6.605
  522    H    GLU  69           H        GLU  69  11.048  -8.688  -5.704
  523    HA   GLU  69           HA       GLU  69   9.786 -10.147  -7.769
  524   1HB   GLU  69          1HB       GLU  69  10.453 -11.087  -4.973
  525   2HB   GLU  69          2HB       GLU  69  10.190 -12.101  -6.385
  526   1HG   GLU  69          1HG       GLU  69  12.453 -10.149  -6.008
  527   2HG   GLU  69          2HG       GLU  69  12.555 -11.901  -5.848
  528    H    ALA  70           H        ALA  70   8.779  -9.189  -4.526
  529    HA   ALA  70           HA       ALA  70   6.384 -10.669  -4.429
  530   1HB   ALA  70          1HB       ALA  70   5.789  -9.251  -2.551
  531   2HB   ALA  70          2HB       ALA  70   7.485  -9.728  -2.447
  532   3HB   ALA  70          3HB       ALA  70   7.055  -8.105  -2.991
  533    H    ILE  71           H        ILE  71   7.011  -7.286  -5.332
  534    HA   ILE  71           HA       ILE  71   4.297  -6.649  -5.861
  535    HB   ILE  71           HB       ILE  71   6.801  -5.311  -6.907
  536   1HG1  ILE  71          1HG1      ILE  71   5.042  -4.617  -4.542
  537   2HG1  ILE  71          2HG1      ILE  71   6.624  -5.382  -4.436
  538   1HG2  ILE  71          1HG2      ILE  71   5.371  -3.353  -7.281
  539   2HG2  ILE  71          2HG2      ILE  71   4.852  -4.731  -8.253
  540   3HG2  ILE  71          3HG2      ILE  71   3.959  -4.295  -6.796
  541   1HD1  ILE  71          1HD1      ILE  71   7.646  -3.399  -5.423
  542   2HD1  ILE  71          2HD1      ILE  71   6.062  -2.633  -5.522
  543   3HD1  ILE  71          3HD1      ILE  71   6.762  -3.014  -3.949
  544    H    LYS  72           H        LYS  72   6.801  -8.155  -7.755
  545    HA   LYS  72           HA       LYS  72   5.559  -7.789 -10.295
  546   1HB   LYS  72          1HB       LYS  72   7.971  -8.311  -9.986
  547   2HB   LYS  72          2HB       LYS  72   7.524  -9.920  -9.438
  548   1HG   LYS  72          1HG       LYS  72   6.575 -10.427 -11.610
  549   2HG   LYS  72          2HG       LYS  72   6.929  -8.788 -12.164
  550   1HD   LYS  72          1HD       LYS  72   8.971 -10.833 -11.289
  551   2HD   LYS  72          2HD       LYS  72   8.600 -10.399 -12.958
  552   1HE   LYS  72          1HE       LYS  72   9.698  -8.542 -10.848
  553   2HE   LYS  72          2HE       LYS  72  10.619  -9.265 -12.168
  554   1HZ   LYS  72          1HZ       LYS  72  10.000  -7.019 -12.719
  555   2HZ   LYS  72          2HZ       LYS  72   9.171  -8.090 -13.737
  556   3HZ   LYS  72          3HZ       LYS  72   8.359  -7.351 -12.444
  557    H    GLN  73           H        GLN  73   5.251 -10.110  -7.725
  558    HA   GLN  73           HA       GLN  73   3.769 -11.991  -9.354
  559   1HB   GLN  73          1HB       GLN  73   4.469 -11.966  -6.416
  560   2HB   GLN  73          2HB       GLN  73   3.590 -13.267  -7.210
  561   1HG   GLN  73          1HG       GLN  73   5.457 -13.830  -8.552
  562   2HG   GLN  73          2HG       GLN  73   6.320 -12.368  -8.080
  563   1HE2  GLN  73          2HE2      GLN  73   4.523 -14.312  -5.799
  564   2HE2  GLN  73          1HE2      GLN  73   5.904 -14.907  -4.935
  565    H    ASN  74           H        ASN  74   3.104  -9.798  -6.634
  566    HA   ASN  74           HA       ASN  74   0.283 -10.568  -6.725
  567   1HB   ASN  74          1HB       ASN  74   1.803  -8.859  -4.747
  568   2HB   ASN  74          2HB       ASN  74   0.096  -9.271  -4.619
  569   1HD2  ASN  74          2HD2      ASN  74   2.351  -9.860  -2.842
  570   2HD2  ASN  74          1HD2      ASN  74   2.367 -11.581  -2.664
  571    H    GLY  75           H        GLY  75   2.350  -7.904  -7.546
  572   1HA   GLY  75          1HA       GLY  75   1.705  -6.058  -8.868
  573   2HA   GLY  75          2HA       GLY  75   0.022  -6.387  -8.467
  574    H    TYR  76           H        TYR  76   1.388  -6.707  -5.630
  575    HA   TYR  76           HA       TYR  76   1.879  -3.992  -4.853
  576   1HB   TYR  76          1HB       TYR  76  -0.054  -3.870  -3.280
  577   2HB   TYR  76          2HB       TYR  76  -0.551  -3.878  -4.968
  578    HD1  TYR  76           HD1      TYR  76  -0.465  -5.830  -1.852
  579    HD2  TYR  76           HD2      TYR  76  -1.816  -5.725  -5.884
  580    HE1  TYR  76           HE1      TYR  76  -1.958  -7.725  -1.394
  581    HE2  TYR  76           HE2      TYR  76  -3.312  -7.624  -5.434
  582    HH   TYR  76           HH       TYR  76  -3.532  -9.464  -3.877
  583    H    PHE  77           H        PHE  77   2.365  -3.869  -2.511
  584    HA   PHE  77           HA       PHE  77   2.593  -6.425  -1.134
  585   1HB   PHE  77          1HB       PHE  77   4.763  -6.105  -2.314
  586   2HB   PHE  77          2HB       PHE  77   4.973  -4.580  -1.458
  587    HD1  PHE  77           HD1      PHE  77   6.049  -4.544   0.599
  588    HD2  PHE  77           HD2      PHE  77   4.491  -8.219  -0.873
  589    HE1  PHE  77           HE1      PHE  77   7.116  -5.738   2.467
  590    HE2  PHE  77           HE2      PHE  77   5.555  -9.423   0.991
  591    HZ   PHE  77           HZ       PHE  77   6.869  -8.182   2.666
  592    H    ILE  78           H        ILE  78   1.344  -5.963   0.568
  593    HA   ILE  78           HA       ILE  78   1.501  -3.390   1.899
  594    HB   ILE  78           HB       ILE  78  -0.173  -5.856   2.395
  595   1HG1  ILE  78          1HG1      ILE  78  -2.037  -4.171   2.110
  596   2HG1  ILE  78          2HG1      ILE  78  -0.814  -3.011   1.612
  597   1HG2  ILE  78          1HG2      ILE  78   0.481  -4.996   4.574
  598   2HG2  ILE  78          2HG2      ILE  78  -0.072  -3.385   4.115
  599   3HG2  ILE  78          3HG2      ILE  78  -1.232  -4.705   4.271
  600   1HD1  ILE  78          1HD1      ILE  78  -0.218  -4.455  -0.261
  601   2HD1  ILE  78          2HD1      ILE  78  -1.457  -5.606   0.240
  602   3HD1  ILE  78          3HD1      ILE  78  -1.919  -3.991  -0.298
  603    H    TYR  79           H        TYR  79   3.066  -2.995   3.346
  604    HA   TYR  79           HA       TYR  79   4.263  -5.262   4.744
  605   1HB   TYR  79          1HB       TYR  79   5.776  -3.562   3.747
  606   2HB   TYR  79          2HB       TYR  79   5.086  -2.351   4.826
  607    HD1  TYR  79           HD1      TYR  79   5.687  -2.278   7.154
  608    HD2  TYR  79           HD2      TYR  79   7.152  -5.390   4.654
  609    HE1  TYR  79           HE1      TYR  79   7.266  -2.940   8.916
  610    HE2  TYR  79           HE2      TYR  79   8.739  -6.059   6.408
  611    HH   TYR  79           HH       TYR  79   8.474  -5.087   9.573
  612    H    LYS  80           H        LYS  80   3.550  -5.835   6.648
  613    HA   LYS  80           HA       LYS  80   1.647  -4.291   8.105
  614   1HB   LYS  80          1HB       LYS  80   3.177  -6.773   8.922
  615   2HB   LYS  80          2HB       LYS  80   1.755  -6.128   9.734
  616   1HG   LYS  80          1HG       LYS  80   0.380  -6.585   7.826
  617   2HG   LYS  80          2HG       LYS  80   1.787  -7.054   6.870
  618   1HD   LYS  80          1HD       LYS  80   2.185  -8.912   8.453
  619   2HD   LYS  80          2HD       LYS  80   0.700  -8.472   9.300
  620   1HE   LYS  80          1HE       LYS  80  -0.607  -8.918   7.316
  621   2HE   LYS  80          2HE       LYS  80   0.856  -9.237   6.386
  622   1HZ   LYS  80          1HZ       LYS  80   1.302 -11.133   7.837
  623   2HZ   LYS  80          2HZ       LYS  80  -0.139 -10.837   8.686
  624   3HZ   LYS  80          3HZ       LYS  80  -0.189 -11.291   7.052
  625    H    MET  81           H        MET  81   2.439  -2.396   8.852
  626    HA   MET  81           HA       MET  81   5.108  -2.188   9.882
  627   1HB   MET  81          1HB       MET  81   4.136  -0.377   8.560
  628   2HB   MET  81          2HB       MET  81   2.891  -0.138   9.777
  629   1HG   MET  81          1HG       MET  81   4.653   0.452  11.405
  630   2HG   MET  81          2HG       MET  81   5.848   0.310  10.117
  631   1HE   MET  81          1HE       MET  81   5.894   1.890   7.969
  632   2HE   MET  81          2HE       MET  81   4.725   3.182   7.685
  633   3HE   MET  81          3HE       MET  81   4.205   1.498   7.635
  634    H    GLU  82           H        GLU  82   2.203  -0.834  11.436
  635    HA   GLU  82           HA       GLU  82   3.150  -2.013  13.962
  636   1HB   GLU  82          1HB       GLU  82   2.608   0.065  15.128
  637   2HB   GLU  82          2HB       GLU  82   3.824   0.340  13.888
  638   1HG   GLU  82          1HG       GLU  82   2.144   1.265  12.410
  639   2HG   GLU  82          2HG       GLU  82   0.887   0.927  13.598
  640    H    GLY  83           H        GLY  83   1.544  -2.349  15.571
  641   1HA   GLY  83          1HA       GLY  83  -0.549  -2.951  16.322
  642   2HA   GLY  83          2HA       GLY  83  -1.227  -1.902  15.084
  643    H    CYS  84           H        CYS  84   0.900  -4.049  13.705
  644    HA   CYS  84           HA       CYS  84  -1.333  -5.714  12.765
  645   1HB   CYS  84          1HB       CYS  84   1.301  -5.164  11.385
  646   2HB   CYS  84          2HB       CYS  84  -0.099  -5.980  10.700
  647    HG   CYS  84           HG       CYS  84  -0.359  -2.745  11.734
  648    H    ASN  85           H        ASN  85  -1.312  -7.645  13.710
  649    HA   ASN  85           HA       ASN  85   1.284  -8.878  14.329
  650   1HB   ASN  85          1HB       ASN  85  -1.460  -9.362  15.509
  651   2HB   ASN  85          2HB       ASN  85  -0.039 -10.334  15.887
  652   1HD2  ASN  85          2HD2      ASN  85   1.583  -9.468  17.146
  653   2HD2  ASN  85          1HD2      ASN  85   1.383  -8.011  18.059
  Start of MODEL    5
    1    H    MET   1           H        MET   1  12.916  -1.175 -11.389
    2    HA   MET   1           HA       MET   1  11.125   0.346 -10.891
    3   1HB   MET   1          1HB       MET   1  10.798  -2.084 -10.541
    4   2HB   MET   1          2HB       MET   1  11.338  -1.907  -8.877
    5   1HG   MET   1          1HG       MET   1   9.439  -0.432  -8.423
    6   2HG   MET   1          2HG       MET   1   8.895  -0.627 -10.088
    7   1HE   MET   1          1HE       MET   1   9.244  -2.227  -6.567
    8   2HE   MET   1          2HE       MET   1  10.360  -3.228  -7.495
    9   3HE   MET   1          3HE       MET   1   8.866  -3.923  -6.867
   10    H    GLN   2           H        GLN   2  10.248   1.898  -9.610
   11    HA   GLN   2           HA       GLN   2  11.694   2.517  -7.122
   12   1HB   GLN   2          1HB       GLN   2  10.176   4.302  -9.027
   13   2HB   GLN   2          2HB       GLN   2  10.665   4.823  -7.423
   14   1HG   GLN   2          1HG       GLN   2  12.423   5.619  -8.586
   15   2HG   GLN   2          2HG       GLN   2  13.027   3.995  -8.283
   16   1HE2  GLN   2          2HE2      GLN   2  13.742   5.833 -10.368
   17   2HE2  GLN   2          1HE2      GLN   2  13.400   5.043 -11.875
   18    H    ILE   3           H        ILE   3  10.645   1.969  -5.343
   19    HA   ILE   3           HA       ILE   3   7.837   1.342  -5.452
   20    HB   ILE   3           HB       ILE   3   8.091   0.789  -3.026
   21   1HG1  ILE   3          1HG1      ILE   3  11.019   1.351  -3.547
   22   2HG1  ILE   3          2HG1      ILE   3   9.962   2.351  -2.556
   23   1HG2  ILE   3          1HG2      ILE   3   8.305  -0.919  -4.719
   24   2HG2  ILE   3          2HG2      ILE   3  10.006  -0.515  -4.952
   25   3HG2  ILE   3          3HG2      ILE   3   9.466  -1.213  -3.426
   26   1HD1  ILE   3          1HD1      ILE   3   9.651   0.483  -1.015
   27   2HD1  ILE   3          2HD1      ILE   3  10.722  -0.507  -2.008
   28   3HD1  ILE   3          3HD1      ILE   3  11.351   0.920  -1.185
   29    H    HIS   4           H        HIS   4   6.217   2.592  -4.934
   30    HA   HIS   4           HA       HIS   4   6.748   5.231  -3.801
   31   1HB   HIS   4          1HB       HIS   4   4.129   4.093  -4.823
   32   2HB   HIS   4          2HB       HIS   4   4.461   5.778  -4.434
   33    HD1  HIS   4           HD1      HIS   4   5.695   7.183  -6.210
   34    HD2  HIS   4           HD2      HIS   4   5.239   3.181  -7.251
   35    HE1  HIS   4           HE1      HIS   4   6.347   7.030  -8.629
   36    HE2  HIS   4           HE2      HIS   4   6.224   4.580  -9.196
   37    H    VAL   5           H        VAL   5   6.653   5.480  -1.686
   38    HA   VAL   5           HA       VAL   5   5.558   3.347  -0.052
   39    HB   VAL   5           HB       VAL   5   6.891   5.890   0.889
   40   1HG1  VAL   5          1HG1      VAL   5   7.441   4.545   2.872
   41   2HG1  VAL   5          2HG1      VAL   5   5.701   4.698   2.624
   42   3HG1  VAL   5          3HG1      VAL   5   6.523   3.198   2.196
   43   1HG2  VAL   5          1HG2      VAL   5   8.388   4.784  -0.666
   44   2HG2  VAL   5          2HG2      VAL   5   8.985   4.603   0.983
   45   3HG2  VAL   5          3HG2      VAL   5   8.179   3.252   0.184
   46    H    TYR   6           H        TYR   6   3.447   3.383   0.410
   47    HA   TYR   6           HA       TYR   6   2.192   5.983   0.988
   48   1HB   TYR   6          1HB       TYR   6   1.054   3.388  -0.022
   49   2HB   TYR   6          2HB       TYR   6   0.029   4.640   0.666
   50    HD1  TYR   6           HD1      TYR   6  -0.237   6.794  -0.489
   51    HD2  TYR   6           HD2      TYR   6   2.011   3.621  -2.214
   52    HE1  TYR   6           HE1      TYR   6  -0.375   7.896  -2.680
   53    HE2  TYR   6           HE2      TYR   6   1.883   4.718  -4.411
   54    HH   TYR   6           HH       TYR   6   0.409   6.336  -5.574
   55    H    ASP   7           H        ASP   7   1.840   6.425   3.029
   56    HA   ASP   7           HA       ASP   7   1.671   4.297   5.030
   57   1HB   ASP   7          1HB       ASP   7   3.110   6.208   5.545
   58   2HB   ASP   7          2HB       ASP   7   1.771   7.317   5.294
   59    H    THR   8           H        THR   8  -0.299   3.402   5.092
   60    HA   THR   8           HA       THR   8  -2.622   5.097   4.543
   61    HB   THR   8           HB       THR   8  -2.554   2.079   4.690
   62    HG1  THR   8           HG1      THR   8  -1.138   3.053   3.042
   63   1HG2  THR   8          1HG2      THR   8  -4.592   2.256   3.326
   64   2HG2  THR   8          2HG2      THR   8  -4.781   3.075   4.875
   65   3HG2  THR   8          3HG2      THR   8  -4.494   4.014   3.410
   66    H    TYR   9           H        TYR   9  -3.896   5.744   6.112
   67    HA   TYR   9           HA       TYR   9  -3.587   4.627   8.785
   68   1HB   TYR   9          1HB       TYR   9  -5.312   6.955   7.918
   69   2HB   TYR   9          2HB       TYR   9  -4.827   6.547   9.559
   70    HD1  TYR   9           HD1      TYR   9  -4.105   8.533   6.734
   71    HD2  TYR   9           HD2      TYR   9  -2.262   6.540  10.007
   72    HE1  TYR   9           HE1      TYR   9  -2.137   9.987   6.503
   73    HE2  TYR   9           HE2      TYR   9  -0.293   7.987   9.786
   74    HH   TYR   9           HH       TYR   9   0.798   9.304   7.922
   75    H    VAL  10           H        VAL  10  -4.653   2.604   8.449
   76    HA   VAL  10           HA       VAL  10  -7.528   2.791   7.907
   77    HB   VAL  10           HB       VAL  10  -5.777   0.339   8.193
   78   1HG1  VAL  10          1HG1      VAL  10  -8.683   0.547   7.394
   79   2HG1  VAL  10          2HG1      VAL  10  -7.719  -0.929   7.432
   80   3HG1  VAL  10          3HG1      VAL  10  -8.083  -0.074   8.931
   81   1HG2  VAL  10          1HG2      VAL  10  -7.045   1.606   5.764
   82   2HG2  VAL  10          2HG2      VAL  10  -5.325   1.591   6.155
   83   3HG2  VAL  10          3HG2      VAL  10  -6.157   0.081   5.781
   84    H    LYS  11           H        LYS  11  -8.539   3.455   9.702
   85    HA   LYS  11           HA       LYS  11  -7.749   2.527  12.308
   86   1HB   LYS  11          1HB       LYS  11 -10.240   4.056  11.520
   87   2HB   LYS  11          2HB       LYS  11  -9.635   3.824  13.155
   88   1HG   LYS  11          1HG       LYS  11  -8.868   5.926  12.742
   89   2HG   LYS  11          2HG       LYS  11  -7.489   4.987  12.170
   90   1HD   LYS  11          1HD       LYS  11  -8.429   5.119   9.871
   91   2HD   LYS  11          2HD       LYS  11  -9.693   6.183  10.494
   92   1HE   LYS  11          1HE       LYS  11  -7.817   7.666  11.343
   93   2HE   LYS  11          2HE       LYS  11  -6.731   6.688  10.357
   94   1HZ   LYS  11          1HZ       LYS  11  -9.004   8.344   9.428
   95   2HZ   LYS  11          2HZ       LYS  11  -7.361   8.575   9.087
   96   3HZ   LYS  11          3HZ       LYS  11  -8.190   7.247   8.426
   97    H    ALA  12           H        ALA  12  -7.971   0.369  12.395
   98    HA   ALA  12           HA       ALA  12 -10.082  -1.091  11.221
   99   1HB   ALA  12          1HB       ALA  12  -9.139  -3.004  12.380
  100   2HB   ALA  12          2HB       ALA  12  -7.849  -2.028  11.672
  101   3HB   ALA  12          3HB       ALA  12  -8.180  -1.938  13.405
  102    H    LYS  13           H        LYS  13 -11.788  -2.237  12.219
  103    HA   LYS  13           HA       LYS  13 -13.212  -0.710  14.125
  104   1HB   LYS  13          1HB       LYS  13 -14.786  -2.696  14.141
  105   2HB   LYS  13          2HB       LYS  13 -14.510  -1.927  12.585
  106   1HG   LYS  13          1HG       LYS  13 -12.972  -3.693  11.959
  107   2HG   LYS  13          2HG       LYS  13 -13.171  -4.450  13.542
  108   1HD   LYS  13          1HD       LYS  13 -15.447  -3.966  11.628
  109   2HD   LYS  13          2HD       LYS  13 -14.524  -5.469  11.684
  110   1HE   LYS  13          1HE       LYS  13 -15.908  -4.301  14.086
  111   2HE   LYS  13          2HE       LYS  13 -16.689  -5.440  12.989
  112   1HZ   LYS  13          1HZ       LYS  13 -15.145  -7.112  13.547
  113   2HZ   LYS  13          2HZ       LYS  13 -14.125  -6.029  14.366
  114   3HZ   LYS  13          3HZ       LYS  13 -15.640  -6.434  15.017
  115    H    ASP  14           H        ASP  14 -10.734  -2.907  14.574
  116    HA   ASP  14           HA       ASP  14 -11.370  -3.967  17.116
  117   1HB   ASP  14          1HB       ASP  14  -9.514  -4.900  15.920
  118   2HB   ASP  14          2HB       ASP  14  -8.736  -3.328  15.780
  119    H    GLY  15           H        GLY  15 -10.118  -0.884  16.033
  120   1HA   GLY  15          1HA       GLY  15 -10.817   0.948  17.624
  121   2HA   GLY  15          2HA       GLY  15  -9.962   0.012  18.841
  122    H    HIS  16           H        HIS  16  -7.733  -0.749  17.270
  123    HA   HIS  16           HA       HIS  16  -6.248   1.716  17.518
  124   1HB   HIS  16          1HB       HIS  16  -4.260   0.389  17.332
  125   2HB   HIS  16          2HB       HIS  16  -5.373  -0.463  18.389
  126    HD1  HIS  16           HD1      HIS  16  -6.481  -2.663  17.414
  127    HD2  HIS  16           HD2      HIS  16  -3.496  -0.972  15.052
  128    HE1  HIS  16           HE1      HIS  16  -5.839  -4.432  15.755
  129    HE2  HIS  16           HE2      HIS  16  -3.848  -3.486  14.552
  130    H    VAL  17           H        VAL  17  -5.008   2.704  15.921
  131    HA   VAL  17           HA       VAL  17  -6.087   2.437  13.245
  132    HB   VAL  17           HB       VAL  17  -3.842   4.247  14.147
  133   1HG1  VAL  17          1HG1      VAL  17  -4.511   5.599  12.218
  134   2HG1  VAL  17          2HG1      VAL  17  -4.032   3.973  11.737
  135   3HG1  VAL  17          3HG1      VAL  17  -5.740   4.403  11.809
  136   1HG2  VAL  17          1HG2      VAL  17  -6.805   4.811  14.107
  137   2HG2  VAL  17          2HG2      VAL  17  -5.794   4.657  15.543
  138   3HG2  VAL  17          3HG2      VAL  17  -5.538   5.996  14.425
  139    H    MET  18           H        MET  18  -5.344   0.913  11.977
  140    HA   MET  18           HA       MET  18  -2.789  -0.336  12.448
  141   1HB   MET  18          1HB       MET  18  -4.728  -1.695  11.876
  142   2HB   MET  18          2HB       MET  18  -4.931  -0.820  10.368
  143   1HG   MET  18          1HG       MET  18  -2.894  -1.726   9.503
  144   2HG   MET  18          2HG       MET  18  -2.521  -2.486  11.049
  145   1HE   MET  18          1HE       MET  18  -6.106  -3.734   8.419
  146   2HE   MET  18          2HE       MET  18  -5.010  -2.415   8.002
  147   3HE   MET  18          3HE       MET  18  -6.081  -2.266   9.396
  148    H    HIS  19           H        HIS  19  -0.952   0.331  11.589
  149    HA   HIS  19           HA       HIS  19  -1.055   2.016   9.172
  150   1HB   HIS  19          1HB       HIS  19   1.086   1.869  11.312
  151   2HB   HIS  19          2HB       HIS  19   1.131   2.911   9.895
  152    HD1  HIS  19           HD1      HIS  19   0.595   3.227  13.311
  153    HD2  HIS  19           HD2      HIS  19  -1.546   4.523   9.981
  154    HE1  HIS  19           HE1      HIS  19  -0.847   5.118  14.120
  155    HE2  HIS  19           HE2      HIS  19  -2.030   5.979  12.070
  156    H    PHE  20           H        PHE  20  -0.190   1.225   7.362
  157    HA   PHE  20           HA       PHE  20   2.011  -0.659   7.536
  158   1HB   PHE  20          1HB       PHE  20   0.916  -2.231   5.932
  159   2HB   PHE  20          2HB       PHE  20   0.163  -2.191   7.520
  160    HD1  PHE  20           HD1      PHE  20  -0.281  -1.634   3.977
  161    HD2  PHE  20           HD2      PHE  20  -2.009  -1.036   7.820
  162    HE1  PHE  20           HE1      PHE  20  -2.469  -1.220   2.926
  163    HE2  PHE  20           HE2      PHE  20  -4.196  -0.622   6.777
  164    HZ   PHE  20           HZ       PHE  20  -4.429  -0.714   4.328
  165    H    ASP  21           H        ASP  21   3.285  -0.758   5.709
  166    HA   ASP  21           HA       ASP  21   3.121   1.586   4.016
  167   1HB   ASP  21          1HB       ASP  21   5.189  -0.618   4.219
  168   2HB   ASP  21          2HB       ASP  21   5.315   0.759   3.131
  169    H    VAL  22           H        VAL  22   1.929   1.516   2.252
  170    HA   VAL  22           HA       VAL  22   1.618  -0.994   0.799
  171    HB   VAL  22           HB       VAL  22   0.443   1.717   0.142
  172   1HG1  VAL  22          1HG1      VAL  22  -0.222  -1.048  -0.860
  173   2HG1  VAL  22          2HG1      VAL  22  -1.135   0.415  -1.231
  174   3HG1  VAL  22          3HG1      VAL  22   0.533   0.253  -1.781
  175   1HG2  VAL  22          1HG2      VAL  22  -1.636   0.863   1.115
  176   2HG2  VAL  22          2HG2      VAL  22  -0.790  -0.598   1.627
  177   3HG2  VAL  22          3HG2      VAL  22  -0.345   0.965   2.312
  178    H    PHE  23           H        PHE  23   3.514  -1.417  -0.197
  179    HA   PHE  23           HA       PHE  23   4.915   0.664  -1.644
  180   1HB   PHE  23          1HB       PHE  23   5.459  -2.295  -1.342
  181   2HB   PHE  23          2HB       PHE  23   6.482  -1.197  -2.259
  182    HD1  PHE  23           HD1      PHE  23   7.201   0.970  -0.881
  183    HD2  PHE  23           HD2      PHE  23   6.076  -2.765   0.812
  184    HE1  PHE  23           HE1      PHE  23   8.451   1.526   1.163
  185    HE2  PHE  23           HE2      PHE  23   7.323  -2.216   2.861
  186    HZ   PHE  23           HZ       PHE  23   8.509  -0.067   3.038
  187    H    THR  24           H        THR  24   4.286   1.257  -3.573
  188    HA   THR  24           HA       THR  24   3.091  -0.764  -5.351
  189    HB   THR  24           HB       THR  24   1.916   1.230  -6.419
  190    HG1  THR  24           HG1      THR  24   2.401   2.477  -3.915
  191   1HG2  THR  24          1HG2      THR  24   0.741  -0.389  -4.998
  192   2HG2  THR  24          2HG2      THR  24   1.209   0.526  -3.564
  193   3HG2  THR  24          3HG2      THR  24   0.117   1.243  -4.753
  194    H    ASP  25           H        ASP  25   3.614  -0.659  -7.551
  195    HA   ASP  25           HA       ASP  25   6.106   0.711  -8.171
  196   1HB   ASP  25          1HB       ASP  25   6.174  -1.472  -9.003
  197   2HB   ASP  25          2HB       ASP  25   4.492  -1.432  -9.522
  198    H    VAL  26           H        VAL  26   2.748   0.616  -9.253
  199    HA   VAL  26           HA       VAL  26   3.011   2.497 -11.327
  200    HB   VAL  26           HB       VAL  26   1.087   0.968 -11.117
  201   1HG1  VAL  26          1HG1      VAL  26   0.726   1.051  -8.728
  202   2HG1  VAL  26          2HG1      VAL  26   0.253   2.746  -8.830
  203   3HG1  VAL  26          3HG1      VAL  26  -0.750   1.503  -9.579
  204   1HG2  VAL  26          1HG2      VAL  26   0.333   3.886 -11.169
  205   2HG2  VAL  26          2HG2      VAL  26   0.906   2.928 -12.537
  206   3HG2  VAL  26          3HG2      VAL  26  -0.646   2.557 -11.788
  207    H    ARG  27           H        ARG  27   2.840   4.686 -11.382
  208    HA   ARG  27           HA       ARG  27   3.116   6.089  -8.851
  209   1HB   ARG  27          1HB       ARG  27   3.547   8.074 -10.343
  210   2HB   ARG  27          2HB       ARG  27   4.688   6.749 -10.503
  211   1HG   ARG  27          1HG       ARG  27   3.605   6.022 -12.546
  212   2HG   ARG  27          2HG       ARG  27   2.386   7.287 -12.368
  213   1HD   ARG  27          1HD       ARG  27   4.030   9.002 -12.650
  214   2HD   ARG  27          2HD       ARG  27   5.342   7.825 -12.593
  215    HE   ARG  27           HE       ARG  27   4.168   6.918 -14.711
  216   1HH1  ARG  27          1HH1      ARG  27   4.395  10.300 -13.802
  217   2HH1  ARG  27          2HH1      ARG  27   4.429  10.869 -15.441
  218   1HH2  ARG  27          1HH2      ARG  27   4.209   7.670 -16.869
  219   2HH2  ARG  27          2HH2      ARG  27   4.314   9.381 -17.183
  220    H    ASP  28           H        ASP  28   0.589   4.969  -9.339
  221    HA   ASP  28           HA       ASP  28  -1.103   7.339  -9.779
  222   1HB   ASP  28          1HB       ASP  28  -1.426   5.396 -11.352
  223   2HB   ASP  28          2HB       ASP  28  -1.920   4.432  -9.965
  224    H    ASP  29           H        ASP  29  -2.427   7.978  -8.126
  225    HA   ASP  29           HA       ASP  29  -1.865   6.775  -5.556
  226   1HB   ASP  29          1HB       ASP  29  -2.967   8.719  -4.602
  227   2HB   ASP  29          2HB       ASP  29  -1.809   9.225  -5.827
  228    H    LYS  30           H        LYS  30  -4.510   6.895  -7.817
  229    HA   LYS  30           HA       LYS  30  -6.508   6.159  -5.877
  230   1HB   LYS  30          1HB       LYS  30  -7.003   7.486  -7.949
  231   2HB   LYS  30          2HB       LYS  30  -6.695   6.034  -8.891
  232   1HG   LYS  30          1HG       LYS  30  -8.516   4.913  -7.575
  233   2HG   LYS  30          2HG       LYS  30  -8.896   6.495  -6.894
  234   1HD   LYS  30          1HD       LYS  30 -10.366   6.112  -8.741
  235   2HD   LYS  30          2HD       LYS  30  -9.195   7.340  -9.226
  236   1HE   LYS  30          1HE       LYS  30  -7.861   5.551 -10.316
  237   2HE   LYS  30          2HE       LYS  30  -9.146   4.410  -9.926
  238   1HZ   LYS  30          1HZ       LYS  30  -9.359   6.787 -11.690
  239   2HZ   LYS  30          2HZ       LYS  30  -9.405   5.161 -12.166
  240   3HZ   LYS  30          3HZ       LYS  30 -10.671   5.810 -11.239
  241    H    LYS  31           H        LYS  31  -4.712   4.552  -8.465
  242    HA   LYS  31           HA       LYS  31  -5.935   2.026  -8.249
  243   1HB   LYS  31          1HB       LYS  31  -4.359   2.930 -10.072
  244   2HB   LYS  31          2HB       LYS  31  -3.048   2.442  -9.007
  245   1HG   LYS  31          1HG       LYS  31  -3.798   0.134  -9.102
  246   2HG   LYS  31          2HG       LYS  31  -5.168   0.607 -10.112
  247   1HD   LYS  31          1HD       LYS  31  -3.524   1.480 -11.785
  248   2HD   LYS  31          2HD       LYS  31  -2.238   0.775 -10.806
  249   1HE   LYS  31          1HE       LYS  31  -4.532  -0.759 -12.025
  250   2HE   LYS  31          2HE       LYS  31  -2.912  -0.654 -12.707
  251   1HZ   LYS  31          1HZ       LYS  31  -3.097  -2.684 -11.510
  252   2HZ   LYS  31          2HZ       LYS  31  -2.079  -1.666 -10.616
  253   3HZ   LYS  31          3HZ       LYS  31  -3.689  -1.903 -10.130
  254    H    ALA  32           H        ALA  32  -3.358   3.562  -6.459
  255    HA   ALA  32           HA       ALA  32  -2.448   1.291  -5.037
  256   1HB   ALA  32          1HB       ALA  32  -2.376   4.184  -4.182
  257   2HB   ALA  32          2HB       ALA  32  -1.391   2.873  -3.535
  258   3HB   ALA  32          3HB       ALA  32  -1.175   3.396  -5.205
  259    H    ILE  33           H        ILE  33  -5.044   3.590  -4.535
  260    HA   ILE  33           HA       ILE  33  -5.769   2.839  -1.921
  261    HB   ILE  33           HB       ILE  33  -7.401   4.028  -4.168
  262   1HG1  ILE  33          1HG1      ILE  33  -6.216   5.230  -1.655
  263   2HG1  ILE  33          2HG1      ILE  33  -5.586   5.432  -3.285
  264   1HG2  ILE  33          1HG2      ILE  33  -8.891   2.822  -2.664
  265   2HG2  ILE  33          2HG2      ILE  33  -8.201   3.674  -1.283
  266   3HG2  ILE  33          3HG2      ILE  33  -9.108   4.565  -2.506
  267   1HD1  ILE  33          1HD1      ILE  33  -7.606   6.618  -3.930
  268   2HD1  ILE  33          2HD1      ILE  33  -8.268   6.386  -2.312
  269   3HD1  ILE  33          3HD1      ILE  33  -6.833   7.385  -2.543
  270    H    GLU  34           H        GLU  34  -6.898   1.718  -5.102
  271    HA   GLU  34           HA       GLU  34  -8.745  -0.180  -4.267
  272   1HB   GLU  34          1HB       GLU  34  -7.012   0.073  -6.683
  273   2HB   GLU  34          2HB       GLU  34  -7.868  -1.438  -6.420
  274   1HG   GLU  34          1HG       GLU  34  -9.201  -0.109  -7.847
  275   2HG   GLU  34          2HG       GLU  34  -9.981  -0.121  -6.268
  276    H    PHE  35           H        PHE  35  -5.239  -0.469  -4.611
  277    HA   PHE  35           HA       PHE  35  -5.000  -3.210  -4.118
  278   1HB   PHE  35          1HB       PHE  35  -3.083  -0.987  -3.393
  279   2HB   PHE  35          2HB       PHE  35  -2.683  -2.700  -3.405
  280    HD1  PHE  35           HD1      PHE  35  -1.530  -0.254  -5.000
  281    HD2  PHE  35           HD2      PHE  35  -4.240  -3.398  -5.932
  282    HE1  PHE  35           HE1      PHE  35  -0.912  -0.078  -7.372
  283    HE2  PHE  35           HE2      PHE  35  -3.620  -3.232  -8.306
  284    HZ   PHE  35           HZ       PHE  35  -1.956  -1.571  -9.026
  285    H    ALA  36           H        ALA  36  -4.961  -0.475  -1.864
  286    HA   ALA  36           HA       ALA  36  -4.565  -1.997   0.474
  287   1HB   ALA  36          1HB       ALA  36  -5.875   0.701   0.154
  288   2HB   ALA  36          2HB       ALA  36  -5.305   0.006   1.672
  289   3HB   ALA  36          3HB       ALA  36  -4.154   0.402   0.397
  290    H    LYS  37           H        LYS  37  -7.493  -0.885  -1.174
  291    HA   LYS  37           HA       LYS  37  -9.305  -1.730   0.823
  292   1HB   LYS  37          1HB       LYS  37  -9.754  -1.297  -2.136
  293   2HB   LYS  37          2HB       LYS  37 -11.034  -1.529  -0.950
  294   1HG   LYS  37          1HG       LYS  37 -10.213   0.492   0.240
  295   2HG   LYS  37          2HG       LYS  37  -9.072   0.750  -1.078
  296   1HD   LYS  37          1HD       LYS  37 -10.886   2.140  -1.590
  297   2HD   LYS  37          2HD       LYS  37 -11.114   0.724  -2.617
  298   1HE   LYS  37          1HE       LYS  37 -12.439   0.980   0.068
  299   2HE   LYS  37          2HE       LYS  37 -13.160   1.650  -1.392
  300   1HZ   LYS  37          1HZ       LYS  37 -12.463  -1.215  -0.990
  301   2HZ   LYS  37          2HZ       LYS  37 -14.015  -0.554  -0.862
  302   3HZ   LYS  37          3HZ       LYS  37 -13.217  -0.548  -2.356
  303    H    GLN  38           H        GLN  38  -7.931  -3.370  -1.982
  304    HA   GLN  38           HA       GLN  38  -9.555  -5.666  -1.901
  305   1HB   GLN  38          1HB       GLN  38  -6.717  -5.283  -2.853
  306   2HB   GLN  38          2HB       GLN  38  -7.595  -6.794  -3.037
  307   1HG   GLN  38          1HG       GLN  38  -9.263  -5.681  -4.407
  308   2HG   GLN  38          2HG       GLN  38  -8.433  -4.141  -4.190
  309   1HE2  GLN  38          2HE2      GLN  38  -6.487  -3.782  -5.252
  310   2HE2  GLN  38          1HE2      GLN  38  -5.963  -4.766  -6.574
  311    H    TRP  39           H        TRP  39  -6.529  -4.874  -0.251
  312    HA   TRP  39           HA       TRP  39  -6.203  -7.405   0.983
  313   1HB   TRP  39          1HB       TRP  39  -4.341  -5.824   0.708
  314   2HB   TRP  39          2HB       TRP  39  -5.123  -4.702   1.816
  315    HD1  TRP  39           HD1      TRP  39  -3.783  -8.349   1.918
  316    HE1  TRP  39           HE1      TRP  39  -2.766  -8.752   4.255
  317    HE3  TRP  39           HE3      TRP  39  -4.866  -3.836   4.054
  318    HZ2  TRP  39           HZ2      TRP  39  -2.464  -7.333   6.669
  319    HZ3  TRP  39           HZ3      TRP  39  -4.176  -3.437   6.380
  320    HH2  TRP  39           HH2      TRP  39  -3.000  -5.152   7.660
  321    H    LEU  40           H        LEU  40  -7.755  -4.388   1.996
  322    HA   LEU  40           HA       LEU  40  -8.398  -5.139   4.616
  323   1HB   LEU  40          1HB       LEU  40  -9.905  -3.342   2.719
  324   2HB   LEU  40          2HB       LEU  40 -10.264  -3.498   4.427
  325    HG   LEU  40           HG       LEU  40  -7.727  -2.395   3.222
  326   1HD1  LEU  40          1HD1      LEU  40  -9.633  -0.886   3.113
  327   2HD1  LEU  40          2HD1      LEU  40  -9.921  -1.108   4.839
  328   3HD1  LEU  40          3HD1      LEU  40  -8.444  -0.319   4.286
  329   1HD2  LEU  40          1HD2      LEU  40  -7.044  -1.932   5.523
  330   2HD2  LEU  40          2HD2      LEU  40  -8.472  -2.777   6.121
  331   3HD2  LEU  40          3HD2      LEU  40  -7.226  -3.665   5.243
  332    H    SER  41           H        SER  41 -10.113  -5.684   1.569
  333    HA   SER  41           HA       SER  41 -12.383  -6.932   2.660
  334   1HB   SER  41          1HB       SER  41 -11.100  -7.489  -0.023
  335   2HB   SER  41          2HB       SER  41 -12.783  -7.767   0.423
  336    HG   SER  41           HG       SER  41 -13.155  -5.607   0.457
  337    H    SER  42           H        SER  42  -9.177  -8.129   1.868
  338    HA   SER  42           HA       SER  42  -9.768 -10.888   2.030
  339   1HB   SER  42          1HB       SER  42  -7.130  -9.499   2.543
  340   2HB   SER  42          2HB       SER  42  -7.354 -11.204   2.161
  341    HG   SER  42           HG       SER  42  -8.578  -9.775   0.281
  342    H    ILE  43           H        ILE  43  -8.492  -8.581   4.419
  343    HA   ILE  43           HA       ILE  43  -8.274 -10.618   6.442
  344    HB   ILE  43           HB       ILE  43  -7.578  -8.815   7.946
  345   1HG1  ILE  43          1HG1      ILE  43  -8.126  -6.976   5.601
  346   2HG1  ILE  43          2HG1      ILE  43  -9.073  -7.046   7.084
  347   1HG2  ILE  43          1HG2      ILE  43  -5.935  -9.864   6.487
  348   2HG2  ILE  43          2HG2      ILE  43  -6.277  -8.675   5.229
  349   3HG2  ILE  43          3HG2      ILE  43  -5.546  -8.163   6.752
  350   1HD1  ILE  43          1HD1      ILE  43  -7.558  -5.156   7.100
  351   2HD1  ILE  43          2HD1      ILE  43  -7.123  -6.313   8.358
  352   3HD1  ILE  43          3HD1      ILE  43  -6.183  -6.236   6.867
  353    H    GLY  44           H        GLY  44 -10.678  -8.324   5.469
  354   1HA   GLY  44          1HA       GLY  44 -12.957  -8.615   6.116
  355   2HA   GLY  44          2HA       GLY  44 -12.403  -9.311   7.634
  356    H    GLU  45           H        GLU  45 -11.306  -6.327   6.107
  357    HA   GLU  45           HA       GLU  45 -12.493  -4.811   8.334
  358   1HB   GLU  45          1HB       GLU  45 -10.047  -5.230   8.668
  359   2HB   GLU  45          2HB       GLU  45  -9.733  -4.369   7.171
  360   1HG   GLU  45          1HG       GLU  45  -9.331  -3.004   9.167
  361   2HG   GLU  45          2HG       GLU  45 -10.566  -2.321   8.113
  362    H    GLU  46           H        GLU  46 -13.374  -5.285   5.566
  363    HA   GLU  46           HA       GLU  46 -12.923  -2.831   4.148
  364   1HB   GLU  46          1HB       GLU  46 -13.490  -4.934   2.960
  365   2HB   GLU  46          2HB       GLU  46 -15.085  -4.898   3.702
  366   1HG   GLU  46          1HG       GLU  46 -15.522  -2.743   2.597
  367   2HG   GLU  46          2HG       GLU  46 -13.950  -2.853   1.808
  368    H    GLY  47           H        GLY  47 -13.412  -1.355   5.776
  369   1HA   GLY  47          1HA       GLY  47 -16.223  -0.585   5.728
  370   2HA   GLY  47          2HA       GLY  47 -15.478  -0.794   7.309
  371    H    ALA  48           H        ALA  48 -13.009   0.146   6.959
  372    HA   ALA  48           HA       ALA  48 -13.208   2.923   7.018
  373   1HB   ALA  48          1HB       ALA  48 -11.373   1.683   8.054
  374   2HB   ALA  48          2HB       ALA  48 -10.769   1.238   6.458
  375   3HB   ALA  48          3HB       ALA  48 -10.767   2.928   6.961
  376    H    THR  49           H        THR  49 -13.560   4.309   5.448
  377    HA   THR  49           HA       THR  49 -13.405   3.549   2.688
  378    HB   THR  49           HB       THR  49 -13.820   6.323   3.823
  379    HG1  THR  49           HG1      THR  49 -15.348   4.177   4.128
  380   1HG2  THR  49          1HG2      THR  49 -15.013   6.718   1.715
  381   2HG2  THR  49          2HG2      THR  49 -13.336   6.258   1.422
  382   3HG2  THR  49          3HG2      THR  49 -14.627   5.080   1.189
  383    H    VAL  50           H        VAL  50 -11.282   3.098   2.193
  384    HA   VAL  50           HA       VAL  50  -9.118   4.815   2.853
  385    HB   VAL  50           HB       VAL  50  -9.249   2.742   0.655
  386   1HG1  VAL  50          1HG1      VAL  50  -6.886   3.982   2.064
  387   2HG1  VAL  50          2HG1      VAL  50  -6.810   2.683   0.873
  388   3HG1  VAL  50          3HG1      VAL  50  -7.381   4.281   0.397
  389   1HG2  VAL  50          1HG2      VAL  50  -9.806   1.753   2.803
  390   2HG2  VAL  50          2HG2      VAL  50  -8.205   1.230   2.279
  391   3HG2  VAL  50          3HG2      VAL  50  -8.363   2.466   3.525
  392    H    THR  51           H        THR  51  -8.677   6.696   2.002
  393    HA   THR  51           HA       THR  51  -9.104   7.166  -0.836
  394    HB   THR  51           HB       THR  51 -11.148   8.002   0.261
  395    HG1  THR  51           HG1      THR  51 -10.483   9.126  -1.565
  396   1HG2  THR  51          1HG2      THR  51  -9.281   9.795   1.793
  397   2HG2  THR  51          2HG2      THR  51 -11.037   9.945   1.766
  398   3HG2  THR  51          3HG2      THR  51 -10.286   8.511   2.462
  399    H    SER  52           H        SER  52  -8.448   9.777  -0.937
  400    HA   SER  52           HA       SER  52  -5.713   9.880  -0.952
  401   1HB   SER  52          1HB       SER  52  -7.823  12.014  -0.759
  402   2HB   SER  52          2HB       SER  52  -6.117  12.392  -1.043
  403    HG   SER  52           HG       SER  52  -6.202  11.324  -2.974
  404    H    GLU  53           H        GLU  53  -7.889  10.925   1.649
  405    HA   GLU  53           HA       GLU  53  -5.806  12.100   3.213
  406   1HB   GLU  53          1HB       GLU  53  -8.180  12.799   3.374
  407   2HB   GLU  53          2HB       GLU  53  -8.573  11.237   4.079
  408   1HG   GLU  53          1HG       GLU  53  -7.098  11.728   5.972
  409   2HG   GLU  53          2HG       GLU  53  -6.734  13.303   5.270
  410    H    GLU  54           H        GLU  54  -7.110   8.915   2.894
  411    HA   GLU  54           HA       GLU  54  -6.098   8.006   5.451
  412   1HB   GLU  54          1HB       GLU  54  -7.353   6.454   3.183
  413   2HB   GLU  54          2HB       GLU  54  -6.978   5.813   4.776
  414   1HG   GLU  54          1HG       GLU  54  -8.943   8.007   4.165
  415   2HG   GLU  54          2HG       GLU  54  -9.331   6.338   4.586
  416    H    CYS  55           H        CYS  55  -5.421   7.403   2.021
  417    HA   CYS  55           HA       CYS  55  -2.997   5.958   2.769
  418   1HB   CYS  55          1HB       CYS  55  -4.673   5.179   0.965
  419   2HB   CYS  55          2HB       CYS  55  -3.970   6.439  -0.043
  420    HG   CYS  55           HG       CYS  55  -2.336   3.726   1.253
  421    H    ARG  56           H        ARG  56  -1.599   7.510   3.451
  422    HA   ARG  56           HA       ARG  56  -1.304   9.968   1.919
  423   1HB   ARG  56          1HB       ARG  56  -1.140   9.329   4.630
  424   2HB   ARG  56          2HB       ARG  56   0.521   9.653   4.153
  425   1HG   ARG  56          1HG       ARG  56  -0.567  11.659   4.988
  426   2HG   ARG  56          2HG       ARG  56  -0.142  11.828   3.282
  427   1HD   ARG  56          1HD       ARG  56  -2.439  11.297   2.651
  428   2HD   ARG  56          2HD       ARG  56  -2.869  11.105   4.351
  429    HE   ARG  56           HE       ARG  56  -2.324  13.511   4.597
  430   1HH1  ARG  56          1HH1      ARG  56  -3.084  12.230   1.429
  431   2HH1  ARG  56          2HH1      ARG  56  -3.656  13.747   0.808
  432   1HH2  ARG  56          1HH2      ARG  56  -3.121  15.510   3.797
  433   2HH2  ARG  56          2HH2      ARG  56  -3.725  15.596   2.168
  434    H    PHE  57           H        PHE  57   0.231  10.252   0.450
  435    HA   PHE  57           HA       PHE  57   2.216   8.265  -0.047
  436   1HB   PHE  57          1HB       PHE  57   1.315   9.555  -1.894
  437   2HB   PHE  57          2HB       PHE  57   1.871  11.057  -1.162
  438    HD1  PHE  57           HD1      PHE  57   3.092   7.834  -2.540
  439    HD2  PHE  57           HD2      PHE  57   3.964  11.907  -1.676
  440    HE1  PHE  57           HE1      PHE  57   5.230   7.625  -3.741
  441    HE2  PHE  57           HE2      PHE  57   6.104  11.708  -2.872
  442    HZ   PHE  57           HZ       PHE  57   6.738   9.565  -3.905
  443    H    CYS  58           H        CYS  58   4.169   8.066   0.822
  444    HA   CYS  58           HA       CYS  58   5.172  10.260   2.487
  445   1HB   CYS  58          1HB       CYS  58   5.998   7.353   2.372
  446   2HB   CYS  58          2HB       CYS  58   6.692   8.560   3.449
  447    HG   CYS  58           HG       CYS  58   4.725   6.655   4.575
  448    H    HIS  59           H        HIS  59   6.790   7.744   0.526
  449    HA   HIS  59           HA       HIS  59   8.483   9.818  -0.663
  450   1HB   HIS  59          1HB       HIS  59   9.423   7.596   1.112
  451   2HB   HIS  59          2HB       HIS  59  10.454   8.163  -0.185
  452    HD1  HIS  59           HD1      HIS  59   8.552  10.881   1.401
  453    HD2  HIS  59           HD2      HIS  59  12.175   8.926   1.979
  454    HE1  HIS  59           HE1      HIS  59   9.896  12.380   2.909
  455    HE2  HIS  59           HE2      HIS  59  12.154  11.271   3.075
  456    H    SER  60           H        SER  60  10.085   8.794  -2.162
  457    HA   SER  60           HA       SER  60   9.108   6.315  -3.417
  458   1HB   SER  60          1HB       SER  60  10.469   8.654  -4.803
  459   2HB   SER  60          2HB       SER  60   9.936   7.161  -5.576
  460    HG   SER  60           HG       SER  60   8.531   9.397  -5.049
  461    H    GLU  61           H        GLU  61  10.548   4.764  -2.888
  462    HA   GLU  61           HA       GLU  61  13.252   5.676  -2.145
  463   1HB   GLU  61          1HB       GLU  61  11.753   5.156  -0.230
  464   2HB   GLU  61          2HB       GLU  61  11.577   3.520  -0.836
  465   1HG   GLU  61          1HG       GLU  61  13.144   3.625   1.013
  466   2HG   GLU  61          2HG       GLU  61  13.941   3.109  -0.471
  467    H    LYS  62           H        LYS  62  14.917   4.001  -2.168
  468    HA   LYS  62           HA       LYS  62  15.044   2.487  -4.525
  469   1HB   LYS  62          1HB       LYS  62  16.982   1.342  -3.360
  470   2HB   LYS  62          2HB       LYS  62  17.082   3.096  -3.451
  471   1HG   LYS  62          1HG       LYS  62  16.156   3.183  -1.136
  472   2HG   LYS  62          2HG       LYS  62  16.323   1.431  -1.069
  473   1HD   LYS  62          1HD       LYS  62  18.677   1.554  -1.262
  474   2HD   LYS  62          2HD       LYS  62  18.622   3.261  -1.707
  475   1HE   LYS  62          1HE       LYS  62  17.745   2.161   0.960
  476   2HE   LYS  62          2HE       LYS  62  19.333   2.857   0.642
  477   1HZ   LYS  62          1HZ       LYS  62  16.804   4.347   0.188
  478   2HZ   LYS  62          2HZ       LYS  62  17.658   4.399   1.655
  479   3HZ   LYS  62          3HZ       LYS  62  18.382   4.962   0.229
  480    H    ALA  63           H        ALA  63  14.462   0.456  -5.018
  481    HA   ALA  63           HA       ALA  63  12.582  -0.781  -3.189
  482   1HB   ALA  63          1HB       ALA  63  13.222  -1.428  -6.060
  483   2HB   ALA  63          2HB       ALA  63  11.904  -2.119  -5.112
  484   3HB   ALA  63          3HB       ALA  63  11.906  -0.398  -5.495
  485    HA   PRO  64           HA       PRO  64  15.588  -3.877  -1.891
  486   1HB   PRO  64          1HB       PRO  64  13.119  -5.021  -0.711
  487   2HB   PRO  64          2HB       PRO  64  14.661  -4.635   0.061
  488   1HG   PRO  64          1HG       PRO  64  12.507  -3.123   0.485
  489   2HG   PRO  64          2HG       PRO  64  14.119  -2.398   0.329
  490   1HD   PRO  64          1HD       PRO  64  11.904  -2.538  -1.682
  491   2HD   PRO  64          2HD       PRO  64  13.004  -1.193  -1.307
  492    H    ASP  65           H        ASP  65  16.011  -5.964  -2.539
  493    HA   ASP  65           HA       ASP  65  15.107  -6.725  -5.046
  494   1HB   ASP  65          1HB       ASP  65  17.231  -7.445  -3.935
  495   2HB   ASP  65          2HB       ASP  65  16.289  -8.577  -2.971
  496    H    GLU  66           H        GLU  66  13.981  -7.800  -1.891
  497    HA   GLU  66           HA       GLU  66  12.451  -9.986  -2.743
  498   1HB   GLU  66          1HB       GLU  66  13.071  -9.656  -0.409
  499   2HB   GLU  66          2HB       GLU  66  12.080  -8.206  -0.330
  500   1HG   GLU  66          1HG       GLU  66  10.913 -10.005   0.724
  501   2HG   GLU  66          2HG       GLU  66  10.084  -9.593  -0.776
  502    H    VAL  67           H        VAL  67  11.495  -6.590  -2.206
  503    HA   VAL  67           HA       VAL  67   8.731  -7.146  -2.600
  504    HB   VAL  67           HB       VAL  67   8.327  -4.789  -2.457
  505   1HG1  VAL  67          1HG1      VAL  67   9.430  -4.253  -0.332
  506   2HG1  VAL  67          2HG1      VAL  67   8.826  -5.911  -0.366
  507   3HG1  VAL  67          3HG1      VAL  67  10.547  -5.593  -0.584
  508   1HG2  VAL  67          1HG2      VAL  67  10.068  -3.971  -3.939
  509   2HG2  VAL  67          2HG2      VAL  67  10.135  -3.134  -2.388
  510   3HG2  VAL  67          3HG2      VAL  67  11.303  -4.405  -2.755
  511    H    ILE  68           H        ILE  68  11.320  -6.611  -4.764
  512    HA   ILE  68           HA       ILE  68  10.138  -5.348  -6.935
  513    HB   ILE  68           HB       ILE  68  12.058  -7.680  -7.098
  514   1HG1  ILE  68          1HG1      ILE  68  12.922  -5.890  -5.634
  515   2HG1  ILE  68          2HG1      ILE  68  13.856  -6.031  -7.119
  516   1HG2  ILE  68          1HG2      ILE  68  12.729  -6.648  -9.236
  517   2HG2  ILE  68          2HG2      ILE  68  11.046  -7.179  -9.229
  518   3HG2  ILE  68          3HG2      ILE  68  11.432  -5.468  -9.045
  519   1HD1  ILE  68          1HD1      ILE  68  11.782  -3.948  -6.495
  520   2HD1  ILE  68          2HD1      ILE  68  13.528  -3.718  -6.559
  521   3HD1  ILE  68          3HD1      ILE  68  12.635  -4.101  -8.030
  522    H    GLU  69           H        GLU  69  10.407  -8.852  -6.421
  523    HA   GLU  69           HA       GLU  69   8.691  -9.485  -8.597
  524   1HB   GLU  69          1HB       GLU  69   9.570 -11.241  -6.299
  525   2HB   GLU  69          2HB       GLU  69   8.932 -11.784  -7.848
  526   1HG   GLU  69          1HG       GLU  69  10.860 -10.844  -8.990
  527   2HG   GLU  69          2HG       GLU  69  11.494 -10.256  -7.455
  528    H    ALA  70           H        ALA  70   8.258  -9.134  -5.132
  529    HA   ALA  70           HA       ALA  70   5.741 -10.340  -4.877
  530   1HB   ALA  70          1HB       ALA  70   7.143  -9.778  -2.963
  531   2HB   ALA  70          2HB       ALA  70   6.900  -8.060  -3.281
  532   3HB   ALA  70          3HB       ALA  70   5.536  -9.069  -2.802
  533    H    ILE  71           H        ILE  71   6.629  -6.953  -5.534
  534    HA   ILE  71           HA       ILE  71   3.959  -6.006  -5.631
  535    HB   ILE  71           HB       ILE  71   6.477  -4.835  -6.823
  536   1HG1  ILE  71          1HG1      ILE  71   4.924  -4.169  -4.312
  537   2HG1  ILE  71          2HG1      ILE  71   6.467  -5.012  -4.371
  538   1HG2  ILE  71          1HG2      ILE  71   4.528  -3.998  -8.019
  539   2HG2  ILE  71          2HG2      ILE  71   3.754  -3.575  -6.492
  540   3HG2  ILE  71          3HG2      ILE  71   5.218  -2.735  -7.001
  541   1HD1  ILE  71          1HD1      ILE  71   5.977  -2.174  -5.239
  542   2HD1  ILE  71          2HD1      ILE  71   6.749  -2.689  -3.740
  543   3HD1  ILE  71          3HD1      ILE  71   7.525  -3.018  -5.288
  544    H    LYS  72           H        LYS  72   6.153  -7.291  -8.086
  545    HA   LYS  72           HA       LYS  72   4.607  -6.636 -10.335
  546   1HB   LYS  72          1HB       LYS  72   6.597  -8.827  -9.820
  547   2HB   LYS  72          2HB       LYS  72   5.781  -8.664 -11.370
  548   1HG   LYS  72          1HG       LYS  72   6.638  -6.333 -11.484
  549   2HG   LYS  72          2HG       LYS  72   7.593  -6.671 -10.042
  550   1HD   LYS  72          1HD       LYS  72   8.849  -8.351 -11.166
  551   2HD   LYS  72          2HD       LYS  72   7.763  -8.319 -12.556
  552   1HE   LYS  72          1HE       LYS  72   9.553  -6.064 -11.663
  553   2HE   LYS  72          2HE       LYS  72   9.859  -7.146 -13.021
  554   1HZ   LYS  72          1HZ       LYS  72   7.748  -6.333 -14.005
  555   2HZ   LYS  72          2HZ       LYS  72   7.640  -5.189 -12.762
  556   3HZ   LYS  72          3HZ       LYS  72   8.933  -5.130 -13.857
  557    H    GLN  73           H        GLN  73   4.362  -9.279  -8.071
  558    HA   GLN  73           HA       GLN  73   2.650 -10.875  -9.710
  559   1HB   GLN  73          1HB       GLN  73   3.181 -11.021  -6.740
  560   2HB   GLN  73          2HB       GLN  73   2.316 -12.234  -7.673
  561   1HG   GLN  73          1HG       GLN  73   5.202 -11.448  -8.011
  562   2HG   GLN  73          2HG       GLN  73   4.599 -12.924  -7.260
  563   1HE2  GLN  73          2HE2      GLN  73   5.155 -11.243 -10.236
  564   2HE2  GLN  73          1HE2      GLN  73   4.875 -12.587 -11.292
  565    H    ASN  74           H        ASN  74   2.069  -8.535  -7.109
  566    HA   ASN  74           HA       ASN  74  -0.813  -9.111  -7.358
  567   1HB   ASN  74          1HB       ASN  74   0.685  -7.862  -5.047
  568   2HB   ASN  74          2HB       ASN  74  -1.051  -8.146  -5.098
  569   1HD2  ASN  74          2HD2      ASN  74   2.068  -9.546  -4.660
  570   2HD2  ASN  74          1HD2      ASN  74   1.522 -11.121  -4.179
  571    H    GLY  75           H        GLY  75   1.569  -6.673  -7.756
  572   1HA   GLY  75          1HA       GLY  75   1.127  -4.626  -8.902
  573   2HA   GLY  75          2HA       GLY  75  -0.528  -4.687  -8.305
  574    H    TYR  76           H        TYR  76   1.080  -5.621  -5.732
  575    HA   TYR  76           HA       TYR  76   2.095  -3.123  -4.744
  576   1HB   TYR  76          1HB       TYR  76   0.421  -2.866  -2.962
  577   2HB   TYR  76          2HB       TYR  76  -0.322  -2.725  -4.552
  578    HD1  TYR  76           HD1      TYR  76  -0.191  -4.630  -1.461
  579    HD2  TYR  76           HD2      TYR  76  -1.738  -4.577  -5.425
  580    HE1  TYR  76           HE1      TYR  76  -1.810  -6.377  -0.849
  581    HE2  TYR  76           HE2      TYR  76  -3.360  -6.322  -4.820
  582    HH   TYR  76           HH       TYR  76  -3.696  -8.038  -3.217
  583    H    PHE  77           H        PHE  77   2.704  -3.326  -2.423
  584    HA   PHE  77           HA       PHE  77   2.893  -6.088  -1.452
  585   1HB   PHE  77          1HB       PHE  77   5.077  -5.539  -2.436
  586   2HB   PHE  77          2HB       PHE  77   5.164  -4.081  -1.452
  587    HD1  PHE  77           HD1      PHE  77   6.054  -4.145   0.703
  588    HD2  PHE  77           HD2      PHE  77   5.032  -7.781  -1.256
  589    HE1  PHE  77           HE1      PHE  77   7.154  -5.416   2.497
  590    HE2  PHE  77           HE2      PHE  77   6.132  -9.059   0.535
  591    HZ   PHE  77           HZ       PHE  77   7.196  -7.876   2.415
  592    H    ILE  78           H        ILE  78   2.100  -6.240   0.544
  593    HA   ILE  78           HA       ILE  78   1.617  -3.778   2.044
  594    HB   ILE  78           HB       ILE  78   0.538  -6.570   2.474
  595   1HG1  ILE  78          1HG1      ILE  78  -0.368  -5.485   0.472
  596   2HG1  ILE  78          2HG1      ILE  78  -1.600  -5.617   1.723
  597   1HG2  ILE  78          1HG2      ILE  78   0.730  -5.370   4.584
  598   2HG2  ILE  78          2HG2      ILE  78  -0.154  -4.005   3.903
  599   3HG2  ILE  78          3HG2      ILE  78  -0.962  -5.559   4.121
  600   1HD1  ILE  78          1HD1      ILE  78  -1.715  -3.472   0.608
  601   2HD1  ILE  78          2HD1      ILE  78  -1.254  -3.266   2.298
  602   3HD1  ILE  78          3HD1      ILE  78  -0.035  -3.140   1.029
  603    H    TYR  79           H        TYR  79   3.299  -3.230   3.263
  604    HA   TYR  79           HA       TYR  79   4.599  -5.307   4.897
  605   1HB   TYR  79          1HB       TYR  79   6.148  -3.998   3.545
  606   2HB   TYR  79          2HB       TYR  79   5.486  -2.499   4.183
  607    HD1  TYR  79           HD1      TYR  79   7.373  -5.552   5.131
  608    HD2  TYR  79           HD2      TYR  79   6.339  -1.556   6.158
  609    HE1  TYR  79           HE1      TYR  79   9.060  -5.579   6.919
  610    HE2  TYR  79           HE2      TYR  79   8.020  -1.575   7.951
  611    HH   TYR  79           HH       TYR  79   9.249  -3.090   9.310
  612    H    LYS  80           H        LYS  80   3.909  -5.463   6.940
  613    HA   LYS  80           HA       LYS  80   2.190  -3.441   8.024
  614   1HB   LYS  80          1HB       LYS  80   3.210  -6.063   9.086
  615   2HB   LYS  80          2HB       LYS  80   2.312  -4.948  10.109
  616   1HG   LYS  80          1HG       LYS  80   0.447  -5.026   8.489
  617   2HG   LYS  80          2HG       LYS  80   1.341  -6.236   7.567
  618   1HD   LYS  80          1HD       LYS  80   1.253  -7.786   9.388
  619   2HD   LYS  80          2HD       LYS  80   0.590  -6.558  10.468
  620   1HE   LYS  80          1HE       LYS  80  -1.428  -6.440   9.085
  621   2HE   LYS  80          2HE       LYS  80  -0.765  -7.678   8.019
  622   1HZ   LYS  80          1HZ       LYS  80  -1.210  -8.122  10.918
  623   2HZ   LYS  80          2HZ       LYS  80  -2.376  -8.475   9.740
  624   3HZ   LYS  80          3HZ       LYS  80  -0.887  -9.281   9.723
  625    H    MET  81           H        MET  81   3.397  -1.614   8.213
  626    HA   MET  81           HA       MET  81   5.833  -1.343   9.591
  627   1HB   MET  81          1HB       MET  81   4.959   0.414   8.144
  628   2HB   MET  81          2HB       MET  81   3.566   0.621   9.195
  629   1HG   MET  81          1HG       MET  81   5.336   1.159  11.011
  630   2HG   MET  81          2HG       MET  81   6.405   1.430   9.637
  631   1HE   MET  81          1HE       MET  81   4.214   2.505   7.503
  632   2HE   MET  81          2HE       MET  81   5.829   3.190   7.674
  633   3HE   MET  81          3HE       MET  81   4.416   4.245   7.704
  634    H    GLU  82           H        GLU  82   2.486  -0.862  10.627
  635    HA   GLU  82           HA       GLU  82   3.161  -1.579  13.351
  636   1HB   GLU  82          1HB       GLU  82   3.621   0.838  13.252
  637   2HB   GLU  82          2HB       GLU  82   1.994   1.121  12.655
  638   1HG   GLU  82          1HG       GLU  82   1.073   0.298  14.756
  639   2HG   GLU  82          2HG       GLU  82   2.707   0.006  15.356
  640    H    GLY  83           H        GLY  83   1.824  -3.333  12.595
  641   1HA   GLY  83          1HA       GLY  83  -0.938  -2.904  13.327
  642   2HA   GLY  83          2HA       GLY  83  -0.703  -3.371  11.647
  643    H    CYS  84           H        CYS  84   1.237  -4.403  14.367
  644    HA   CYS  84           HA       CYS  84   0.329  -7.166  13.916
  645   1HB   CYS  84          1HB       CYS  84   2.758  -6.622  13.478
  646   2HB   CYS  84          2HB       CYS  84   2.921  -6.254  15.189
  647    HG   CYS  84           HG       CYS  84   1.629  -9.283  14.646
  648    H    ASN  85           H        ASN  85  -0.113  -4.618  15.874
  649    HA   ASN  85           HA       ASN  85  -0.528  -6.275  18.265
  650   1HB   ASN  85          1HB       ASN  85   0.286  -3.367  18.072
  651   2HB   ASN  85          2HB       ASN  85  -0.290  -4.113  19.560
  652   1HD2  ASN  85          2HD2      ASN  85   0.987  -6.671  18.971
  653   2HD2  ASN  85          1HD2      ASN  85   2.681  -6.436  19.247
  Start of MODEL    6
    1    H    MET   1           H        MET   1  13.758   0.256 -10.988
    2    HA   MET   1           HA       MET   1  10.896   0.983 -11.211
    3   1HB   MET   1          1HB       MET   1  11.419  -1.441 -11.561
    4   2HB   MET   1          2HB       MET   1  12.170  -1.469  -9.972
    5   1HG   MET   1          1HG       MET   1  10.076  -0.986  -8.911
    6   2HG   MET   1          2HG       MET   1   9.291  -0.756 -10.473
    7   1HE   MET   1          1HE       MET   1   7.643  -4.064  -9.188
    8   2HE   MET   1          2HE       MET   1   7.361  -2.430  -9.790
    9   3HE   MET   1          3HE       MET   1   8.115  -2.672  -8.214
   10    H    GLN   2           H        GLN   2  10.095   2.048  -9.513
   11    HA   GLN   2           HA       GLN   2  11.847   2.397  -7.163
   12   1HB   GLN   2          1HB       GLN   2  12.121   4.328  -8.607
   13   2HB   GLN   2          2HB       GLN   2  10.380   4.526  -8.731
   14   1HG   GLN   2          1HG       GLN   2  10.279   5.046  -6.340
   15   2HG   GLN   2          2HG       GLN   2  12.031   4.874  -6.239
   16   1HE2  GLN   2          2HE2      GLN   2  12.510   6.092  -8.829
   17   2HE2  GLN   2          1HE2      GLN   2  12.225   7.789  -8.630
   18    H    ILE   3           H        ILE   3  10.820   1.980  -5.304
   19    HA   ILE   3           HA       ILE   3   7.993   1.452  -5.368
   20    HB   ILE   3           HB       ILE   3   8.251   0.953  -2.924
   21   1HG1  ILE   3          1HG1      ILE   3  11.202   1.264  -3.511
   22   2HG1  ILE   3          2HG1      ILE   3  10.249   2.392  -2.552
   23   1HG2  ILE   3          1HG2      ILE   3  10.004  -0.517  -4.872
   24   2HG2  ILE   3          2HG2      ILE   3   9.475  -1.144  -3.311
   25   3HG2  ILE   3          3HG2      ILE   3   8.289  -0.795  -4.568
   26   1HD1  ILE   3          1HD1      ILE   3   9.786   0.611  -0.938
   27   2HD1  ILE   3          2HD1      ILE   3  10.768  -0.499  -1.895
   28   3HD1  ILE   3          3HD1      ILE   3  11.515   0.902  -1.127
   29    H    HIS   4           H        HIS   4   6.490   2.868  -5.072
   30    HA   HIS   4           HA       HIS   4   7.024   5.349  -3.654
   31   1HB   HIS   4          1HB       HIS   4   4.636   4.310  -5.181
   32   2HB   HIS   4          2HB       HIS   4   4.573   5.790  -4.231
   33    HD1  HIS   4           HD1      HIS   4   4.283   7.383  -6.171
   34    HD2  HIS   4           HD2      HIS   4   7.622   4.940  -6.553
   35    HE1  HIS   4           HE1      HIS   4   5.598   8.330  -8.093
   36    HE2  HIS   4           HE2      HIS   4   7.497   6.706  -8.438
   37    H    VAL   5           H        VAL   5   6.480   5.685  -1.613
   38    HA   VAL   5           HA       VAL   5   5.336   3.435  -0.149
   39    HB   VAL   5           HB       VAL   5   6.656   5.945   0.896
   40   1HG1  VAL   5          1HG1      VAL   5   5.138   4.936   2.509
   41   2HG1  VAL   5          2HG1      VAL   5   5.930   3.376   2.296
   42   3HG1  VAL   5          3HG1      VAL   5   6.816   4.723   3.009
   43   1HG2  VAL   5          1HG2      VAL   5   8.215   4.602  -0.406
   44   2HG2  VAL   5          2HG2      VAL   5   8.608   4.525   1.312
   45   3HG2  VAL   5          3HG2      VAL   5   7.786   3.172   0.534
   46    H    TYR   6           H        TYR   6   3.176   3.518  -0.204
   47    HA   TYR   6           HA       TYR   6   1.849   6.076   0.283
   48   1HB   TYR   6          1HB       TYR   6   0.735   3.407  -0.602
   49   2HB   TYR   6          2HB       TYR   6  -0.233   4.854  -0.330
   50    HD1  TYR   6           HD1      TYR   6  -0.032   6.786  -1.842
   51    HD2  TYR   6           HD2      TYR   6   2.110   3.182  -2.565
   52    HE1  TYR   6           HE1      TYR   6   0.429   7.526  -4.142
   53    HE2  TYR   6           HE2      TYR   6   2.572   3.911  -4.864
   54    HH   TYR   6           HH       TYR   6   1.745   5.422  -6.525
   55    H    ASP   7           H        ASP   7   1.839   6.524   2.340
   56    HA   ASP   7           HA       ASP   7   1.712   4.620   4.453
   57   1HB   ASP   7          1HB       ASP   7   2.753   6.938   4.543
   58   2HB   ASP   7          2HB       ASP   7   1.118   7.585   4.593
   59    H    THR   8           H        THR   8  -0.088   3.518   4.968
   60    HA   THR   8           HA       THR   8  -2.662   4.749   4.249
   61    HB   THR   8           HB       THR   8  -2.110   1.792   4.492
   62    HG1  THR   8           HG1      THR   8  -0.895   2.950   2.781
   63   1HG2  THR   8          1HG2      THR   8  -4.174   1.595   3.174
   64   2HG2  THR   8          2HG2      THR   8  -4.464   2.443   4.693
   65   3HG2  THR   8          3HG2      THR   8  -4.349   3.350   3.185
   66    H    TYR   9           H        TYR   9  -3.756   5.443   5.923
   67    HA   TYR   9           HA       TYR   9  -3.588   4.076   8.508
   68   1HB   TYR   9          1HB       TYR   9  -5.037   6.622   7.737
   69   2HB   TYR   9          2HB       TYR   9  -4.877   5.986   9.368
   70    HD1  TYR   9           HD1      TYR   9  -3.496   8.158   6.936
   71    HD2  TYR   9           HD2      TYR   9  -2.457   5.723  10.263
   72    HE1  TYR   9           HE1      TYR   9  -1.419   9.444   7.220
   73    HE2  TYR   9           HE2      TYR   9  -0.384   7.002  10.564
   74    HH   TYR   9           HH       TYR   9   1.143   8.416   8.902
   75    H    VAL  10           H        VAL  10  -4.920   2.355   8.660
   76    HA   VAL  10           HA       VAL  10  -7.601   2.600   7.460
   77    HB   VAL  10           HB       VAL  10  -6.103   0.107   8.273
   78   1HG1  VAL  10          1HG1      VAL  10  -8.776   0.421   6.909
   79   2HG1  VAL  10          2HG1      VAL  10  -7.934  -1.105   7.183
   80   3HG1  VAL  10          3HG1      VAL  10  -8.510  -0.157   8.554
   81   1HG2  VAL  10          1HG2      VAL  10  -5.146   1.139   6.304
   82   2HG2  VAL  10          2HG2      VAL  10  -6.024  -0.322   5.845
   83   3HG2  VAL  10          3HG2      VAL  10  -6.742   1.265   5.563
   84    H    LYS  11           H        LYS  11  -9.072   3.204   8.842
   85    HA   LYS  11           HA       LYS  11  -8.605   2.933  11.689
   86   1HB   LYS  11          1HB       LYS  11 -11.021   4.220  10.460
   87   2HB   LYS  11          2HB       LYS  11 -10.206   4.615  11.969
   88   1HG   LYS  11          1HG       LYS  11  -8.934   5.024   9.283
   89   2HG   LYS  11          2HG       LYS  11  -9.924   6.255  10.068
   90   1HD   LYS  11          1HD       LYS  11  -8.394   6.322  11.945
   91   2HD   LYS  11          2HD       LYS  11  -7.449   5.001  11.253
   92   1HE   LYS  11          1HE       LYS  11  -6.417   7.209  10.861
   93   2HE   LYS  11          2HE       LYS  11  -6.832   6.376   9.364
   94   1HZ   LYS  11          1HZ       LYS  11  -7.450   8.679   9.216
   95   2HZ   LYS  11          2HZ       LYS  11  -8.858   7.740   9.247
   96   3HZ   LYS  11          3HZ       LYS  11  -8.369   8.579  10.637
   97    H    ALA  12           H        ALA  12  -8.924   0.578  11.704
   98    HA   ALA  12           HA       ALA  12 -11.643  -0.355  11.355
   99   1HB   ALA  12          1HB       ALA  12  -9.178  -1.728  12.423
  100   2HB   ALA  12          2HB       ALA  12 -10.746  -2.509  12.208
  101   3HB   ALA  12          3HB       ALA  12  -9.866  -1.892  10.810
  102    H    LYS  13           H        LYS  13 -13.108   0.205  12.802
  103    HA   LYS  13           HA       LYS  13 -12.517   1.403  15.258
  104   1HB   LYS  13          1HB       LYS  13 -14.598   1.751  13.969
  105   2HB   LYS  13          2HB       LYS  13 -15.115   0.129  14.403
  106   1HG   LYS  13          1HG       LYS  13 -15.102   0.768  16.769
  107   2HG   LYS  13          2HG       LYS  13 -14.625   2.405  16.308
  108   1HD   LYS  13          1HD       LYS  13 -16.681   2.624  14.995
  109   2HD   LYS  13          2HD       LYS  13 -17.158   0.995  15.479
  110   1HE   LYS  13          1HE       LYS  13 -17.168   1.713  17.825
  111   2HE   LYS  13          2HE       LYS  13 -16.729   3.345  17.319
  112   1HZ   LYS  13          1HZ       LYS  13 -19.213   1.903  16.566
  113   2HZ   LYS  13          2HZ       LYS  13 -19.098   3.160  17.698
  114   3HZ   LYS  13          3HZ       LYS  13 -18.790   3.464  16.057
  115    H    ASP  14           H        ASP  14 -14.038  -1.783  14.704
  116    HA   ASP  14           HA       ASP  14 -13.765  -2.445  17.493
  117   1HB   ASP  14          1HB       ASP  14 -14.957  -4.429  17.006
  118   2HB   ASP  14          2HB       ASP  14 -15.665  -3.197  15.969
  119    H    GLY  15           H        GLY  15 -12.099  -3.145  14.512
  120   1HA   GLY  15          1HA       GLY  15 -10.358  -5.119  15.662
  121   2HA   GLY  15          2HA       GLY  15 -10.173  -4.350  14.089
  122    H    HIS  16           H        HIS  16  -8.721  -2.742  13.858
  123    HA   HIS  16           HA       HIS  16  -7.872  -1.113  16.035
  124   1HB   HIS  16          1HB       HIS  16  -5.541  -1.820  16.152
  125   2HB   HIS  16          2HB       HIS  16  -6.609  -3.140  16.595
  126    HD1  HIS  16           HD1      HIS  16  -7.191  -4.096  13.592
  127    HD2  HIS  16           HD2      HIS  16  -3.462  -3.345  15.276
  128    HE1  HIS  16           HE1      HIS  16  -5.561  -5.464  12.269
  129    HE2  HIS  16           HE2      HIS  16  -3.370  -5.200  13.481
  130    H    VAL  17           H        VAL  17  -6.523   0.619  15.386
  131    HA   VAL  17           HA       VAL  17  -6.865   1.434  12.668
  132    HB   VAL  17           HB       VAL  17  -5.041   2.619  14.780
  133   1HG1  VAL  17          1HG1      VAL  17  -5.167   4.660  13.438
  134   2HG1  VAL  17          2HG1      VAL  17  -4.471   3.329  12.513
  135   3HG1  VAL  17          3HG1      VAL  17  -6.144   3.814  12.237
  136   1HG2  VAL  17          1HG2      VAL  17  -7.349   2.556  15.548
  137   2HG2  VAL  17          2HG2      VAL  17  -6.864   4.211  15.181
  138   3HG2  VAL  17          3HG2      VAL  17  -7.885   3.321  14.052
  139    H    MET  18           H        MET  18  -5.818   0.373  11.121
  140    HA   MET  18           HA       MET  18  -3.235  -0.829  11.652
  141   1HB   MET  18          1HB       MET  18  -4.848  -0.867   9.099
  142   2HB   MET  18          2HB       MET  18  -3.475  -1.893   9.490
  143   1HG   MET  18          1HG       MET  18  -4.812  -2.827  11.376
  144   2HG   MET  18          2HG       MET  18  -6.195  -1.920  10.765
  145   1HE   MET  18          1HE       MET  18  -3.317  -3.845   8.855
  146   2HE   MET  18          2HE       MET  18  -4.112  -5.394   8.571
  147   3HE   MET  18          3HE       MET  18  -3.741  -4.883  10.218
  148    H    HIS  19           H        HIS  19  -1.352  -0.069  11.021
  149    HA   HIS  19           HA       HIS  19  -1.313   2.076   9.010
  150   1HB   HIS  19          1HB       HIS  19  -0.853   2.996  11.255
  151   2HB   HIS  19          2HB       HIS  19   0.461   1.843  11.456
  152    HD1  HIS  19           HD1      HIS  19   2.675   2.873  11.055
  153    HD2  HIS  19           HD2      HIS  19  -0.300   4.613   8.726
  154    HE1  HIS  19           HE1      HIS  19   3.807   4.704   9.759
  155    HE2  HIS  19           HE2      HIS  19   2.037   5.585   8.196
  156    H    PHE  20           H        PHE  20  -0.673   0.939   7.276
  157    HA   PHE  20           HA       PHE  20   1.888  -0.471   7.493
  158   1HB   PHE  20          1HB       PHE  20   1.034  -2.157   5.847
  159   2HB   PHE  20          2HB       PHE  20   0.255  -2.234   7.422
  160    HD1  PHE  20           HD1      PHE  20  -0.181  -1.383   3.886
  161    HD2  PHE  20           HD2      PHE  20  -2.071  -1.673   7.689
  162    HE1  PHE  20           HE1      PHE  20  -2.383  -1.230   2.801
  163    HE2  PHE  20           HE2      PHE  20  -4.273  -1.518   6.609
  164    HZ   PHE  20           HZ       PHE  20  -4.431  -1.297   4.161
  165    H    ASP  21           H        ASP  21   3.199  -0.381   5.669
  166    HA   ASP  21           HA       ASP  21   2.526   1.884   3.937
  167   1HB   ASP  21          1HB       ASP  21   5.108   0.545   4.672
  168   2HB   ASP  21          2HB       ASP  21   5.007   1.574   3.246
  169    H    VAL  22           H        VAL  22   1.762   1.564   2.006
  170    HA   VAL  22           HA       VAL  22   1.986  -1.038   0.732
  171    HB   VAL  22           HB       VAL  22   0.575   1.458  -0.239
  172   1HG1  VAL  22          1HG1      VAL  22   1.120  -0.084  -2.043
  173   2HG1  VAL  22          2HG1      VAL  22   0.362  -1.407  -1.157
  174   3HG1  VAL  22          3HG1      VAL  22  -0.618  -0.062  -1.741
  175   1HG2  VAL  22          1HG2      VAL  22  -1.486   0.351   0.515
  176   2HG2  VAL  22          2HG2      VAL  22  -0.519  -0.945   1.220
  177   3HG2  VAL  22          3HG2      VAL  22  -0.390   0.697   1.852
  178    H    PHE  23           H        PHE  23   3.818  -1.429  -0.321
  179    HA   PHE  23           HA       PHE  23   5.193   0.746  -1.708
  180   1HB   PHE  23          1HB       PHE  23   6.017  -2.130  -1.252
  181   2HB   PHE  23          2HB       PHE  23   6.998  -0.917  -2.062
  182    HD1  PHE  23           HD1      PHE  23   6.349   1.397  -0.193
  183    HD2  PHE  23           HD2      PHE  23   7.449  -2.650   0.524
  184    HE1  PHE  23           HE1      PHE  23   7.336   2.050   1.963
  185    HE2  PHE  23           HE2      PHE  23   8.435  -2.004   2.681
  186    HZ   PHE  23           HZ       PHE  23   8.379   0.349   3.404
  187    H    THR  24           H        THR  24   4.678   1.135  -3.750
  188    HA   THR  24           HA       THR  24   4.642  -1.103  -5.595
  189    HB   THR  24           HB       THR  24   2.256  -0.856  -4.974
  190    HG1  THR  24           HG1      THR  24   2.016  -1.510  -6.963
  191   1HG2  THR  24          1HG2      THR  24   1.007   1.126  -5.707
  192   2HG2  THR  24          2HG2      THR  24   2.215   1.537  -4.491
  193   3HG2  THR  24          3HG2      THR  24   2.518   1.898  -6.190
  194    H    ASP  25           H        ASP  25   4.874  -0.411  -7.841
  195    HA   ASP  25           HA       ASP  25   6.483   1.992  -8.032
  196   1HB   ASP  25          1HB       ASP  25   7.103  -0.156  -9.190
  197   2HB   ASP  25          2HB       ASP  25   5.708   0.067 -10.239
  198    H    VAL  26           H        VAL  26   3.264   1.023  -8.554
  199    HA   VAL  26           HA       VAL  26   2.405   2.728 -10.591
  200    HB   VAL  26           HB       VAL  26   0.848   1.822  -8.158
  201   1HG1  VAL  26          1HG1      VAL  26  -0.124   2.846 -10.824
  202   2HG1  VAL  26          2HG1      VAL  26  -1.141   2.209  -9.532
  203   3HG1  VAL  26          3HG1      VAL  26  -0.230   3.699  -9.284
  204   1HG2  VAL  26          1HG2      VAL  26   0.023   0.032  -9.604
  205   2HG2  VAL  26          2HG2      VAL  26   1.070   0.597 -10.905
  206   3HG2  VAL  26          3HG2      VAL  26   1.776  -0.047  -9.422
  207    H    ARG  27           H        ARG  27   2.093   4.854 -10.711
  208    HA   ARG  27           HA       ARG  27   2.838   6.418  -8.353
  209   1HB   ARG  27          1HB       ARG  27   2.691   7.250 -11.257
  210   2HB   ARG  27          2HB       ARG  27   3.383   8.188  -9.939
  211   1HG   ARG  27          1HG       ARG  27   5.132   6.548  -9.637
  212   2HG   ARG  27          2HG       ARG  27   4.407   5.516 -10.870
  213   1HD   ARG  27          1HD       ARG  27   5.520   8.282 -11.316
  214   2HD   ARG  27          2HD       ARG  27   6.322   6.769 -11.738
  215    HE   ARG  27           HE       ARG  27   4.012   7.968 -13.075
  216   1HH1  ARG  27          1HH1      ARG  27   6.311   5.322 -12.847
  217   2HH1  ARG  27          2HH1      ARG  27   5.988   4.747 -14.453
  218   1HH2  ARG  27          1HH2      ARG  27   3.593   7.203 -15.194
  219   2HH2  ARG  27          2HH2      ARG  27   4.481   5.827 -15.799
  220    H    ASP  28           H        ASP  28   0.162   5.291  -8.894
  221    HA   ASP  28           HA       ASP  28  -1.404   7.780  -9.055
  222   1HB   ASP  28          1HB       ASP  28  -1.914   6.174 -10.852
  223   2HB   ASP  28          2HB       ASP  28  -2.282   4.944  -9.648
  224    H    ASP  29           H        ASP  29  -2.889   8.232  -7.461
  225    HA   ASP  29           HA       ASP  29  -2.277   7.049  -4.925
  226   1HB   ASP  29          1HB       ASP  29  -3.655   8.758  -3.945
  227   2HB   ASP  29          2HB       ASP  29  -2.686   9.489  -5.218
  228    H    LYS  30           H        LYS  30  -5.189   7.104  -6.992
  229    HA   LYS  30           HA       LYS  30  -6.750   5.768  -4.994
  230   1HB   LYS  30          1HB       LYS  30  -8.529   5.693  -6.653
  231   2HB   LYS  30          2HB       LYS  30  -7.815   7.296  -6.587
  232   1HG   LYS  30          1HG       LYS  30  -6.511   6.771  -8.605
  233   2HG   LYS  30          2HG       LYS  30  -7.304   5.195  -8.679
  234   1HD   LYS  30          1HD       LYS  30  -9.479   6.310  -8.877
  235   2HD   LYS  30          2HD       LYS  30  -8.672   7.879  -8.828
  236   1HE   LYS  30          1HE       LYS  30  -7.450   7.303 -10.872
  237   2HE   LYS  30          2HE       LYS  30  -8.271   5.742 -10.921
  238   1HZ   LYS  30          1HZ       LYS  30 -10.394   6.966 -11.073
  239   2HZ   LYS  30          2HZ       LYS  30  -9.530   8.419 -11.178
  240   3HZ   LYS  30          3HZ       LYS  30  -9.368   7.251 -12.399
  241    H    LYS  31           H        LYS  31  -4.797   4.795  -7.699
  242    HA   LYS  31           HA       LYS  31  -5.635   2.096  -7.822
  243   1HB   LYS  31          1HB       LYS  31  -3.450   3.699  -8.875
  244   2HB   LYS  31          2HB       LYS  31  -2.911   2.089  -8.414
  245   1HG   LYS  31          1HG       LYS  31  -5.252   2.645 -10.223
  246   2HG   LYS  31          2HG       LYS  31  -3.618   2.266 -10.778
  247   1HD   LYS  31          1HD       LYS  31  -3.708   0.098  -9.754
  248   2HD   LYS  31          2HD       LYS  31  -5.243   0.478  -8.971
  249   1HE   LYS  31          1HE       LYS  31  -4.801   0.303 -11.949
  250   2HE   LYS  31          2HE       LYS  31  -5.511  -0.966 -10.951
  251   1HZ   LYS  31          1HZ       LYS  31  -6.618   1.732 -11.489
  252   2HZ   LYS  31          2HZ       LYS  31  -7.278   0.238 -11.942
  253   3HZ   LYS  31          3HZ       LYS  31  -7.242   0.690 -10.303
  254    H    ALA  32           H        ALA  32  -3.113   3.724  -5.931
  255    HA   ALA  32           HA       ALA  32  -2.193   1.447  -4.551
  256   1HB   ALA  32          1HB       ALA  32  -2.241   4.320  -3.626
  257   2HB   ALA  32          2HB       ALA  32  -1.261   3.023  -2.939
  258   3HB   ALA  32          3HB       ALA  32  -0.970   3.568  -4.591
  259    H    ILE  33           H        ILE  33  -4.778   3.749  -3.909
  260    HA   ILE  33           HA       ILE  33  -5.647   2.809  -1.431
  261    HB   ILE  33           HB       ILE  33  -7.274   3.969  -3.704
  262   1HG1  ILE  33          1HG1      ILE  33  -6.161   5.255  -1.200
  263   2HG1  ILE  33          2HG1      ILE  33  -5.485   5.431  -2.815
  264   1HG2  ILE  33          1HG2      ILE  33  -8.031   3.599  -0.809
  265   2HG2  ILE  33          2HG2      ILE  33  -8.973   4.480  -2.011
  266   3HG2  ILE  33          3HG2      ILE  33  -8.723   2.743  -2.187
  267   1HD1  ILE  33          1HD1      ILE  33  -7.540   6.520  -3.553
  268   2HD1  ILE  33          2HD1      ILE  33  -8.213   6.343  -1.933
  269   3HD1  ILE  33          3HD1      ILE  33  -6.802   7.368  -2.195
  270    H    GLU  34           H        GLU  34  -6.644   1.812  -4.711
  271    HA   GLU  34           HA       GLU  34  -8.483  -0.158  -3.991
  272   1HB   GLU  34          1HB       GLU  34  -6.633  -0.071  -6.380
  273   2HB   GLU  34          2HB       GLU  34  -7.963  -1.203  -6.202
  274   1HG   GLU  34          1HG       GLU  34  -9.518   0.721  -6.078
  275   2HG   GLU  34          2HG       GLU  34  -8.154   1.790  -6.402
  276    H    PHE  35           H        PHE  35  -4.986  -0.396  -4.488
  277    HA   PHE  35           HA       PHE  35  -4.693  -3.144  -4.178
  278   1HB   PHE  35          1HB       PHE  35  -2.792  -0.922  -3.408
  279   2HB   PHE  35          2HB       PHE  35  -2.352  -2.623  -3.483
  280    HD1  PHE  35           HD1      PHE  35  -1.271  -0.128  -5.040
  281    HD2  PHE  35           HD2      PHE  35  -3.996  -3.257  -5.994
  282    HE1  PHE  35           HE1      PHE  35  -0.724   0.127  -7.424
  283    HE2  PHE  35           HE2      PHE  35  -3.452  -3.006  -8.379
  284    HZ   PHE  35           HZ       PHE  35  -1.814  -1.312  -9.097
  285    H    ALA  36           H        ALA  36  -4.674  -0.594  -1.711
  286    HA   ALA  36           HA       ALA  36  -4.195  -2.332   0.477
  287   1HB   ALA  36          1HB       ALA  36  -5.503   0.386   0.457
  288   2HB   ALA  36          2HB       ALA  36  -4.870  -0.450   1.875
  289   3HB   ALA  36          3HB       ALA  36  -3.774   0.072   0.596
  290    H    LYS  37           H        LYS  37  -7.136  -1.026  -0.984
  291    HA   LYS  37           HA       LYS  37  -8.962  -1.987   0.919
  292   1HB   LYS  37          1HB       LYS  37  -9.309  -1.359  -2.013
  293   2HB   LYS  37          2HB       LYS  37 -10.646  -1.740  -0.933
  294   1HG   LYS  37          1HG       LYS  37 -10.162   0.182   0.418
  295   2HG   LYS  37          2HG       LYS  37  -8.722   0.537  -0.531
  296   1HD   LYS  37          1HD       LYS  37 -10.484   2.013  -1.226
  297   2HD   LYS  37          2HD       LYS  37 -10.172   0.856  -2.519
  298   1HE   LYS  37          1HE       LYS  37 -12.108  -0.454  -1.822
  299   2HE   LYS  37          2HE       LYS  37 -12.409   0.678  -0.502
  300   1HZ   LYS  37          1HZ       LYS  37 -13.824   1.113  -2.441
  301   2HZ   LYS  37          2HZ       LYS  37 -12.798   2.424  -2.109
  302   3HZ   LYS  37          3HZ       LYS  37 -12.445   1.376  -3.392
  303    H    GLN  38           H        GLN  38  -7.604  -3.469  -1.961
  304    HA   GLN  38           HA       GLN  38  -9.187  -5.774  -2.093
  305   1HB   GLN  38          1HB       GLN  38  -6.267  -5.407  -2.784
  306   2HB   GLN  38          2HB       GLN  38  -7.211  -6.826  -3.210
  307   1HG   GLN  38          1HG       GLN  38  -7.925  -4.046  -4.089
  308   2HG   GLN  38          2HG       GLN  38  -6.896  -5.128  -5.023
  309   1HE2  GLN  38          2HE2      GLN  38  -8.303  -5.195  -6.733
  310   2HE2  GLN  38          1HE2      GLN  38  -9.819  -6.035  -6.680
  311    H    TRP  39           H        TRP  39  -6.429  -5.000  -0.086
  312    HA   TRP  39           HA       TRP  39  -6.146  -7.693   0.911
  313   1HB   TRP  39          1HB       TRP  39  -4.211  -6.183   0.574
  314   2HB   TRP  39          2HB       TRP  39  -4.843  -5.119   1.823
  315    HD1  TRP  39           HD1      TRP  39  -3.793  -8.856   1.573
  316    HE1  TRP  39           HE1      TRP  39  -2.573  -9.479   3.757
  317    HE3  TRP  39           HE3      TRP  39  -4.242  -4.395   4.033
  318    HZ2  TRP  39           HZ2      TRP  39  -1.894  -8.225   6.199
  319    HZ3  TRP  39           HZ3      TRP  39  -3.277  -4.189   6.286
  320    HH2  TRP  39           HH2      TRP  39  -2.128  -6.066   7.346
  321    H    LEU  40           H        LEU  40  -7.322  -4.582   2.137
  322    HA   LEU  40           HA       LEU  40  -7.841  -5.320   4.778
  323   1HB   LEU  40          1HB       LEU  40  -9.351  -3.370   3.041
  324   2HB   LEU  40          2HB       LEU  40  -9.471  -3.466   4.787
  325    HG   LEU  40           HG       LEU  40  -6.975  -2.752   3.249
  326   1HD1  LEU  40          1HD1      LEU  40  -7.346  -0.509   4.162
  327   2HD1  LEU  40          2HD1      LEU  40  -8.662  -1.014   3.102
  328   3HD1  LEU  40          3HD1      LEU  40  -8.877  -1.050   4.852
  329   1HD2  LEU  40          1HD2      LEU  40  -7.537  -2.746   6.214
  330   2HD2  LEU  40          2HD2      LEU  40  -6.502  -3.892   5.362
  331   3HD2  LEU  40          3HD2      LEU  40  -6.056  -2.188   5.439
  332    H    SER  41           H        SER  41  -9.924  -5.557   1.923
  333    HA   SER  41           HA       SER  41 -12.223  -6.363   3.371
  334   1HB   SER  41          1HB       SER  41 -13.048  -7.028   1.049
  335   2HB   SER  41          2HB       SER  41 -12.592  -5.338   1.270
  336    HG   SER  41           HG       SER  41 -10.934  -5.592  -0.034
  337    H    SER  42           H        SER  42  -9.482  -8.098   2.147
  338    HA   SER  42           HA       SER  42 -10.883 -10.634   2.243
  339   1HB   SER  42          1HB       SER  42  -8.556 -11.520   1.595
  340   2HB   SER  42          2HB       SER  42  -9.409 -10.522   0.418
  341    HG   SER  42           HG       SER  42  -7.937  -9.022   0.613
  342    H    ILE  43           H        ILE  43  -8.624  -8.788   4.200
  343    HA   ILE  43           HA       ILE  43  -8.097 -11.019   5.953
  344    HB   ILE  43           HB       ILE  43  -6.996  -9.373   7.442
  345   1HG1  ILE  43          1HG1      ILE  43  -7.700  -7.386   5.273
  346   2HG1  ILE  43          2HG1      ILE  43  -8.386  -7.415   6.893
  347   1HG2  ILE  43          1HG2      ILE  43  -5.131  -8.874   5.919
  348   2HG2  ILE  43          2HG2      ILE  43  -5.721 -10.527   5.747
  349   3HG2  ILE  43          3HG2      ILE  43  -6.155  -9.307   4.549
  350   1HD1  ILE  43          1HD1      ILE  43  -6.679  -5.712   6.699
  351   2HD1  ILE  43          2HD1      ILE  43  -6.177  -6.969   7.830
  352   3HD1  ILE  43          3HD1      ILE  43  -5.500  -6.928   6.202
  353    H    GLY  44           H        GLY  44 -10.319  -8.283   5.899
  354   1HA   GLY  44          1HA       GLY  44 -12.521  -8.770   6.824
  355   2HA   GLY  44          2HA       GLY  44 -11.717  -9.619   8.130
  356    H    GLU  45           H        GLU  45  -9.969  -6.855   7.538
  357    HA   GLU  45           HA       GLU  45 -11.025  -5.547   9.879
  358   1HB   GLU  45          1HB       GLU  45  -8.815  -4.793   7.961
  359   2HB   GLU  45          2HB       GLU  45  -9.269  -3.808   9.343
  360   1HG   GLU  45          1HG       GLU  45  -8.289  -6.650   9.484
  361   2HG   GLU  45          2HG       GLU  45  -7.306  -5.218   9.773
  362    H    GLU  46           H        GLU  46 -13.115  -5.586   8.511
  363    HA   GLU  46           HA       GLU  46 -13.367  -3.398   6.620
  364   1HB   GLU  46          1HB       GLU  46 -14.487  -5.856   6.717
  365   2HB   GLU  46          2HB       GLU  46 -15.742  -4.934   7.527
  366   1HG   GLU  46          1HG       GLU  46 -14.643  -4.192   4.831
  367   2HG   GLU  46          2HG       GLU  46 -16.019  -5.268   5.052
  368    H    GLY  47           H        GLY  47 -15.151  -1.831   6.879
  369   1HA   GLY  47          1HA       GLY  47 -16.714  -0.805   8.504
  370   2HA   GLY  47          2HA       GLY  47 -15.486  -1.106   9.729
  371    H    ALA  48           H        ALA  48 -13.524  -0.394   7.436
  372    HA   ALA  48           HA       ALA  48 -13.531   2.468   8.072
  373   1HB   ALA  48          1HB       ALA  48 -11.148   2.423   7.574
  374   2HB   ALA  48          2HB       ALA  48 -11.557   1.210   8.788
  375   3HB   ALA  48          3HB       ALA  48 -11.263   0.724   7.118
  376    H    THR  49           H        THR  49 -13.440   4.004   6.512
  377    HA   THR  49           HA       THR  49 -13.744   3.115   3.730
  378    HB   THR  49           HB       THR  49 -14.272   5.863   4.892
  379    HG1  THR  49           HG1      THR  49 -15.673   3.626   5.196
  380   1HG2  THR  49          1HG2      THR  49 -13.841   5.848   2.480
  381   2HG2  THR  49          2HG2      THR  49 -15.075   4.607   2.264
  382   3HG2  THR  49          3HG2      THR  49 -15.533   6.216   2.818
  383    H    VAL  50           H        VAL  50 -12.113   3.463   2.310
  384    HA   VAL  50           HA       VAL  50  -9.790   4.939   3.365
  385    HB   VAL  50           HB       VAL  50  -9.798   2.719   1.315
  386   1HG1  VAL  50          1HG1      VAL  50  -7.366   2.731   1.625
  387   2HG1  VAL  50          2HG1      VAL  50  -7.955   4.270   0.997
  388   3HG1  VAL  50          3HG1      VAL  50  -7.514   4.124   2.698
  389   1HG2  VAL  50          1HG2      VAL  50  -9.016   2.689   4.230
  390   2HG2  VAL  50          2HG2      VAL  50 -10.409   1.880   3.511
  391   3HG2  VAL  50          3HG2      VAL  50  -8.776   1.361   3.093
  392    H    THR  51           H        THR  51  -9.826   6.923   2.556
  393    HA   THR  51           HA       THR  51 -10.066   7.229  -0.370
  394    HB   THR  51           HB       THR  51 -10.484   9.610   0.050
  395    HG1  THR  51           HG1      THR  51 -10.327   8.886   2.821
  396   1HG2  THR  51          1HG2      THR  51 -12.253   7.814   1.717
  397   2HG2  THR  51          2HG2      THR  51 -12.677   9.429   1.148
  398   3HG2  THR  51          3HG2      THR  51 -12.419   8.126  -0.011
  399    H    SER  52           H        SER  52  -8.749   9.687  -0.594
  400    HA   SER  52           HA       SER  52  -6.005   8.858  -0.462
  401   1HB   SER  52          1HB       SER  52  -7.105  11.581  -1.196
  402   2HB   SER  52          2HB       SER  52  -5.520  10.926  -1.610
  403    HG   SER  52           HG       SER  52  -6.385   9.739  -3.163
  404    H    GLU  53           H        GLU  53  -8.098  10.176   1.764
  405    HA   GLU  53           HA       GLU  53  -6.105  11.686   3.229
  406   1HB   GLU  53          1HB       GLU  53  -8.525  12.294   3.303
  407   2HB   GLU  53          2HB       GLU  53  -8.853  10.768   4.113
  408   1HG   GLU  53          1HG       GLU  53  -7.375  11.467   5.959
  409   2HG   GLU  53          2HG       GLU  53  -7.153  13.022   5.159
  410    H    GLU  54           H        GLU  54  -7.461   8.488   3.127
  411    HA   GLU  54           HA       GLU  54  -6.195   7.651   5.591
  412   1HB   GLU  54          1HB       GLU  54  -7.784   6.177   3.492
  413   2HB   GLU  54          2HB       GLU  54  -6.981   5.348   4.813
  414   1HG   GLU  54          1HG       GLU  54  -9.322   5.692   5.308
  415   2HG   GLU  54          2HG       GLU  54  -8.310   6.601   6.425
  416    H    CYS  55           H        CYS  55  -5.843   6.938   2.123
  417    HA   CYS  55           HA       CYS  55  -3.177   5.849   2.692
  418   1HB   CYS  55          1HB       CYS  55  -4.860   4.525   1.322
  419   2HB   CYS  55          2HB       CYS  55  -4.669   5.741   0.066
  420    HG   CYS  55           HG       CYS  55  -2.329   3.521   1.194
  421    H    ARG  56           H        ARG  56  -1.598   7.298   2.587
  422    HA   ARG  56           HA       ARG  56  -1.903   9.559   0.714
  423   1HB   ARG  56          1HB       ARG  56  -0.583   9.525   3.432
  424   2HB   ARG  56          2HB       ARG  56  -0.631  10.903   2.343
  425   1HG   ARG  56          1HG       ARG  56  -3.021  11.052   2.556
  426   2HG   ARG  56          2HG       ARG  56  -3.060   9.576   3.525
  427   1HD   ARG  56          1HD       ARG  56  -3.217  11.607   4.903
  428   2HD   ARG  56          2HD       ARG  56  -1.784  10.650   5.275
  429    HE   ARG  56           HE       ARG  56  -1.558  12.932   3.436
  430   1HH1  ARG  56          1HH1      ARG  56  -0.786  11.405   6.477
  431   2HH1  ARG  56          2HH1      ARG  56   0.460  12.536   6.894
  432   1HH2  ARG  56          1HH2      ARG  56   0.082  14.452   3.970
  433   2HH2  ARG  56          2HH2      ARG  56   0.954  14.270   5.469
  434    H    PHE  57           H        PHE  57  -0.328   9.865  -0.721
  435    HA   PHE  57           HA       PHE  57   2.033   8.248  -0.739
  436   1HB   PHE  57          1HB       PHE  57   1.126   9.013  -2.852
  437   2HB   PHE  57          2HB       PHE  57   1.261  10.696  -2.349
  438    HD1  PHE  57           HD1      PHE  57   3.393   7.673  -2.830
  439    HD2  PHE  57           HD2      PHE  57   3.077  11.911  -3.060
  440    HE1  PHE  57           HE1      PHE  57   5.645   7.785  -3.813
  441    HE2  PHE  57           HE2      PHE  57   5.328  12.031  -4.045
  442    HZ   PHE  57           HZ       PHE  57   6.615   9.965  -4.420
  443    H    CYS  58           H        CYS  58   3.675   8.544   0.623
  444    HA   CYS  58           HA       CYS  58   4.153  11.262   1.625
  445   1HB   CYS  58          1HB       CYS  58   4.894   8.580   2.792
  446   2HB   CYS  58          2HB       CYS  58   5.406  10.123   3.469
  447    HG   CYS  58           HG       CYS  58   3.023   8.632   4.609
  448    H    HIS  59           H        HIS  59   6.142   8.357   0.882
  449    HA   HIS  59           HA       HIS  59   7.976  10.130  -0.523
  450   1HB   HIS  59          1HB       HIS  59   9.922   9.550   0.674
  451   2HB   HIS  59          2HB       HIS  59   8.733   9.963   1.884
  452    HD1  HIS  59           HD1      HIS  59   7.846   7.968   3.406
  453    HD2  HIS  59           HD2      HIS  59  10.909   6.978   0.762
  454    HE1  HIS  59           HE1      HIS  59   8.734   5.749   4.188
  455    HE2  HIS  59           HE2      HIS  59  10.539   5.126   2.531
  456    H    SER  60           H        SER  60   9.913   8.736  -1.282
  457    HA   SER  60           HA       SER  60   9.087   6.034  -2.073
  458   1HB   SER  60          1HB       SER  60  10.273   8.029  -4.021
  459   2HB   SER  60          2HB       SER  60   9.723   6.394  -4.381
  460    HG   SER  60           HG       SER  60   8.298   8.730  -4.149
  461    H    GLU  61           H        GLU  61  11.029   4.741  -2.807
  462    HA   GLU  61           HA       GLU  61  13.610   5.850  -2.203
  463   1HB   GLU  61          1HB       GLU  61  14.102   4.226  -0.356
  464   2HB   GLU  61          2HB       GLU  61  12.963   5.496   0.067
  465   1HG   GLU  61          1HG       GLU  61  11.110   3.930  -0.249
  466   2HG   GLU  61          2HG       GLU  61  12.261   2.657  -0.651
  467    H    LYS  62           H        LYS  62  15.289   3.980  -2.106
  468    HA   LYS  62           HA       LYS  62  15.269   2.568  -4.509
  469   1HB   LYS  62          1HB       LYS  62  17.159   1.273  -3.542
  470   2HB   LYS  62          2HB       LYS  62  17.342   3.009  -3.323
  471   1HG   LYS  62          1HG       LYS  62  16.631   2.836  -1.031
  472   2HG   LYS  62          2HG       LYS  62  16.300   1.117  -1.229
  473   1HD   LYS  62          1HD       LYS  62  18.655   0.683  -1.623
  474   2HD   LYS  62          2HD       LYS  62  19.009   2.409  -1.518
  475   1HE   LYS  62          1HE       LYS  62  19.546   1.215   0.564
  476   2HE   LYS  62          2HE       LYS  62  18.309   2.448   0.796
  477   1HZ   LYS  62          1HZ       LYS  62  17.742   0.414   1.955
  478   2HZ   LYS  62          2HZ       LYS  62  16.621   0.708   0.719
  479   3HZ   LYS  62          3HZ       LYS  62  17.823  -0.474   0.512
  480    H    ALA  63           H        ALA  63  14.773   0.493  -5.070
  481    HA   ALA  63           HA       ALA  63  13.081  -0.943  -3.136
  482   1HB   ALA  63          1HB       ALA  63  11.811  -1.769  -5.019
  483   2HB   ALA  63          2HB       ALA  63  11.886  -0.007  -5.066
  484   3HB   ALA  63          3HB       ALA  63  12.906  -0.961  -6.141
  485    HA   PRO  64           HA       PRO  64  16.314  -4.104  -3.601
  486   1HB   PRO  64          1HB       PRO  64  15.237  -5.684  -1.629
  487   2HB   PRO  64          2HB       PRO  64  16.381  -4.374  -1.326
  488   1HG   PRO  64          1HG       PRO  64  13.404  -4.392  -1.062
  489   2HG   PRO  64          2HG       PRO  64  14.619  -3.649  -0.006
  490   1HD   PRO  64          1HD       PRO  64  13.183  -2.206  -1.775
  491   2HD   PRO  64          2HD       PRO  64  14.865  -1.804  -1.375
  492    H    ASP  65           H        ASP  65  16.227  -6.199  -4.472
  493    HA   ASP  65           HA       ASP  65  14.174  -6.652  -6.300
  494   1HB   ASP  65          1HB       ASP  65  15.286  -8.713  -6.814
  495   2HB   ASP  65          2HB       ASP  65  16.511  -7.501  -6.479
  496    H    GLU  66           H        GLU  66  14.496  -7.657  -3.004
  497    HA   GLU  66           HA       GLU  66  12.745  -9.842  -2.981
  498   1HB   GLU  66          1HB       GLU  66  14.278  -9.189  -1.124
  499   2HB   GLU  66          2HB       GLU  66  13.206  -7.844  -0.759
  500   1HG   GLU  66          1HG       GLU  66  12.849  -9.740   0.736
  501   2HG   GLU  66          2HG       GLU  66  11.415  -9.371  -0.220
  502    H    VAL  67           H        VAL  67  12.111  -6.360  -2.527
  503    HA   VAL  67           HA       VAL  67   9.277  -6.857  -2.237
  504    HB   VAL  67           HB       VAL  67   8.976  -4.479  -2.018
  505   1HG1  VAL  67          1HG1      VAL  67   9.774  -5.661  -0.056
  506   2HG1  VAL  67          2HG1      VAL  67  11.445  -5.376  -0.542
  507   3HG1  VAL  67          3HG1      VAL  67  10.413  -4.018  -0.094
  508   1HG2  VAL  67          1HG2      VAL  67  10.807  -2.881  -2.242
  509   2HG2  VAL  67          2HG2      VAL  67  11.883  -4.177  -2.765
  510   3HG2  VAL  67          3HG2      VAL  67  10.504  -3.719  -3.764
  511    H    ILE  68           H        ILE  68  11.510  -6.118  -4.762
  512    HA   ILE  68           HA       ILE  68   9.809  -5.075  -6.723
  513    HB   ILE  68           HB       ILE  68  12.194  -6.903  -7.050
  514   1HG1  ILE  68          1HG1      ILE  68  12.802  -4.809  -6.014
  515   2HG1  ILE  68          2HG1      ILE  68  13.352  -4.790  -7.687
  516   1HG2  ILE  68          1HG2      ILE  68  12.269  -6.150  -9.385
  517   2HG2  ILE  68          2HG2      ILE  68  10.788  -7.041  -9.028
  518   3HG2  ILE  68          3HG2      ILE  68  10.754  -5.281  -9.144
  519   1HD1  ILE  68          1HD1      ILE  68  11.400  -3.436  -8.291
  520   2HD1  ILE  68          2HD1      ILE  68  10.905  -3.426  -6.598
  521   3HD1  ILE  68          3HD1      ILE  68  12.417  -2.655  -7.079
  522    H    GLU  69           H        GLU  69  10.716  -8.444  -6.072
  523    HA   GLU  69           HA       GLU  69   9.107  -9.610  -8.047
  524   1HB   GLU  69          1HB       GLU  69  11.007 -10.677  -6.759
  525   2HB   GLU  69          2HB       GLU  69   9.890 -10.869  -5.416
  526   1HG   GLU  69          1HG       GLU  69  10.103 -12.922  -6.689
  527   2HG   GLU  69          2HG       GLU  69   8.464 -12.284  -6.780
  528    H    ALA  70           H        ALA  70   8.397  -8.571  -4.781
  529    HA   ALA  70           HA       ALA  70   5.916  -9.901  -4.490
  530   1HB   ALA  70          1HB       ALA  70   5.505  -8.337  -2.659
  531   2HB   ALA  70          2HB       ALA  70   7.139  -8.999  -2.584
  532   3HB   ALA  70          3HB       ALA  70   6.878  -7.361  -3.182
  533    H    ILE  71           H        ILE  71   6.749  -6.612  -5.555
  534    HA   ILE  71           HA       ILE  71   4.052  -5.837  -6.087
  535    HB   ILE  71           HB       ILE  71   6.596  -4.665  -7.231
  536   1HG1  ILE  71          1HG1      ILE  71   5.059  -3.814  -4.767
  537   2HG1  ILE  71          2HG1      ILE  71   6.550  -4.751  -4.734
  538   1HG2  ILE  71          1HG2      ILE  71   5.247  -2.625  -7.491
  539   2HG2  ILE  71          2HG2      ILE  71   4.608  -3.969  -8.438
  540   3HG2  ILE  71          3HG2      ILE  71   3.827  -3.505  -6.927
  541   1HD1  ILE  71          1HD1      ILE  71   6.978  -2.410  -4.291
  542   2HD1  ILE  71          2HD1      ILE  71   7.728  -2.903  -5.810
  543   3HD1  ILE  71          3HD1      ILE  71   6.233  -1.965  -5.826
  544    H    LYS  72           H        LYS  72   6.687  -7.148  -7.990
  545    HA   LYS  72           HA       LYS  72   5.537  -7.064 -10.537
  546   1HB   LYS  72          1HB       LYS  72   7.850  -7.534 -10.292
  547   2HB   LYS  72          2HB       LYS  72   7.540  -8.882  -9.212
  548   1HG   LYS  72          1HG       LYS  72   6.536 -10.104 -11.133
  549   2HG   LYS  72          2HG       LYS  72   7.059  -8.773 -12.177
  550   1HD   LYS  72          1HD       LYS  72   9.343  -9.160 -11.666
  551   2HD   LYS  72          2HD       LYS  72   8.932 -10.273 -10.363
  552   1HE   LYS  72          1HE       LYS  72   7.900 -11.759 -12.102
  553   2HE   LYS  72          2HE       LYS  72   8.603 -10.695 -13.320
  554   1HZ   LYS  72          1HZ       LYS  72   9.968 -12.677 -12.791
  555   2HZ   LYS  72          2HZ       LYS  72  10.781 -11.208 -12.547
  556   3HZ   LYS  72          3HZ       LYS  72  10.178 -12.074 -11.221
  557    H    GLN  73           H        GLN  73   5.098  -9.278  -7.868
  558    HA   GLN  73           HA       GLN  73   3.630 -11.187  -9.479
  559   1HB   GLN  73          1HB       GLN  73   5.209 -11.846  -7.639
  560   2HB   GLN  73          2HB       GLN  73   4.059 -11.179  -6.490
  561   1HG   GLN  73          1HG       GLN  73   3.813 -13.571  -6.617
  562   2HG   GLN  73          2HG       GLN  73   2.375 -12.785  -7.264
  563   1HE2  GLN  73          2HE2      GLN  73   1.927 -12.928  -9.445
  564   2HE2  GLN  73          1HE2      GLN  73   2.735 -14.046 -10.489
  565    H    ASN  74           H        ASN  74   2.928  -9.087  -6.675
  566    HA   ASN  74           HA       ASN  74   0.101  -9.831  -6.900
  567   1HB   ASN  74          1HB       ASN  74   1.590  -8.382  -4.701
  568   2HB   ASN  74          2HB       ASN  74  -0.122  -8.792  -4.659
  569   1HD2  ASN  74          2HD2      ASN  74   3.122  -9.994  -4.448
  570   2HD2  ASN  74          1HD2      ASN  74   2.716 -11.572  -3.866
  571    H    GLY  75           H        GLY  75   2.166  -7.235  -7.672
  572   1HA   GLY  75          1HA       GLY  75   1.481  -5.299  -8.841
  573   2HA   GLY  75          2HA       GLY  75  -0.150  -5.531  -8.224
  574    H    TYR  76           H        TYR  76   1.150  -6.028  -5.519
  575    HA   TYR  76           HA       TYR  76   2.136  -3.428  -4.760
  576   1HB   TYR  76          1HB       TYR  76   0.332  -3.076  -3.074
  577   2HB   TYR  76          2HB       TYR  76  -0.242  -2.965  -4.732
  578    HD1  TYR  76           HD1      TYR  76  -1.646  -4.768  -5.679
  579    HD2  TYR  76           HD2      TYR  76  -0.468  -4.793  -1.591
  580    HE1  TYR  76           HE1      TYR  76  -3.409  -6.409  -5.188
  581    HE2  TYR  76           HE2      TYR  76  -2.222  -6.440  -1.092
  582    HH   TYR  76           HH       TYR  76  -3.899  -8.137  -3.513
  583    H    PHE  77           H        PHE  77   3.183  -3.460  -2.770
  584    HA   PHE  77           HA       PHE  77   3.217  -6.071  -1.406
  585   1HB   PHE  77          1HB       PHE  77   5.402  -5.538  -2.365
  586   2HB   PHE  77          2HB       PHE  77   5.408  -3.981  -1.540
  587    HD1  PHE  77           HD1      PHE  77   6.558  -3.817   0.444
  588    HD2  PHE  77           HD2      PHE  77   5.069  -7.615  -0.762
  589    HE1  PHE  77           HE1      PHE  77   7.635  -4.855   2.396
  590    HE2  PHE  77           HE2      PHE  77   6.144  -8.661   1.186
  591    HZ   PHE  77           HZ       PHE  77   7.429  -7.281   2.770
  592    H    ILE  78           H        ILE  78   2.079  -6.018   0.386
  593    HA   ILE  78           HA       ILE  78   1.610  -3.528   1.789
  594    HB   ILE  78           HB       ILE  78   0.648  -6.326   2.424
  595   1HG1  ILE  78          1HG1      ILE  78  -0.246  -5.486   0.299
  596   2HG1  ILE  78          2HG1      ILE  78  -1.509  -5.569   1.522
  597   1HG2  ILE  78          1HG2      ILE  78  -0.195  -3.668   3.572
  598   2HG2  ILE  78          2HG2      ILE  78  -0.961  -5.221   3.907
  599   3HG2  ILE  78          3HG2      ILE  78   0.704  -4.933   4.411
  600   1HD1  ILE  78          1HD1      ILE  78  -0.054  -3.078   0.662
  601   2HD1  ILE  78          2HD1      ILE  78  -1.687  -3.548   0.190
  602   3HD1  ILE  78          3HD1      ILE  78  -1.333  -3.166   1.873
  603    H    TYR  79           H        TYR  79   3.476  -2.914   2.797
  604    HA   TYR  79           HA       TYR  79   4.928  -4.803   4.444
  605   1HB   TYR  79          1HB       TYR  79   6.184  -3.096   3.222
  606   2HB   TYR  79          2HB       TYR  79   5.289  -1.824   4.044
  607    HD1  TYR  79           HD1      TYR  79   6.779  -4.915   5.510
  608    HD2  TYR  79           HD2      TYR  79   6.941  -0.673   5.212
  609    HE1  TYR  79           HE1      TYR  79   8.478  -4.860   7.286
  610    HE2  TYR  79           HE2      TYR  79   8.638  -0.609   6.986
  611    HH   TYR  79           HH       TYR  79   9.349  -2.016   8.897
  612    H    LYS  80           H        LYS  80   3.786  -5.436   6.133
  613    HA   LYS  80           HA       LYS  80   1.897  -3.797   7.497
  614   1HB   LYS  80          1HB       LYS  80   2.185  -6.441   7.232
  615   2HB   LYS  80          2HB       LYS  80   3.020  -6.249   8.765
  616   1HG   LYS  80          1HG       LYS  80   1.048  -5.279   9.761
  617   2HG   LYS  80          2HG       LYS  80   0.205  -5.339   8.211
  618   1HD   LYS  80          1HD       LYS  80   1.169  -7.683   9.846
  619   2HD   LYS  80          2HD       LYS  80  -0.506  -7.198   9.575
  620   1HE   LYS  80          1HE       LYS  80  -0.201  -7.631   7.160
  621   2HE   LYS  80          2HE       LYS  80   1.439  -8.187   7.490
  622   1HZ   LYS  80          1HZ       LYS  80   0.454  -9.916   8.945
  623   2HZ   LYS  80          2HZ       LYS  80  -1.089  -9.422   8.446
  624   3HZ   LYS  80          3HZ       LYS  80   0.004 -10.071   7.318
  625    H    MET  81           H        MET  81   2.717  -2.035   8.536
  626    HA   MET  81           HA       MET  81   5.245  -2.300   9.928
  627   1HB   MET  81          1HB       MET  81   3.578   0.127   9.311
  628   2HB   MET  81          2HB       MET  81   5.081   0.173  10.224
  629   1HG   MET  81          1HG       MET  81   5.885  -1.168   8.031
  630   2HG   MET  81          2HG       MET  81   4.625  -0.145   7.341
  631   1HE   MET  81          1HE       MET  81   4.576   2.518   7.705
  632   2HE   MET  81          2HE       MET  81   5.896   3.429   8.440
  633   3HE   MET  81          3HE       MET  81   4.891   2.375   9.435
  634    H    GLU  82           H        GLU  82   2.073  -0.875  10.688
  635    HA   GLU  82           HA       GLU  82   2.695  -1.246  13.543
  636   1HB   GLU  82          1HB       GLU  82   2.289   1.093  12.361
  637   2HB   GLU  82          2HB       GLU  82   0.603   0.656  12.589
  638   1HG   GLU  82          1HG       GLU  82   1.262   2.002  14.423
  639   2HG   GLU  82          2HG       GLU  82   1.089   0.347  15.010
  640    H    GLY  83           H        GLY  83   1.361  -2.450  14.761
  641   1HA   GLY  83          1HA       GLY  83  -0.826  -3.063  15.484
  642   2HA   GLY  83          2HA       GLY  83  -1.402  -2.851  13.838
  643    H    CYS  84           H        CYS  84   1.517  -4.486  13.845
  644    HA   CYS  84           HA       CYS  84   0.843  -7.081  14.601
  645   1HB   CYS  84          1HB       CYS  84  -0.804  -6.978  12.772
  646   2HB   CYS  84          2HB       CYS  84   0.479  -6.574  11.637
  647    HG   CYS  84           HG       CYS  84   1.741  -9.020  11.738
  648    H    ASN  85           H        ASN  85   2.722  -8.052  14.886
  649    HA   ASN  85           HA       ASN  85   4.785  -7.815  12.827
  650   1HB   ASN  85          1HB       ASN  85   5.409  -6.203  14.609
  651   2HB   ASN  85          2HB       ASN  85   5.374  -7.517  15.784
  652   1HD2  ASN  85          2HD2      ASN  85   7.537  -7.310  16.304
  653   2HD2  ASN  85          1HD2      ASN  85   8.806  -7.775  15.214
  Start of MODEL    7
    1    H    MET   1           H        MET   1  16.093   0.932  -8.628
    2    HA   MET   1           HA       MET   1  14.078   1.122  -9.850
    3   1HB   MET   1          1HB       MET   1  13.689  -1.434  -9.721
    4   2HB   MET   1          2HB       MET   1  12.916  -1.101  -8.177
    5   1HG   MET   1          1HG       MET   1  11.393   0.478  -9.367
    6   2HG   MET   1          2HG       MET   1  12.094  -0.080 -10.883
    7   1HE   MET   1          1HE       MET   1  10.906  -1.873  -7.531
    8   2HE   MET   1          2HE       MET   1   9.345  -2.482  -8.083
    9   3HE   MET   1          3HE       MET   1   9.637  -0.745  -8.006
   10    H    GLN   2           H        GLN   2  12.173   2.213  -8.970
   11    HA   GLN   2           HA       GLN   2  12.606   3.031  -6.188
   12   1HB   GLN   2          1HB       GLN   2  11.024   4.915  -6.812
   13   2HB   GLN   2          2HB       GLN   2  12.588   4.927  -7.615
   14   1HG   GLN   2          1HG       GLN   2  11.684   4.244  -9.651
   15   2HG   GLN   2          2HG       GLN   2  10.194   3.673  -8.902
   16   1HE2  GLN   2          2HE2      GLN   2   8.570   5.091  -8.456
   17   2HE2  GLN   2          1HE2      GLN   2   8.575   6.747  -8.998
   18    H    ILE   3           H        ILE   3  10.744   3.313  -4.815
   19    HA   ILE   3           HA       ILE   3   8.301   1.933  -5.661
   20    HB   ILE   3           HB       ILE   3   8.153   1.060  -3.239
   21   1HG1  ILE   3          1HG1      ILE   3  11.154   1.380  -3.483
   22   2HG1  ILE   3          2HG1      ILE   3  10.115   2.282  -2.386
   23   1HG2  ILE   3          1HG2      ILE   3   9.406  -1.004  -3.862
   24   2HG2  ILE   3          2HG2      ILE   3   8.261  -0.436  -5.079
   25   3HG2  ILE   3          3HG2      ILE   3   9.985  -0.147  -5.291
   26   1HD1  ILE   3          1HD1      ILE   3  10.563  -0.694  -2.333
   27   2HD1  ILE   3          2HD1      ILE   3  11.293   0.487  -1.244
   28   3HD1  ILE   3          3HD1      ILE   3   9.549   0.224  -1.220
   29    H    HIS   4           H        HIS   4   6.477   2.923  -5.051
   30    HA   HIS   4           HA       HIS   4   6.647   5.368  -3.509
   31   1HB   HIS   4          1HB       HIS   4   4.364   3.947  -4.883
   32   2HB   HIS   4          2HB       HIS   4   4.119   5.366  -3.876
   33    HD1  HIS   4           HD1      HIS   4   3.245   6.740  -5.847
   34    HD2  HIS   4           HD2      HIS   4   7.123   5.326  -6.373
   35    HE1  HIS   4           HE1      HIS   4   4.161   7.991  -7.830
   36    HE2  HIS   4           HE2      HIS   4   6.572   7.264  -7.999
   37    H    VAL   5           H        VAL   5   6.583   5.343  -1.382
   38    HA   VAL   5           HA       VAL   5   5.484   3.021   0.007
   39    HB   VAL   5           HB       VAL   5   6.944   5.412   1.153
   40   1HG1  VAL   5          1HG1      VAL   5   5.566   4.248   2.787
   41   2HG1  VAL   5          2HG1      VAL   5   6.315   2.714   2.345
   42   3HG1  VAL   5          3HG1      VAL   5   7.279   3.979   3.109
   43   1HG2  VAL   5          1HG2      VAL   5   8.382   4.213  -0.396
   44   2HG2  VAL   5          2HG2      VAL   5   8.905   3.929   1.265
   45   3HG2  VAL   5          3HG2      VAL   5   7.998   2.687   0.399
   46    H    TYR   6           H        TYR   6   3.365   3.100   0.385
   47    HA   TYR   6           HA       TYR   6   2.176   5.679   1.154
   48   1HB   TYR   6          1HB       TYR   6   0.822   3.179   0.123
   49   2HB   TYR   6          2HB       TYR   6   0.006   4.679   0.550
   50    HD1  TYR   6           HD1      TYR   6   1.616   2.840  -2.044
   51    HD2  TYR   6           HD2      TYR   6   0.652   6.787  -0.783
   52    HE1  TYR   6           HE1      TYR   6   1.909   3.642  -4.348
   53    HE2  TYR   6           HE2      TYR   6   0.944   7.599  -3.086
   54    HH   TYR   6           HH       TYR   6   1.028   5.619  -5.737
   55    H    ASP   7           H        ASP   7   2.488   5.754   3.335
   56    HA   ASP   7           HA       ASP   7   1.937   3.526   5.062
   57   1HB   ASP   7          1HB       ASP   7   3.555   5.280   5.704
   58   2HB   ASP   7          2HB       ASP   7   2.264   6.472   5.713
   59    H    THR   8           H        THR   8  -0.106   2.843   4.654
   60    HA   THR   8           HA       THR   8  -2.260   4.747   4.333
   61    HB   THR   8           HB       THR   8  -2.368   1.726   4.276
   62    HG1  THR   8           HG1      THR   8  -0.941   2.897   2.699
   63   1HG2  THR   8          1HG2      THR   8  -4.414   2.073   2.965
   64   2HG2  THR   8          2HG2      THR   8  -4.556   2.788   4.570
   65   3HG2  THR   8          3HG2      THR   8  -4.252   3.817   3.171
   66    H    TYR   9           H        TYR   9  -3.405   5.477   5.952
   67    HA   TYR   9           HA       TYR   9  -3.345   4.134   8.537
   68   1HB   TYR   9          1HB       TYR   9  -4.748   6.722   7.855
   69   2HB   TYR   9          2HB       TYR   9  -4.210   6.168   9.437
   70    HD1  TYR   9           HD1      TYR   9  -3.319   7.961   6.446
   71    HD2  TYR   9           HD2      TYR   9  -1.735   6.069   9.909
   72    HE1  TYR   9           HE1      TYR   9  -1.200   9.166   6.123
   73    HE2  TYR   9           HE2      TYR   9   0.386   7.269   9.599
   74    HH   TYR   9           HH       TYR   9   1.636   8.308   7.607
   75    H    VAL  10           H        VAL  10  -4.788   2.504   8.728
   76    HA   VAL  10           HA       VAL  10  -7.489   2.917   7.631
   77    HB   VAL  10           HB       VAL  10  -6.117   0.348   8.458
   78   1HG1  VAL  10          1HG1      VAL  10  -8.502   0.197   8.853
   79   2HG1  VAL  10          2HG1      VAL  10  -8.834   0.804   7.230
   80   3HG1  VAL  10          3HG1      VAL  10  -8.067  -0.769   7.442
   81   1HG2  VAL  10          1HG2      VAL  10  -6.814   1.436   5.732
   82   2HG2  VAL  10          2HG2      VAL  10  -5.196   1.260   6.407
   83   3HG2  VAL  10          3HG2      VAL  10  -6.164  -0.171   6.055
   84    H    LYS  11           H        LYS  11  -8.968   3.520   9.036
   85    HA   LYS  11           HA       LYS  11  -8.465   3.280  11.878
   86   1HB   LYS  11          1HB       LYS  11 -10.854   4.493  10.476
   87   2HB   LYS  11          2HB       LYS  11 -10.376   4.733  12.152
   88   1HG   LYS  11          1HG       LYS  11  -8.304   5.825  11.369
   89   2HG   LYS  11          2HG       LYS  11  -8.877   5.656   9.709
   90   1HD   LYS  11          1HD       LYS  11 -10.878   6.991  10.316
   91   2HD   LYS  11          2HD       LYS  11 -10.187   7.237  11.921
   92   1HE   LYS  11          1HE       LYS  11  -9.689   9.171  10.617
   93   2HE   LYS  11          2HE       LYS  11  -8.191   8.263  10.813
   94   1HZ   LYS  11          1HZ       LYS  11  -8.558   7.325   8.588
   95   2HZ   LYS  11          2HZ       LYS  11  -9.940   8.288   8.408
   96   3HZ   LYS  11          3HZ       LYS  11  -8.410   9.010   8.551
   97    H    ALA  12           H        ALA  12  -8.809   1.290  12.630
   98    HA   ALA  12           HA       ALA  12 -10.784  -0.500  11.660
   99   1HB   ALA  12          1HB       ALA  12 -10.138  -1.921  13.526
  100   2HB   ALA  12          2HB       ALA  12  -8.713  -1.257  12.726
  101   3HB   ALA  12          3HB       ALA  12  -9.259  -0.579  14.260
  102    H    LYS  13           H        LYS  13 -12.531  -1.431  12.952
  103    HA   LYS  13           HA       LYS  13 -14.300   0.638  13.784
  104   1HB   LYS  13          1HB       LYS  13 -14.654  -2.339  14.160
  105   2HB   LYS  13          2HB       LYS  13 -15.918  -1.117  14.133
  106   1HG   LYS  13          1HG       LYS  13 -15.359  -0.650  11.770
  107   2HG   LYS  13          2HG       LYS  13 -14.186  -1.967  11.821
  108   1HD   LYS  13          1HD       LYS  13 -16.065  -3.483  12.502
  109   2HD   LYS  13          2HD       LYS  13 -17.172  -2.151  12.173
  110   1HE   LYS  13          1HE       LYS  13 -17.144  -3.515  10.232
  111   2HE   LYS  13          2HE       LYS  13 -16.213  -2.067   9.850
  112   1HZ   LYS  13          1HZ       LYS  13 -15.184  -4.192   9.106
  113   2HZ   LYS  13          2HZ       LYS  13 -14.184  -3.268  10.118
  114   3HZ   LYS  13          3HZ       LYS  13 -14.990  -4.625  10.732
  115    H    ASP  14           H        ASP  14 -12.207  -1.573  15.454
  116    HA   ASP  14           HA       ASP  14 -13.379  -1.315  18.032
  117   1HB   ASP  14          1HB       ASP  14 -11.952  -3.215  17.502
  118   2HB   ASP  14          2HB       ASP  14 -10.585  -2.143  17.214
  119    H    GLY  15           H        GLY  15 -11.162   0.600  16.190
  120   1HA   GLY  15          1HA       GLY  15 -10.865   2.921  16.810
  121   2HA   GLY  15          2HA       GLY  15 -10.900   2.419  18.495
  122    H    HIS  16           H        HIS  16  -9.077   1.619  15.551
  123    HA   HIS  16           HA       HIS  16  -6.590   2.269  16.901
  124   1HB   HIS  16          1HB       HIS  16  -6.936  -0.118  17.427
  125   2HB   HIS  16          2HB       HIS  16  -7.099  -0.470  15.714
  126    HD1  HIS  16           HD1      HIS  16  -4.505   0.640  18.237
  127    HD2  HIS  16           HD2      HIS  16  -4.739  -0.929  14.394
  128    HE1  HIS  16           HE1      HIS  16  -2.144   0.046  17.602
  129    HE2  HIS  16           HE2      HIS  16  -2.329  -1.020  15.324
  130    H    VAL  17           H        VAL  17  -5.008   2.897  15.495
  131    HA   VAL  17           HA       VAL  17  -5.910   3.327  12.749
  132    HB   VAL  17           HB       VAL  17  -3.488   4.483  14.147
  133   1HG1  VAL  17          1HG1      VAL  17  -3.231   4.412  11.729
  134   2HG1  VAL  17          2HG1      VAL  17  -4.791   5.209  11.522
  135   3HG1  VAL  17          3HG1      VAL  17  -3.452   6.074  12.278
  136   1HG2  VAL  17          1HG2      VAL  17  -4.791   6.552  14.299
  137   2HG2  VAL  17          2HG2      VAL  17  -6.189   5.722  13.615
  138   3HG2  VAL  17          3HG2      VAL  17  -5.559   5.240  15.191
  139    H    MET  18           H        MET  18  -5.576   1.442  11.712
  140    HA   MET  18           HA       MET  18  -3.084   0.005  11.942
  141   1HB   MET  18          1HB       MET  18  -5.442  -0.361  10.078
  142   2HB   MET  18          2HB       MET  18  -4.067  -1.452  10.181
  143   1HG   MET  18          1HG       MET  18  -4.632  -2.074  12.407
  144   2HG   MET  18          2HG       MET  18  -5.868  -0.822  12.501
  145   1HE   MET  18          1HE       MET  18  -4.807  -4.158  10.688
  146   2HE   MET  18          2HE       MET  18  -5.211  -3.086   9.347
  147   3HE   MET  18          3HE       MET  18  -6.232  -4.479   9.700
  148    H    HIS  19           H        HIS  19  -1.531   1.495  11.244
  149    HA   HIS  19           HA       HIS  19  -1.717   2.235   8.415
  150   1HB   HIS  19          1HB       HIS  19  -0.075   3.961   8.818
  151   2HB   HIS  19          2HB       HIS  19  -1.375   4.118   9.990
  152    HD1  HIS  19           HD1      HIS  19   2.242   3.798   9.692
  153    HD2  HIS  19           HD2      HIS  19  -0.627   3.207  12.647
  154    HE1  HIS  19           HE1      HIS  19   3.512   3.729  11.872
  155    HE2  HIS  19           HE2      HIS  19   1.741   3.470  13.660
  156    H    PHE  20           H        PHE  20  -0.386   1.441   6.971
  157    HA   PHE  20           HA       PHE  20   1.957  -0.086   7.786
  158   1HB   PHE  20          1HB       PHE  20   1.164  -1.990   6.285
  159   2HB   PHE  20          2HB       PHE  20   0.340  -1.826   7.832
  160    HD1  PHE  20           HD1      PHE  20   0.027  -1.423   4.196
  161    HD2  PHE  20           HD2      PHE  20  -1.968  -1.195   7.949
  162    HE1  PHE  20           HE1      PHE  20  -2.140  -1.332   3.035
  163    HE2  PHE  20           HE2      PHE  20  -4.137  -1.103   6.793
  164    HZ   PHE  20           HZ       PHE  20  -4.225  -1.172   4.334
  165    H    ASP  21           H        ASP  21   3.143  -0.882   5.757
  166    HA   ASP  21           HA       ASP  21   3.250   1.445   3.984
  167   1HB   ASP  21          1HB       ASP  21   5.239  -0.810   4.354
  168   2HB   ASP  21          2HB       ASP  21   5.472   0.596   3.324
  169    H    VAL  22           H        VAL  22   1.931   1.206   2.292
  170    HA   VAL  22           HA       VAL  22   1.764  -1.319   0.879
  171    HB   VAL  22           HB       VAL  22   0.634   1.382   0.108
  172   1HG1  VAL  22          1HG1      VAL  22  -0.796   0.110  -1.424
  173   2HG1  VAL  22          2HG1      VAL  22   0.913  -0.081  -1.818
  174   3HG1  VAL  22          3HG1      VAL  22   0.051  -1.371  -0.979
  175   1HG2  VAL  22          1HG2      VAL  22  -0.680  -0.973   1.459
  176   2HG2  VAL  22          2HG2      VAL  22  -0.327   0.592   2.192
  177   3HG2  VAL  22          3HG2      VAL  22  -1.512   0.475   0.891
  178    H    PHE  23           H        PHE  23   3.705  -1.799   0.011
  179    HA   PHE  23           HA       PHE  23   5.234   0.206  -1.404
  180   1HB   PHE  23          1HB       PHE  23   5.682  -2.745  -0.955
  181   2HB   PHE  23          2HB       PHE  23   6.771  -1.732  -1.894
  182    HD1  PHE  23           HD1      PHE  23   6.099  -3.048   1.284
  183    HD2  PHE  23           HD2      PHE  23   7.625   0.417  -0.658
  184    HE1  PHE  23           HE1      PHE  23   7.292  -2.422   3.342
  185    HE2  PHE  23           HE2      PHE  23   8.821   1.047   1.395
  186    HZ   PHE  23           HZ       PHE  23   8.658  -0.374   3.399
  187    H    THR  24           H        THR  24   4.397   0.820  -3.286
  188    HA   THR  24           HA       THR  24   4.392  -1.174  -5.390
  189    HB   THR  24           HB       THR  24   2.037  -1.184  -4.713
  190    HG1  THR  24           HG1      THR  24   1.653  -1.385  -6.770
  191   1HG2  THR  24          1HG2      THR  24   2.081   1.773  -5.332
  192   2HG2  THR  24          2HG2      THR  24   0.642   0.818  -4.973
  193   3HG2  THR  24          3HG2      THR  24   1.880   1.048  -3.737
  194    H    ASP  25           H        ASP  25   4.871  -0.261  -7.425
  195    HA   ASP  25           HA       ASP  25   5.527   2.604  -7.293
  196   1HB   ASP  25          1HB       ASP  25   7.469   0.997  -7.549
  197   2HB   ASP  25          2HB       ASP  25   6.825   0.598  -9.141
  198    H    VAL  26           H        VAL  26   3.191   0.727  -8.313
  199    HA   VAL  26           HA       VAL  26   2.793   1.497 -11.013
  200    HB   VAL  26           HB       VAL  26   0.718   0.784  -8.924
  201   1HG1  VAL  26          1HG1      VAL  26   0.525   0.871 -11.933
  202   2HG1  VAL  26          2HG1      VAL  26  -0.719   0.248 -10.848
  203   3HG1  VAL  26          3HG1      VAL  26  -0.280   1.955 -10.799
  204   1HG2  VAL  26          1HG2      VAL  26   2.358  -0.998  -9.250
  205   2HG2  VAL  26          2HG2      VAL  26   0.784  -1.459  -9.901
  206   3HG2  VAL  26          3HG2      VAL  26   2.075  -0.948 -10.990
  207    H    ARG  27           H        ARG  27   2.651   3.553 -11.655
  208    HA   ARG  27           HA       ARG  27   2.088   5.624  -9.769
  209   1HB   ARG  27          1HB       ARG  27   2.590   5.771 -12.742
  210   2HB   ARG  27          2HB       ARG  27   2.436   7.167 -11.684
  211   1HG   ARG  27          1HG       ARG  27   4.368   6.228 -10.360
  212   2HG   ARG  27          2HG       ARG  27   4.588   5.070 -11.672
  213   1HD   ARG  27          1HD       ARG  27   4.669   8.076 -11.924
  214   2HD   ARG  27          2HD       ARG  27   6.067   7.003 -11.924
  215    HE   ARG  27           HE       ARG  27   5.213   6.073 -14.029
  216   1HH1  ARG  27          1HH1      ARG  27   4.031   9.205 -12.982
  217   2HH1  ARG  27          2HH1      ARG  27   3.580   9.711 -14.581
  218   1HH2  ARG  27          1HH2      ARG  27   4.653   6.758 -16.145
  219   2HH2  ARG  27          2HH2      ARG  27   3.945   8.326 -16.372
  220    H    ASP  28           H        ASP  28  -0.050   4.795  -9.260
  221    HA   ASP  28           HA       ASP  28  -1.942   6.563 -10.569
  222   1HB   ASP  28          1HB       ASP  28  -2.360   4.368 -11.666
  223   2HB   ASP  28          2HB       ASP  28  -2.609   3.646 -10.082
  224    H    ASP  29           H        ASP  29  -2.639   7.768  -8.985
  225    HA   ASP  29           HA       ASP  29  -1.961   7.387  -6.323
  226   1HB   ASP  29          1HB       ASP  29  -4.199   9.121  -7.382
  227   2HB   ASP  29          2HB       ASP  29  -3.342   9.324  -5.854
  228    H    LYS  30           H        LYS  30  -4.905   6.505  -8.039
  229    HA   LYS  30           HA       LYS  30  -6.225   5.892  -5.530
  230   1HB   LYS  30          1HB       LYS  30  -8.213   5.541  -6.771
  231   2HB   LYS  30          2HB       LYS  30  -7.432   6.953  -7.463
  232   1HG   LYS  30          1HG       LYS  30  -6.534   5.485  -9.263
  233   2HG   LYS  30          2HG       LYS  30  -7.516   4.174  -8.599
  234   1HD   LYS  30          1HD       LYS  30  -9.459   5.888  -8.796
  235   2HD   LYS  30          2HD       LYS  30  -8.386   6.705  -9.934
  236   1HE   LYS  30          1HE       LYS  30  -9.836   5.248 -11.165
  237   2HE   LYS  30          2HE       LYS  30  -8.207   4.572 -11.198
  238   1HZ   LYS  30          1HZ       LYS  30 -10.325   3.717  -9.300
  239   2HZ   LYS  30          2HZ       LYS  30  -9.971   2.913 -10.751
  240   3HZ   LYS  30          3HZ       LYS  30  -8.806   2.996  -9.522
  241    H    LYS  31           H        LYS  31  -4.231   4.265  -7.755
  242    HA   LYS  31           HA       LYS  31  -5.244   1.630  -7.431
  243   1HB   LYS  31          1HB       LYS  31  -2.608   2.751  -8.299
  244   2HB   LYS  31          2HB       LYS  31  -2.728   1.041  -7.918
  245   1HG   LYS  31          1HG       LYS  31  -4.379   2.505  -9.956
  246   2HG   LYS  31          2HG       LYS  31  -3.000   1.460 -10.295
  247   1HD   LYS  31          1HD       LYS  31  -4.154  -0.464  -9.569
  248   2HD   LYS  31          2HD       LYS  31  -5.425   0.492  -8.805
  249   1HE   LYS  31          1HE       LYS  31  -4.874   0.309 -11.761
  250   2HE   LYS  31          2HE       LYS  31  -6.204  -0.469 -10.901
  251   1HZ   LYS  31          1HZ       LYS  31  -5.766   2.470 -11.068
  252   2HZ   LYS  31          2HZ       LYS  31  -6.887   1.591 -11.994
  253   3HZ   LYS  31          3HZ       LYS  31  -7.070   1.687 -10.308
  254    H    ALA  32           H        ALA  32  -2.974   3.605  -5.633
  255    HA   ALA  32           HA       ALA  32  -2.014   1.714  -3.828
  256   1HB   ALA  32          1HB       ALA  32  -2.648   4.608  -3.256
  257   2HB   ALA  32          2HB       ALA  32  -1.521   3.583  -2.370
  258   3HB   ALA  32          3HB       ALA  32  -1.177   4.034  -4.042
  259    H    ILE  33           H        ILE  33  -4.981   3.584  -3.845
  260    HA   ILE  33           HA       ILE  33  -5.987   2.655  -1.355
  261    HB   ILE  33           HB       ILE  33  -7.440   3.823  -3.738
  262   1HG1  ILE  33          1HG1      ILE  33  -6.510   5.129  -1.168
  263   2HG1  ILE  33          2HG1      ILE  33  -5.714   5.293  -2.731
  264   1HG2  ILE  33          1HG2      ILE  33  -8.385   3.452  -0.896
  265   2HG2  ILE  33          2HG2      ILE  33  -9.258   4.305  -2.169
  266   3HG2  ILE  33          3HG2      ILE  33  -8.964   2.572  -2.311
  267   1HD1  ILE  33          1HD1      ILE  33  -7.713   6.368  -3.632
  268   2HD1  ILE  33          2HD1      ILE  33  -8.505   6.206  -2.064
  269   3HD1  ILE  33          3HD1      ILE  33  -7.081   7.233  -2.231
  270    H    GLU  34           H        GLU  34  -6.586   1.740  -4.737
  271    HA   GLU  34           HA       GLU  34  -8.555  -0.193  -4.202
  272   1HB   GLU  34          1HB       GLU  34  -6.679   0.040  -6.561
  273   2HB   GLU  34          2HB       GLU  34  -8.097  -0.998  -6.503
  274   1HG   GLU  34          1HG       GLU  34  -9.518   0.975  -6.206
  275   2HG   GLU  34          2HG       GLU  34  -8.093   2.005  -6.297
  276    H    PHE  35           H        PHE  35  -5.033  -0.488  -4.526
  277    HA   PHE  35           HA       PHE  35  -4.968  -3.313  -4.298
  278   1HB   PHE  35          1HB       PHE  35  -2.866  -1.219  -3.733
  279   2HB   PHE  35          2HB       PHE  35  -2.556  -2.948  -3.633
  280    HD1  PHE  35           HD1      PHE  35  -1.431  -0.631  -5.491
  281    HD2  PHE  35           HD2      PHE  35  -4.214  -3.807  -6.004
  282    HE1  PHE  35           HE1      PHE  35  -0.931  -0.675  -7.900
  283    HE2  PHE  35           HE2      PHE  35  -3.720  -3.858  -8.414
  284    HZ   PHE  35           HZ       PHE  35  -2.075  -2.290  -9.365
  285    H    ALA  36           H        ALA  36  -4.814  -0.703  -1.925
  286    HA   ALA  36           HA       ALA  36  -4.351  -2.317   0.343
  287   1HB   ALA  36          1HB       ALA  36  -5.800   0.326   0.175
  288   2HB   ALA  36          2HB       ALA  36  -5.167  -0.417   1.644
  289   3HB   ALA  36          3HB       ALA  36  -4.060   0.114   0.378
  290    H    LYS  37           H        LYS  37  -7.304  -1.244  -1.271
  291    HA   LYS  37           HA       LYS  37  -9.195  -2.266   0.502
  292   1HB   LYS  37          1HB       LYS  37  -9.262  -1.911  -2.490
  293   2HB   LYS  37          2HB       LYS  37 -10.657  -2.460  -1.574
  294   1HG   LYS  37          1HG       LYS  37  -9.234   0.123  -1.001
  295   2HG   LYS  37          2HG       LYS  37 -10.592  -0.010  -2.117
  296   1HD   LYS  37          1HD       LYS  37 -11.953  -0.958  -0.263
  297   2HD   LYS  37          2HD       LYS  37 -10.599  -0.657   0.830
  298   1HE   LYS  37          1HE       LYS  37 -10.741   1.706   0.451
  299   2HE   LYS  37          2HE       LYS  37 -11.942   1.477  -0.819
  300   1HZ   LYS  37          1HZ       LYS  37 -13.459   0.583   0.871
  301   2HZ   LYS  37          2HZ       LYS  37 -12.317   0.912   2.076
  302   3HZ   LYS  37          3HZ       LYS  37 -13.014   2.181   1.197
  303    H    GLN  38           H        GLN  38  -7.397  -3.871  -2.079
  304    HA   GLN  38           HA       GLN  38  -8.782  -6.308  -2.061
  305   1HB   GLN  38          1HB       GLN  38  -5.867  -5.782  -2.665
  306   2HB   GLN  38          2HB       GLN  38  -6.697  -7.294  -3.000
  307   1HG   GLN  38          1HG       GLN  38  -8.264  -6.021  -4.466
  308   2HG   GLN  38          2HG       GLN  38  -7.242  -4.605  -4.229
  309   1HE2  GLN  38          2HE2      GLN  38  -5.994  -7.861  -4.469
  310   2HE2  GLN  38          1HE2      GLN  38  -5.216  -7.656  -5.995
  311    H    TRP  39           H        TRP  39  -5.869  -5.349  -0.239
  312    HA   TRP  39           HA       TRP  39  -5.647  -7.795   1.177
  313   1HB   TRP  39          1HB       TRP  39  -3.758  -6.234   0.949
  314   2HB   TRP  39          2HB       TRP  39  -4.617  -5.047   1.923
  315    HD1  TRP  39           HD1      TRP  39  -3.148  -8.621   2.320
  316    HE1  TRP  39           HE1      TRP  39  -2.370  -8.896   4.764
  317    HE3  TRP  39           HE3      TRP  39  -4.730  -4.128   4.185
  318    HZ2  TRP  39           HZ2      TRP  39  -2.421  -7.403   7.153
  319    HZ3  TRP  39           HZ3      TRP  39  -4.327  -3.633   6.562
  320    HH2  TRP  39           HH2      TRP  39  -3.197  -5.237   8.012
  321    H    LEU  40           H        LEU  40  -7.243  -4.725   1.882
  322    HA   LEU  40           HA       LEU  40  -8.081  -5.330   4.493
  323   1HB   LEU  40          1HB       LEU  40  -9.311  -3.554   2.391
  324   2HB   LEU  40          2HB       LEU  40  -9.880  -3.633   4.047
  325    HG   LEU  40           HG       LEU  40  -7.126  -2.748   3.184
  326   1HD1  LEU  40          1HD1      LEU  40  -9.483  -1.181   4.219
  327   2HD1  LEU  40          2HD1      LEU  40  -7.871  -0.534   3.907
  328   3HD1  LEU  40          3HD1      LEU  40  -8.848  -1.146   2.573
  329   1HD2  LEU  40          1HD2      LEU  40  -7.115  -3.827   5.374
  330   2HD2  LEU  40          2HD2      LEU  40  -6.848  -2.089   5.522
  331   3HD2  LEU  40          3HD2      LEU  40  -8.428  -2.775   5.904
  332    H    SER  41           H        SER  41  -9.584  -5.956   1.346
  333    HA   SER  41           HA       SER  41 -11.985  -7.046   2.346
  334   1HB   SER  41          1HB       SER  41 -10.570  -7.660  -0.261
  335   2HB   SER  41          2HB       SER  41 -12.254  -8.032   0.106
  336    HG   SER  41           HG       SER  41 -11.067  -5.450  -0.038
  337    H    SER  42           H        SER  42  -8.800  -8.384   1.861
  338    HA   SER  42           HA       SER  42  -9.524 -11.112   2.117
  339   1HB   SER  42          1HB       SER  42  -7.383 -10.314   1.112
  340   2HB   SER  42          2HB       SER  42  -6.849  -9.824   2.720
  341    HG   SER  42           HG       SER  42  -6.062 -11.801   2.672
  342    H    ILE  43           H        ILE  43  -8.340  -8.689   4.449
  343    HA   ILE  43           HA       ILE  43  -8.391 -10.583   6.612
  344    HB   ILE  43           HB       ILE  43  -7.856  -8.688   8.077
  345   1HG1  ILE  43          1HG1      ILE  43  -7.999  -7.011   5.559
  346   2HG1  ILE  43          2HG1      ILE  43  -9.173  -6.965   6.871
  347   1HG2  ILE  43          1HG2      ILE  43  -6.062  -9.872   6.974
  348   2HG2  ILE  43          2HG2      ILE  43  -6.215  -8.836   5.554
  349   3HG2  ILE  43          3HG2      ILE  43  -5.668  -8.157   7.086
  350   1HD1  ILE  43          1HD1      ILE  43  -7.622  -5.105   7.002
  351   2HD1  ILE  43          2HD1      ILE  43  -7.439  -6.174   8.393
  352   3HD1  ILE  43          3HD1      ILE  43  -6.263  -6.226   7.080
  353    H    GLY  44           H        GLY  44 -10.647  -8.337   5.239
  354   1HA   GLY  44          1HA       GLY  44 -12.988  -9.097   5.788
  355   2HA   GLY  44          2HA       GLY  44 -12.498  -8.928   7.467
  356    H    GLU  45           H        GLU  45 -10.895  -6.487   6.582
  357    HA   GLU  45           HA       GLU  45 -13.020  -4.606   7.137
  358   1HB   GLU  45          1HB       GLU  45 -10.050  -4.161   6.779
  359   2HB   GLU  45          2HB       GLU  45 -11.200  -2.962   7.353
  360   1HG   GLU  45          1HG       GLU  45 -10.394  -5.512   8.720
  361   2HG   GLU  45          2HG       GLU  45 -10.028  -3.862   9.225
  362    H    GLU  46           H        GLU  46 -13.476  -5.681   4.698
  363    HA   GLU  46           HA       GLU  46 -12.364  -4.370   2.484
  364   1HB   GLU  46          1HB       GLU  46 -14.509  -5.051   1.340
  365   2HB   GLU  46          2HB       GLU  46 -13.626  -6.354   2.122
  366   1HG   GLU  46          1HG       GLU  46 -15.146  -6.103   4.084
  367   2HG   GLU  46          2HG       GLU  46 -16.089  -4.960   3.130
  368    H    GLY  47           H        GLY  47 -14.895  -3.442   4.703
  369   1HA   GLY  47          1HA       GLY  47 -15.560  -1.111   3.064
  370   2HA   GLY  47          2HA       GLY  47 -16.477  -1.698   4.443
  371    H    ALA  48           H        ALA  48 -13.014  -1.367   4.613
  372    HA   ALA  48           HA       ALA  48 -13.242   0.518   6.772
  373   1HB   ALA  48          1HB       ALA  48 -10.778  -0.472   5.340
  374   2HB   ALA  48          2HB       ALA  48 -10.811   0.409   6.868
  375   3HB   ALA  48          3HB       ALA  48 -11.501  -1.211   6.769
  376    H    THR  49           H        THR  49 -12.718   2.672   6.776
  377    HA   THR  49           HA       THR  49 -13.168   4.099   4.373
  378    HB   THR  49           HB       THR  49 -11.983   5.232   6.908
  379    HG1  THR  49           HG1      THR  49 -13.800   4.230   7.620
  380   1HG2  THR  49          1HG2      THR  49 -12.023   6.742   4.980
  381   2HG2  THR  49          2HG2      THR  49 -13.747   6.433   4.767
  382   3HG2  THR  49          3HG2      THR  49 -13.172   7.264   6.213
  383    H    VAL  50           H        VAL  50 -11.683   3.973   2.776
  384    HA   VAL  50           HA       VAL  50  -8.988   4.944   3.432
  385    HB   VAL  50           HB       VAL  50  -9.560   2.844   1.330
  386   1HG1  VAL  50          1HG1      VAL  50  -7.117   2.656   1.205
  387   2HG1  VAL  50          2HG1      VAL  50  -7.670   4.279   0.787
  388   3HG1  VAL  50          3HG1      VAL  50  -6.961   3.969   2.373
  389   1HG2  VAL  50          1HG2      VAL  50  -8.264   2.525   4.036
  390   2HG2  VAL  50          2HG2      VAL  50  -9.847   1.908   3.564
  391   3HG2  VAL  50          3HG2      VAL  50  -8.389   1.276   2.797
  392    H    THR  51           H        THR  51  -9.449   7.036   2.777
  393    HA   THR  51           HA       THR  51  -9.972   7.347  -0.106
  394    HB   THR  51           HB       THR  51 -10.528   9.686   0.357
  395    HG1  THR  51           HG1      THR  51 -10.015   8.988   3.093
  396   1HG2  THR  51          1HG2      THR  51 -12.334   8.050   0.479
  397   2HG2  THR  51          2HG2      THR  51 -11.992   7.782   2.187
  398   3HG2  THR  51          3HG2      THR  51 -12.591   9.349   1.644
  399    H    SER  52           H        SER  52  -8.869   9.857  -0.476
  400    HA   SER  52           HA       SER  52  -6.128   9.234  -0.801
  401   1HB   SER  52          1HB       SER  52  -7.453  11.947  -1.015
  402   2HB   SER  52          2HB       SER  52  -5.941  11.441  -1.772
  403    HG   SER  52           HG       SER  52  -7.762  11.365  -3.206
  404    H    GLU  53           H        GLU  53  -7.833  10.350   1.890
  405    HA   GLU  53           HA       GLU  53  -5.605  11.780   3.064
  406   1HB   GLU  53          1HB       GLU  53  -8.360  11.057   4.038
  407   2HB   GLU  53          2HB       GLU  53  -7.161  11.815   5.070
  408   1HG   GLU  53          1HG       GLU  53  -7.055  13.721   3.549
  409   2HG   GLU  53          2HG       GLU  53  -8.269  12.957   2.524
  410    H    GLU  54           H        GLU  54  -7.113   8.633   3.202
  411    HA   GLU  54           HA       GLU  54  -5.655   7.814   5.550
  412   1HB   GLU  54          1HB       GLU  54  -7.469   6.361   3.635
  413   2HB   GLU  54          2HB       GLU  54  -6.590   5.519   4.901
  414   1HG   GLU  54          1HG       GLU  54  -8.811   5.944   5.660
  415   2HG   GLU  54          2HG       GLU  54  -7.701   6.961   6.574
  416    H    CYS  55           H        CYS  55  -5.574   7.061   2.085
  417    HA   CYS  55           HA       CYS  55  -2.949   5.825   2.487
  418   1HB   CYS  55          1HB       CYS  55  -4.813   4.647   1.178
  419   2HB   CYS  55          2HB       CYS  55  -4.539   5.847  -0.079
  420    HG   CYS  55           HG       CYS  55  -2.391   3.421   0.999
  421    H    ARG  56           H        ARG  56  -1.682   7.640   2.728
  422    HA   ARG  56           HA       ARG  56  -1.766   9.607   0.554
  423   1HB   ARG  56          1HB       ARG  56  -1.061   9.809   3.448
  424   2HB   ARG  56          2HB       ARG  56  -0.325  10.932   2.308
  425   1HG   ARG  56          1HG       ARG  56  -2.547  11.632   1.564
  426   2HG   ARG  56          2HG       ARG  56  -3.279  10.516   2.717
  427   1HD   ARG  56          1HD       ARG  56  -1.356  12.634   3.605
  428   2HD   ARG  56          2HD       ARG  56  -3.065  12.992   3.373
  429    HE   ARG  56           HE       ARG  56  -3.428  11.085   5.013
  430   1HH1  ARG  56          1HH1      ARG  56  -0.540  13.066   5.036
  431   2HH1  ARG  56          2HH1      ARG  56  -0.320  12.957   6.758
  432   1HH2  ARG  56          1HH2      ARG  56  -3.174  10.964   7.283
  433   2HH2  ARG  56          2HH2      ARG  56  -1.829  11.770   8.040
  434    H    PHE  57           H        PHE  57   0.191  10.480  -0.242
  435    HA   PHE  57           HA       PHE  57   2.144   8.419  -0.699
  436   1HB   PHE  57          1HB       PHE  57   1.388   9.858  -2.536
  437   2HB   PHE  57          2HB       PHE  57   1.999  11.276  -1.693
  438    HD1  PHE  57           HD1      PHE  57   4.025  12.100  -2.360
  439    HD2  PHE  57           HD2      PHE  57   3.229   7.952  -2.866
  440    HE1  PHE  57           HE1      PHE  57   6.204  11.821  -3.468
  441    HE2  PHE  57           HE2      PHE  57   5.405   7.666  -3.976
  442    HZ   PHE  57           HZ       PHE  57   6.894   9.601  -4.278
  443    H    CYS  58           H        CYS  58   3.542   8.046   0.895
  444    HA   CYS  58           HA       CYS  58   4.505  10.099   2.639
  445   1HB   CYS  58          1HB       CYS  58   4.227   7.743   3.361
  446   2HB   CYS  58          2HB       CYS  58   5.502   7.264   2.246
  447    HG   CYS  58           HG       CYS  58   6.007   7.649   5.248
  448    H    HIS  59           H        HIS  59   6.153   7.986   0.275
  449    HA   HIS  59           HA       HIS  59   7.535  10.028  -1.044
  450   1HB   HIS  59          1HB       HIS  59   9.838   9.659  -0.222
  451   2HB   HIS  59          2HB       HIS  59   8.797  10.337   1.018
  452    HD1  HIS  59           HD1      HIS  59   8.795   9.155   3.219
  453    HD2  HIS  59           HD2      HIS  59  10.261   6.763   0.142
  454    HE1  HIS  59           HE1      HIS  59   9.608   7.037   4.321
  455    HE2  HIS  59           HE2      HIS  59  10.494   5.600   2.439
  456    H    SER  60           H        SER  60   9.556   9.049  -2.198
  457    HA   SER  60           HA       SER  60   9.041   6.213  -2.828
  458   1HB   SER  60          1HB       SER  60  10.236   8.313  -4.660
  459   2HB   SER  60          2HB       SER  60   9.893   6.636  -5.079
  460    HG   SER  60           HG       SER  60   8.309   8.529  -5.539
  461    H    GLU  61           H        GLU  61  10.723   4.828  -2.587
  462    HA   GLU  61           HA       GLU  61  13.412   5.962  -2.290
  463   1HB   GLU  61          1HB       GLU  61  13.847   4.400  -0.401
  464   2HB   GLU  61          2HB       GLU  61  12.663   5.643  -0.031
  465   1HG   GLU  61          1HG       GLU  61  10.864   4.006  -0.421
  466   2HG   GLU  61          2HG       GLU  61  12.087   2.766  -0.698
  467    H    LYS  62           H        LYS  62  14.911   3.766  -1.930
  468    HA   LYS  62           HA       LYS  62  14.736   2.566  -4.536
  469   1HB   LYS  62          1HB       LYS  62  16.711   2.166  -2.287
  470   2HB   LYS  62          2HB       LYS  62  16.858   1.439  -3.883
  471   1HG   LYS  62          1HG       LYS  62  16.959   3.656  -4.890
  472   2HG   LYS  62          2HG       LYS  62  16.804   4.390  -3.294
  473   1HD   LYS  62          1HD       LYS  62  18.906   3.344  -2.612
  474   2HD   LYS  62          2HD       LYS  62  19.057   2.604  -4.208
  475   1HE   LYS  62          1HE       LYS  62  20.430   4.591  -4.101
  476   2HE   LYS  62          2HE       LYS  62  19.092   4.855  -5.218
  477   1HZ   LYS  62          1HZ       LYS  62  19.401   5.907  -2.462
  478   2HZ   LYS  62          2HZ       LYS  62  19.266   6.788  -3.905
  479   3HZ   LYS  62          3HZ       LYS  62  17.923   5.952  -3.291
  480    H    ALA  63           H        ALA  63  14.209   0.542  -5.071
  481    HA   ALA  63           HA       ALA  63  12.545  -0.847  -3.156
  482   1HB   ALA  63          1HB       ALA  63  11.827  -0.364  -5.487
  483   2HB   ALA  63          2HB       ALA  63  13.037  -1.513  -6.049
  484   3HB   ALA  63          3HB       ALA  63  11.703  -2.064  -5.034
  485    HA   PRO  64           HA       PRO  64  15.693  -4.010  -2.378
  486   1HB   PRO  64          1HB       PRO  64  13.541  -5.097  -0.694
  487   2HB   PRO  64          2HB       PRO  64  15.184  -4.631  -0.245
  488   1HG   PRO  64          1HG       PRO  64  13.040  -3.198   0.523
  489   2HG   PRO  64          2HG       PRO  64  14.597  -2.436   0.150
  490   1HD   PRO  64          1HD       PRO  64  12.123  -2.618  -1.531
  491   2HD   PRO  64          2HD       PRO  64  13.237  -1.251  -1.308
  492    H    ASP  65           H        ASP  65  15.793  -6.168  -3.074
  493    HA   ASP  65           HA       ASP  65  14.122  -6.808  -5.241
  494   1HB   ASP  65          1HB       ASP  65  16.205  -8.372  -3.735
  495   2HB   ASP  65          2HB       ASP  65  15.336  -9.046  -5.107
  496    H    GLU  66           H        GLU  66  13.621  -7.245  -1.947
  497    HA   GLU  66           HA       GLU  66  12.120  -9.639  -1.945
  498   1HB   GLU  66          1HB       GLU  66  11.819  -7.268  -0.094
  499   2HB   GLU  66          2HB       GLU  66  11.298  -8.916   0.220
  500   1HG   GLU  66          1HG       GLU  66  14.137  -7.959  -0.062
  501   2HG   GLU  66          2HG       GLU  66  13.324  -8.422   1.432
  502    H    VAL  67           H        VAL  67  11.301  -6.277  -2.620
  503    HA   VAL  67           HA       VAL  67   8.456  -6.951  -2.639
  504    HB   VAL  67           HB       VAL  67   8.002  -4.575  -2.745
  505   1HG1  VAL  67          1HG1      VAL  67   8.358  -5.553  -0.553
  506   2HG1  VAL  67          2HG1      VAL  67  10.089  -5.231  -0.671
  507   3HG1  VAL  67          3HG1      VAL  67   8.945  -3.891  -0.590
  508   1HG2  VAL  67          1HG2      VAL  67   9.810  -2.916  -2.658
  509   2HG2  VAL  67          2HG2      VAL  67  10.995  -4.207  -2.860
  510   3HG2  VAL  67          3HG2      VAL  67   9.847  -3.851  -4.152
  511    H    ILE  68           H        ILE  68  10.989  -6.755  -4.837
  512    HA   ILE  68           HA       ILE  68   9.805  -5.492  -7.045
  513    HB   ILE  68           HB       ILE  68  11.802  -7.763  -7.102
  514   1HG1  ILE  68          1HG1      ILE  68  12.571  -5.841  -5.751
  515   2HG1  ILE  68          2HG1      ILE  68  13.517  -6.029  -7.223
  516   1HG2  ILE  68          1HG2      ILE  68  11.119  -5.692  -9.187
  517   2HG2  ILE  68          2HG2      ILE  68  12.417  -6.879  -9.305
  518   3HG2  ILE  68          3HG2      ILE  68  10.736  -7.411  -9.260
  519   1HD1  ILE  68          1HD1      ILE  68  11.330  -4.019  -6.749
  520   2HD1  ILE  68          2HD1      ILE  68  13.064  -3.700  -6.802
  521   3HD1  ILE  68          3HD1      ILE  68  12.217  -4.221  -8.259
  522    H    GLU  69           H        GLU  69  10.078  -8.991  -6.394
  523    HA   GLU  69           HA       GLU  69   8.418  -9.954  -8.381
  524   1HB   GLU  69          1HB       GLU  69   9.439 -10.922  -5.822
  525   2HB   GLU  69          2HB       GLU  69   7.873 -11.606  -6.224
  526   1HG   GLU  69          1HG       GLU  69  10.205 -11.639  -8.117
  527   2HG   GLU  69          2HG       GLU  69   9.887 -12.923  -6.952
  528    H    ALA  70           H        ALA  70   7.536  -8.736  -5.179
  529    HA   ALA  70           HA       ALA  70   4.848  -9.548  -5.215
  530   1HB   ALA  70          1HB       ALA  70   4.537  -8.001  -3.366
  531   2HB   ALA  70          2HB       ALA  70   6.030  -8.919  -3.174
  532   3HB   ALA  70          3HB       ALA  70   6.090  -7.244  -3.724
  533    H    ILE  71           H        ILE  71   6.302  -6.388  -5.995
  534    HA   ILE  71           HA       ILE  71   3.804  -5.173  -6.648
  535    HB   ILE  71           HB       ILE  71   6.587  -4.286  -7.428
  536   1HG1  ILE  71          1HG1      ILE  71   4.903  -3.485  -5.045
  537   2HG1  ILE  71          2HG1      ILE  71   6.263  -4.601  -4.981
  538   1HG2  ILE  71          1HG2      ILE  71   5.588  -2.056  -7.615
  539   2HG2  ILE  71          2HG2      ILE  71   4.840  -3.193  -8.737
  540   3HG2  ILE  71          3HG2      ILE  71   4.001  -2.737  -7.254
  541   1HD1  ILE  71          1HD1      ILE  71   6.886  -2.382  -4.224
  542   2HD1  ILE  71          2HD1      ILE  71   7.762  -2.823  -5.690
  543   3HD1  ILE  71          3HD1      ILE  71   6.400  -1.706  -5.778
  544    H    LYS  72           H        LYS  72   6.256  -6.866  -8.474
  545    HA   LYS  72           HA       LYS  72   5.315  -6.106 -11.053
  546   1HB   LYS  72          1HB       LYS  72   7.608  -6.863 -10.643
  547   2HB   LYS  72          2HB       LYS  72   7.006  -8.441 -10.167
  548   1HG   LYS  72          1HG       LYS  72   6.082  -8.687 -12.481
  549   2HG   LYS  72          2HG       LYS  72   6.944  -7.204 -12.902
  550   1HD   LYS  72          1HD       LYS  72   8.273  -9.146 -13.510
  551   2HD   LYS  72          2HD       LYS  72   9.058  -8.255 -12.202
  552   1HE   LYS  72          1HE       LYS  72   8.104  -9.839 -10.580
  553   2HE   LYS  72          2HE       LYS  72   7.377 -10.742 -11.907
  554   1HZ   LYS  72          1HZ       LYS  72   9.643 -11.113 -12.771
  555   2HZ   LYS  72          2HZ       LYS  72  10.273 -10.365 -11.381
  556   3HZ   LYS  72          3HZ       LYS  72   9.386 -11.803 -11.241
  557    H    GLN  73           H        GLN  73   4.754  -8.842  -8.917
  558    HA   GLN  73           HA       GLN  73   3.161 -10.242 -10.888
  559   1HB   GLN  73          1HB       GLN  73   4.664 -11.482  -9.412
  560   2HB   GLN  73          2HB       GLN  73   3.790 -10.895  -8.005
  561   1HG   GLN  73          1HG       GLN  73   1.785 -12.085  -8.780
  562   2HG   GLN  73          2HG       GLN  73   2.709 -12.710 -10.147
  563   1HE2  GLN  73          2HE2      GLN  73   4.304 -14.252  -9.791
  564   2HE2  GLN  73          1HE2      GLN  73   4.403 -15.146  -8.313
  565    H    ASN  74           H        ASN  74   2.557  -9.073  -7.563
  566    HA   ASN  74           HA       ASN  74  -0.303  -9.392  -8.016
  567   1HB   ASN  74          1HB       ASN  74   1.296  -8.725  -5.540
  568   2HB   ASN  74          2HB       ASN  74  -0.464  -8.757  -5.574
  569   1HD2  ASN  74          2HD2      ASN  74   2.437 -10.644  -5.639
  570   2HD2  ASN  74          1HD2      ASN  74   1.683 -12.188  -5.446
  571    H    GLY  75           H        GLY  75   2.085  -6.887  -7.716
  572   1HA   GLY  75          1HA       GLY  75   1.723  -4.745  -8.692
  573   2HA   GLY  75          2HA       GLY  75   0.002  -4.931  -8.389
  574    H    TYR  76           H        TYR  76   1.327  -6.006  -5.649
  575    HA   TYR  76           HA       TYR  76   1.876  -3.472  -4.386
  576   1HB   TYR  76          1HB       TYR  76  -0.018  -3.636  -2.795
  577   2HB   TYR  76          2HB       TYR  76  -0.559  -3.394  -4.452
  578    HD1  TYR  76           HD1      TYR  76  -0.460  -5.721  -1.632
  579    HD2  TYR  76           HD2      TYR  76  -1.712  -5.183  -5.658
  580    HE1  TYR  76           HE1      TYR  76  -1.908  -7.695  -1.436
  581    HE2  TYR  76           HE2      TYR  76  -3.165  -7.158  -5.474
  582    HH   TYR  76           HH       TYR  76  -3.871  -8.650  -2.479
  583    H    PHE  77           H        PHE  77   2.705  -3.680  -2.293
  584    HA   PHE  77           HA       PHE  77   2.797  -6.363  -1.126
  585   1HB   PHE  77          1HB       PHE  77   4.965  -6.016  -2.255
  586   2HB   PHE  77          2HB       PHE  77   5.192  -4.518  -1.358
  587    HD1  PHE  77           HD1      PHE  77   6.028  -4.530   0.857
  588    HD2  PHE  77           HD2      PHE  77   4.956  -8.189  -1.037
  589    HE1  PHE  77           HE1      PHE  77   7.108  -5.786   2.676
  590    HE2  PHE  77           HE2      PHE  77   6.033  -9.449   0.780
  591    HZ   PHE  77           HZ       PHE  77   7.111  -8.249   2.638
  592    H    ILE  78           H        ILE  78   1.744  -6.147   0.739
  593    HA   ILE  78           HA       ILE  78   1.784  -3.589   2.129
  594    HB   ILE  78           HB       ILE  78   0.095  -6.058   2.422
  595   1HG1  ILE  78          1HG1      ILE  78  -1.743  -4.365   2.309
  596   2HG1  ILE  78          2HG1      ILE  78  -0.525  -3.118   2.082
  597   1HG2  ILE  78          1HG2      ILE  78   0.753  -5.508   4.694
  598   2HG2  ILE  78          2HG2      ILE  78   0.275  -3.829   4.445
  599   3HG2  ILE  78          3HG2      ILE  78  -0.944  -5.105   4.431
  600   1HD1  ILE  78          1HD1      ILE  78   0.159  -4.160  -0.006
  601   2HD1  ILE  78          2HD1      ILE  78  -1.052  -5.421   0.224
  602   3HD1  ILE  78          3HD1      ILE  78  -1.556  -3.748  -0.017
  603    H    TYR  79           H        TYR  79   3.430  -3.234   3.421
  604    HA   TYR  79           HA       TYR  79   4.516  -5.433   5.015
  605   1HB   TYR  79          1HB       TYR  79   6.167  -4.003   3.928
  606   2HB   TYR  79          2HB       TYR  79   5.454  -2.574   4.669
  607    HD1  TYR  79           HD1      TYR  79   6.335  -1.766   6.652
  608    HD2  TYR  79           HD2      TYR  79   7.038  -5.826   5.591
  609    HE1  TYR  79           HE1      TYR  79   7.835  -2.005   8.585
  610    HE2  TYR  79           HE2      TYR  79   8.538  -6.078   7.523
  611    HH   TYR  79           HH       TYR  79   8.704  -3.777  10.029
  612    H    LYS  80           H        LYS  80   3.651  -5.811   6.915
  613    HA   LYS  80           HA       LYS  80   1.895  -3.957   8.202
  614   1HB   LYS  80          1HB       LYS  80   3.114  -6.490   9.321
  615   2HB   LYS  80          2HB       LYS  80   1.692  -5.654   9.930
  616   1HG   LYS  80          1HG       LYS  80   0.417  -6.245   8.014
  617   2HG   LYS  80          2HG       LYS  80   1.849  -6.831   7.165
  618   1HD   LYS  80          1HD       LYS  80   0.654  -8.735   7.965
  619   2HD   LYS  80          2HD       LYS  80   2.103  -8.561   8.953
  620   1HE   LYS  80          1HE       LYS  80   0.503  -7.174  10.499
  621   2HE   LYS  80          2HE       LYS  80  -0.754  -8.082   9.657
  622   1HZ   LYS  80          1HZ       LYS  80   1.522  -9.233  11.187
  623   2HZ   LYS  80          2HZ       LYS  80  -0.110  -9.227  11.664
  624   3HZ   LYS  80          3HZ       LYS  80   0.383 -10.139  10.321
  625    H    MET  81           H        MET  81   3.279  -2.134   8.429
  626    HA   MET  81           HA       MET  81   5.755  -2.106   9.713
  627   1HB   MET  81          1HB       MET  81   4.844  -0.239   8.365
  628   2HB   MET  81          2HB       MET  81   3.694   0.104   9.651
  629   1HG   MET  81          1HG       MET  81   5.835   0.284  11.126
  630   2HG   MET  81          2HG       MET  81   6.640   0.536   9.579
  631   1HE   MET  81          1HE       MET  81   4.660   3.693   8.244
  632   2HE   MET  81          2HE       MET  81   4.228   2.002   7.989
  633   3HE   MET  81          3HE       MET  81   5.913   2.511   7.869
  634    H    GLU  82           H        GLU  82   2.886  -0.602  11.139
  635    HA   GLU  82           HA       GLU  82   3.389  -1.960  13.674
  636   1HB   GLU  82          1HB       GLU  82   4.721   0.193  13.584
  637   2HB   GLU  82          2HB       GLU  82   3.190   1.051  13.510
  638   1HG   GLU  82          1HG       GLU  82   4.061   1.046  15.761
  639   2HG   GLU  82          2HG       GLU  82   2.563   0.117  15.678
  640    H    GLY  83           H        GLY  83   1.304  -0.826  11.358
  641   1HA   GLY  83          1HA       GLY  83  -0.879   0.114  12.877
  642   2HA   GLY  83          2HA       GLY  83  -0.953  -0.480  11.225
  643    H    CYS  84           H        CYS  84   0.109  -3.115  11.951
  644    HA   CYS  84           HA       CYS  84  -2.336  -4.154  13.202
  645   1HB   CYS  84          1HB       CYS  84  -0.413  -5.709  11.467
  646   2HB   CYS  84          2HB       CYS  84  -2.041  -6.173  11.955
  647    HG   CYS  84           HG       CYS  84  -3.139  -3.911  10.484
  648    H    ASN  85           H        ASN  85   0.415  -6.180  12.747
  649    HA   ASN  85           HA       ASN  85   1.294  -5.880  15.515
  650   1HB   ASN  85          1HB       ASN  85   0.362  -8.458  14.238
  651   2HB   ASN  85          2HB       ASN  85   1.415  -8.431  15.645
  652   1HD2  ASN  85          2HD2      ASN  85   0.220  -6.211  16.958
  653   2HD2  ASN  85          1HD2      ASN  85  -1.341  -6.722  17.503
  Start of MODEL    8
    1    H    MET   1           H        MET   1  14.592  -0.098 -10.705
    2    HA   MET   1           HA       MET   1  12.332   0.519 -10.174
    3   1HB   MET   1          1HB       MET   1  13.419  -1.789  -9.630
    4   2HB   MET   1          2HB       MET   1  13.290  -1.274  -7.955
    5   1HG   MET   1          1HG       MET   1  10.984  -1.485  -9.875
    6   2HG   MET   1          2HG       MET   1  11.430  -2.710  -8.693
    7   1HE   MET   1          1HE       MET   1   8.957  -2.693  -7.731
    8   2HE   MET   1          2HE       MET   1   8.507  -1.478  -8.927
    9   3HE   MET   1          3HE       MET   1   8.114  -1.228  -7.226
   10    H    GLN   2           H        GLN   2  11.271   2.100  -9.208
   11    HA   GLN   2           HA       GLN   2  12.162   3.002  -6.552
   12   1HB   GLN   2          1HB       GLN   2  10.894   4.536  -8.824
   13   2HB   GLN   2          2HB       GLN   2  11.070   5.186  -7.200
   14   1HG   GLN   2          1HG       GLN   2  13.405   4.171  -8.783
   15   2HG   GLN   2          2HG       GLN   2  12.830   5.834  -8.900
   16   1HE2  GLN   2          2HE2      GLN   2  15.370   4.709  -7.897
   17   2HE2  GLN   2          1HE2      GLN   2  15.542   5.318  -6.283
   18    H    ILE   3           H        ILE   3  10.844   2.286  -5.035
   19    HA   ILE   3           HA       ILE   3   8.094   1.627  -5.641
   20    HB   ILE   3           HB       ILE   3   8.049   1.140  -3.101
   21   1HG1  ILE   3          1HG1      ILE   3  11.037   1.225  -3.579
   22   2HG1  ILE   3          2HG1      ILE   3  10.131   2.344  -2.568
   23   1HG2  ILE   3          1HG2      ILE   3   9.163  -1.066  -3.516
   24   2HG2  ILE   3          2HG2      ILE   3   7.921  -0.605  -4.682
   25   3HG2  ILE   3          3HG2      ILE   3   9.625  -0.445  -5.101
   26   1HD1  ILE   3          1HD1      ILE   3  10.439  -0.611  -2.094
   27   2HD1  ILE   3          2HD1      ILE   3  11.273   0.681  -1.229
   28   3HD1  ILE   3          3HD1      ILE   3   9.524   0.507  -1.081
   29    H    HIS   4           H        HIS   4   6.418   2.857  -5.328
   30    HA   HIS   4           HA       HIS   4   6.720   5.385  -3.912
   31   1HB   HIS   4          1HB       HIS   4   4.321   4.280  -5.401
   32   2HB   HIS   4          2HB       HIS   4   4.498   5.920  -4.787
   33    HD1  HIS   4           HD1      HIS   4   6.796   7.150  -5.878
   34    HD2  HIS   4           HD2      HIS   4   4.943   4.097  -8.014
   35    HE1  HIS   4           HE1      HIS   4   7.544   7.435  -8.262
   36    HE2  HIS   4           HE2      HIS   4   6.564   5.469  -9.500
   37    H    VAL   5           H        VAL   5   6.532   5.258  -1.805
   38    HA   VAL   5           HA       VAL   5   5.056   3.078  -0.580
   39    HB   VAL   5           HB       VAL   5   6.620   5.281   0.777
   40   1HG1  VAL   5          1HG1      VAL   5   5.733   2.567   1.745
   41   2HG1  VAL   5          2HG1      VAL   5   6.735   3.701   2.649
   42   3HG1  VAL   5          3HG1      VAL   5   5.070   4.121   2.246
   43   1HG2  VAL   5          1HG2      VAL   5   8.477   3.691   0.907
   44   2HG2  VAL   5          2HG2      VAL   5   7.560   2.541  -0.066
   45   3HG2  VAL   5          3HG2      VAL   5   8.072   4.078  -0.766
   46    H    TYR   6           H        TYR   6   2.951   3.347  -0.312
   47    HA   TYR   6           HA       TYR   6   1.913   6.016   0.215
   48   1HB   TYR   6          1HB       TYR   6   0.638   3.419  -0.576
   49   2HB   TYR   6          2HB       TYR   6  -0.335   4.729   0.091
   50    HD1  TYR   6           HD1      TYR   6  -0.712   6.756  -1.153
   51    HD2  TYR   6           HD2      TYR   6   1.740   3.672  -2.753
   52    HE1  TYR   6           HE1      TYR   6  -0.803   7.841  -3.356
   53    HE2  TYR   6           HE2      TYR   6   1.657   4.747  -4.964
   54    HH   TYR   6           HH       TYR   6   0.319   7.922  -5.409
   55    H    ASP   7           H        ASP   7   1.811   6.697   2.154
   56    HA   ASP   7           HA       ASP   7   2.014   5.019   4.463
   57   1HB   ASP   7          1HB       ASP   7   3.066   7.248   4.359
   58   2HB   ASP   7          2HB       ASP   7   1.482   7.992   4.189
   59    H    THR   8           H        THR   8   0.208   3.760   4.753
   60    HA   THR   8           HA       THR   8  -2.388   5.100   4.459
   61    HB   THR   8           HB       THR   8  -1.859   2.130   4.377
   62    HG1  THR   8           HG1      THR   8  -0.834   3.423   2.655
   63   1HG2  THR   8          1HG2      THR   8  -4.219   3.797   3.489
   64   2HG2  THR   8          2HG2      THR   8  -4.059   2.053   3.286
   65   3HG2  THR   8          3HG2      THR   8  -4.168   2.746   4.904
   66    H    TYR   9           H        TYR   9  -3.481   5.543   6.210
   67    HA   TYR   9           HA       TYR   9  -3.183   3.845   8.595
   68   1HB   TYR   9          1HB       TYR   9  -4.235   6.652   8.221
   69   2HB   TYR   9          2HB       TYR   9  -4.524   5.735   9.693
   70    HD1  TYR   9           HD1      TYR   9  -2.645   5.166  11.183
   71    HD2  TYR   9           HD2      TYR   9  -2.093   7.628   7.759
   72    HE1  TYR   9           HE1      TYR   9  -0.501   5.947  12.097
   73    HE2  TYR   9           HE2      TYR   9   0.054   8.411   8.664
   74    HH   TYR   9           HH       TYR   9   1.171   8.627  10.807
   75    H    VAL  10           H        VAL  10  -4.667   2.294   8.760
   76    HA   VAL  10           HA       VAL  10  -7.309   2.770   7.546
   77    HB   VAL  10           HB       VAL  10  -5.904   0.171   8.192
   78   1HG1  VAL  10          1HG1      VAL  10  -7.850  -0.944   7.187
   79   2HG1  VAL  10          2HG1      VAL  10  -8.280  -0.068   8.656
   80   3HG1  VAL  10          3HG1      VAL  10  -8.673   0.610   7.075
   81   1HG2  VAL  10          1HG2      VAL  10  -6.760   1.396   5.573
   82   2HG2  VAL  10          2HG2      VAL  10  -5.106   1.281   6.174
   83   3HG2  VAL  10          3HG2      VAL  10  -6.003  -0.183   5.771
   84    H    LYS  11           H        LYS  11  -8.773   3.382   8.944
   85    HA   LYS  11           HA       LYS  11  -8.418   2.902  11.767
   86   1HB   LYS  11          1HB       LYS  11 -10.630   4.364  10.307
   87   2HB   LYS  11          2HB       LYS  11 -10.422   4.318  12.050
   88   1HG   LYS  11          1HG       LYS  11  -9.570   6.390  11.401
   89   2HG   LYS  11          2HG       LYS  11  -8.143   5.382  11.643
   90   1HD   LYS  11          1HD       LYS  11  -7.990   5.007   9.235
   91   2HD   LYS  11          2HD       LYS  11  -9.445   5.973   8.984
   92   1HE   LYS  11          1HE       LYS  11  -6.863   6.980  10.176
   93   2HE   LYS  11          2HE       LYS  11  -7.381   7.228   8.508
   94   1HZ   LYS  11          1HZ       LYS  11  -7.922   9.167   9.728
   95   2HZ   LYS  11          2HZ       LYS  11  -9.380   8.364   9.427
   96   3HZ   LYS  11          3HZ       LYS  11  -8.667   8.283  10.968
   97    H    ALA  12           H        ALA  12  -8.639   0.603  11.686
   98    HA   ALA  12           HA       ALA  12 -11.229  -0.507  11.039
   99   1HB   ALA  12          1HB       ALA  12 -10.246  -2.637  11.743
  100   2HB   ALA  12          2HB       ALA  12  -9.208  -1.802  10.586
  101   3HB   ALA  12          3HB       ALA  12  -8.806  -1.788  12.303
  102    H    LYS  13           H        LYS  13 -12.861  -0.783  12.431
  103    HA   LYS  13           HA       LYS  13 -12.781   0.521  14.928
  104   1HB   LYS  13          1HB       LYS  13 -15.059  -0.376  15.262
  105   2HB   LYS  13          2HB       LYS  13 -14.848   0.376  13.689
  106   1HG   LYS  13          1HG       LYS  13 -14.678  -1.791  12.633
  107   2HG   LYS  13          2HG       LYS  13 -14.762  -2.590  14.204
  108   1HD   LYS  13          1HD       LYS  13 -16.934  -0.839  13.054
  109   2HD   LYS  13          2HD       LYS  13 -16.918  -2.601  12.968
  110   1HE   LYS  13          1HE       LYS  13 -16.844  -1.018  15.533
  111   2HE   LYS  13          2HE       LYS  13 -18.313  -1.681  14.818
  112   1HZ   LYS  13          1HZ       LYS  13 -17.522  -3.876  15.133
  113   2HZ   LYS  13          2HZ       LYS  13 -15.968  -3.351  15.549
  114   3HZ   LYS  13          3HZ       LYS  13 -17.267  -3.065  16.599
  115    H    ASP  14           H        ASP  14 -12.316  -2.829  14.031
  116    HA   ASP  14           HA       ASP  14 -12.052  -3.488  16.897
  117   1HB   ASP  14          1HB       ASP  14 -12.592  -5.398  14.616
  118   2HB   ASP  14          2HB       ASP  14 -12.538  -5.802  16.329
  119    H    GLY  15           H        GLY  15 -10.473  -3.269  13.877
  120   1HA   GLY  15          1HA       GLY  15  -8.322  -5.070  14.696
  121   2HA   GLY  15          2HA       GLY  15  -8.546  -4.388  13.093
  122    H    HIS  16           H        HIS  16  -8.948  -1.985  15.407
  123    HA   HIS  16           HA       HIS  16  -7.648  -0.312  16.262
  124   1HB   HIS  16          1HB       HIS  16  -6.201  -2.154  17.092
  125   2HB   HIS  16          2HB       HIS  16  -5.326  -2.140  15.572
  126    HD1  HIS  16           HD1      HIS  16  -5.386  -0.660  18.906
  127    HD2  HIS  16           HD2      HIS  16  -3.692   0.240  15.216
  128    HE1  HIS  16           HE1      HIS  16  -3.548   0.987  19.387
  129    HE2  HIS  16           HE2      HIS  16  -2.413   1.360  17.166
  130    H    VAL  17           H        VAL  17  -6.396   1.531  15.468
  131    HA   VAL  17           HA       VAL  17  -6.602   1.956  12.672
  132    HB   VAL  17           HB       VAL  17  -4.953   3.512  14.682
  133   1HG1  VAL  17          1HG1      VAL  17  -5.067   5.336  13.047
  134   2HG1  VAL  17          2HG1      VAL  17  -4.234   3.928  12.388
  135   3HG1  VAL  17          3HG1      VAL  17  -5.899   4.270  11.916
  136   1HG2  VAL  17          1HG2      VAL  17  -6.858   5.065  14.711
  137   2HG2  VAL  17          2HG2      VAL  17  -7.758   3.971  13.661
  138   3HG2  VAL  17          3HG2      VAL  17  -7.309   3.462  15.289
  139    H    MET  18           H        MET  18  -5.490   0.664  11.363
  140    HA   MET  18           HA       MET  18  -2.876  -0.317  12.111
  141   1HB   MET  18          1HB       MET  18  -4.597  -0.860   9.688
  142   2HB   MET  18          2HB       MET  18  -3.057  -1.643  10.011
  143   1HG   MET  18          1HG       MET  18  -3.983  -2.573  12.085
  144   2HG   MET  18          2HG       MET  18  -5.535  -1.825  11.711
  145   1HE   MET  18          1HE       MET  18  -7.051  -2.519   9.643
  146   2HE   MET  18          2HE       MET  18  -6.576  -3.723   8.446
  147   3HE   MET  18          3HE       MET  18  -5.697  -2.198   8.561
  148    H    HIS  19           H        HIS  19  -1.016   0.478  11.487
  149    HA   HIS  19           HA       HIS  19  -0.941   2.262   9.142
  150   1HB   HIS  19          1HB       HIS  19  -0.305   3.305  11.331
  151   2HB   HIS  19          2HB       HIS  19   1.004   2.138  11.463
  152    HD1  HIS  19           HD1      HIS  19   2.870   3.884  11.394
  153    HD2  HIS  19           HD2      HIS  19   0.338   4.032   8.089
  154    HE1  HIS  19           HE1      HIS  19   3.967   5.443   9.758
  155    HE2  HIS  19           HE2      HIS  19   2.366   5.627   7.826
  156    H    PHE  20           H        PHE  20   0.238   1.589   7.439
  157    HA   PHE  20           HA       PHE  20   2.337  -0.358   7.742
  158   1HB   PHE  20          1HB       PHE  20   1.280  -1.968   6.140
  159   2HB   PHE  20          2HB       PHE  20   0.504  -1.894   7.715
  160    HD1  PHE  20           HD1      PHE  20   0.157  -1.195   4.149
  161    HD2  PHE  20           HD2      PHE  20  -1.718  -0.965   7.963
  162    HE1  PHE  20           HE1      PHE  20  -2.014  -0.821   3.058
  163    HE2  PHE  20           HE2      PHE  20  -3.891  -0.587   6.876
  164    HZ   PHE  20           HZ       PHE  20  -4.041  -0.517   4.420
  165    H    ASP  21           H        ASP  21   3.417  -0.825   5.687
  166    HA   ASP  21           HA       ASP  21   3.450   1.597   4.042
  167   1HB   ASP  21          1HB       ASP  21   5.409  -0.704   4.255
  168   2HB   ASP  21          2HB       ASP  21   5.598   0.655   3.158
  169    H    VAL  22           H        VAL  22   2.311   1.568   2.223
  170    HA   VAL  22           HA       VAL  22   1.874  -0.958   0.816
  171    HB   VAL  22           HB       VAL  22   0.797   1.796   0.173
  172   1HG1  VAL  22          1HG1      VAL  22  -0.758   0.628  -1.308
  173   2HG1  VAL  22          2HG1      VAL  22   0.914   0.340  -1.785
  174   3HG1  VAL  22          3HG1      VAL  22   0.018  -0.908  -0.917
  175   1HG2  VAL  22          1HG2      VAL  22  -1.323   0.981   1.081
  176   2HG2  VAL  22          2HG2      VAL  22  -0.542  -0.533   1.541
  177   3HG2  VAL  22          3HG2      VAL  22  -0.053   0.980   2.305
  178    H    PHE  23           H        PHE  23   3.656  -1.509  -0.303
  179    HA   PHE  23           HA       PHE  23   5.145   0.544  -1.750
  180   1HB   PHE  23          1HB       PHE  23   5.690  -2.416  -1.454
  181   2HB   PHE  23          2HB       PHE  23   6.759  -1.254  -2.223
  182    HD1  PHE  23           HD1      PHE  23   6.029  -2.970   0.736
  183    HD2  PHE  23           HD2      PHE  23   7.488   0.757  -0.697
  184    HE1  PHE  23           HE1      PHE  23   7.139  -2.582   2.896
  185    HE2  PHE  23           HE2      PHE  23   8.600   1.155   1.461
  186    HZ   PHE  23           HZ       PHE  23   8.430  -0.518   3.259
  187    H    THR  24           H        THR  24   4.422   1.065  -3.723
  188    HA   THR  24           HA       THR  24   3.985  -1.146  -5.583
  189    HB   THR  24           HB       THR  24   1.728  -0.480  -4.879
  190    HG1  THR  24           HG1      THR  24   1.695  -1.149  -6.949
  191   1HG2  THR  24          1HG2      THR  24   2.162   1.840  -4.267
  192   2HG2  THR  24          2HG2      THR  24   2.473   2.241  -5.956
  193   3HG2  THR  24          3HG2      THR  24   0.858   1.748  -5.452
  194    H    ASP  25           H        ASP  25   4.291  -0.576  -7.804
  195    HA   ASP  25           HA       ASP  25   6.236   1.561  -8.129
  196   1HB   ASP  25          1HB       ASP  25   6.617   0.571 -10.348
  197   2HB   ASP  25          2HB       ASP  25   6.722  -0.649  -9.083
  198    H    VAL  26           H        VAL  26   2.926   1.107  -8.496
  199    HA   VAL  26           HA       VAL  26   2.673   3.056 -10.666
  200    HB   VAL  26           HB       VAL  26   0.456   1.555  -9.268
  201   1HG1  VAL  26          1HG1      VAL  26  -0.816   2.077 -11.307
  202   2HG1  VAL  26          2HG1      VAL  26  -0.286   3.530 -10.461
  203   3HG1  VAL  26          3HG1      VAL  26   0.560   2.998 -11.913
  204   1HG2  VAL  26          1HG2      VAL  26   1.928   0.799 -11.791
  205   2HG2  VAL  26          2HG2      VAL  26   1.990  -0.056 -10.249
  206   3HG2  VAL  26          3HG2      VAL  26   0.485   0.003 -11.165
  207    H    ARG  27           H        ARG  27   2.770   5.125  -9.977
  208    HA   ARG  27           HA       ARG  27   1.701   5.830  -7.368
  209   1HB   ARG  27          1HB       ARG  27   3.804   6.880  -8.156
  210   2HB   ARG  27          2HB       ARG  27   2.916   7.620  -9.485
  211   1HG   ARG  27          1HG       ARG  27   1.519   8.815  -7.835
  212   2HG   ARG  27          2HG       ARG  27   2.509   8.133  -6.547
  213   1HD   ARG  27          1HD       ARG  27   4.474   9.254  -7.446
  214   2HD   ARG  27          2HD       ARG  27   3.510   9.907  -8.772
  215    HE   ARG  27           HE       ARG  27   2.607  10.559  -6.082
  216   1HH1  ARG  27          1HH1      ARG  27   4.404  11.580  -8.921
  217   2HH1  ARG  27          2HH1      ARG  27   4.317  13.266  -8.514
  218   1HH2  ARG  27          1HH2      ARG  27   2.535  12.770  -5.540
  219   2HH2  ARG  27          2HH2      ARG  27   3.284  13.942  -6.588
  220    H    ASP  28           H        ASP  28  -0.472   5.367  -7.684
  221    HA   ASP  28           HA       ASP  28  -1.897   7.395  -9.245
  222   1HB   ASP  28          1HB       ASP  28  -1.823   5.302 -10.578
  223   2HB   ASP  28          2HB       ASP  28  -2.608   4.457  -9.253
  224    H    ASP  29           H        ASP  29  -3.485   8.316  -8.153
  225    HA   ASP  29           HA       ASP  29  -3.712   8.001  -5.395
  226   1HB   ASP  29          1HB       ASP  29  -4.261  10.044  -6.721
  227   2HB   ASP  29          2HB       ASP  29  -5.744   9.254  -7.244
  228    H    LYS  30           H        LYS  30  -5.697   6.660  -7.993
  229    HA   LYS  30           HA       LYS  30  -7.670   5.682  -6.113
  230   1HB   LYS  30          1HB       LYS  30  -7.536   6.086  -8.978
  231   2HB   LYS  30          2HB       LYS  30  -8.190   4.503  -8.580
  232   1HG   LYS  30          1HG       LYS  30  -9.875   5.527  -7.165
  233   2HG   LYS  30          2HG       LYS  30  -9.201   7.123  -7.496
  234   1HD   LYS  30          1HD       LYS  30  -9.770   6.925  -9.833
  235   2HD   LYS  30          2HD       LYS  30 -10.316   5.264  -9.591
  236   1HE   LYS  30          1HE       LYS  30 -12.161   6.930  -9.721
  237   2HE   LYS  30          2HE       LYS  30 -12.143   5.994  -8.228
  238   1HZ   LYS  30          1HZ       LYS  30 -11.273   7.811  -7.036
  239   2HZ   LYS  30          2HZ       LYS  30 -10.915   8.682  -8.450
  240   3HZ   LYS  30          3HZ       LYS  30 -12.526   8.447  -7.982
  241    H    LYS  31           H        LYS  31  -5.113   4.330  -8.159
  242    HA   LYS  31           HA       LYS  31  -5.746   1.626  -7.610
  243   1HB   LYS  31          1HB       LYS  31  -3.245   2.962  -8.587
  244   2HB   LYS  31          2HB       LYS  31  -3.287   1.238  -8.261
  245   1HG   LYS  31          1HG       LYS  31  -5.034   2.721 -10.216
  246   2HG   LYS  31          2HG       LYS  31  -3.676   1.659 -10.608
  247   1HD   LYS  31          1HD       LYS  31  -4.851  -0.218  -9.553
  248   2HD   LYS  31          2HD       LYS  31  -6.213   0.844  -9.188
  249   1HE   LYS  31          1HE       LYS  31  -6.521   1.231 -11.600
  250   2HE   LYS  31          2HE       LYS  31  -5.192   0.118 -11.931
  251   1HZ   LYS  31          1HZ       LYS  31  -7.784  -0.537 -10.638
  252   2HZ   LYS  31          2HZ       LYS  31  -7.254  -1.041 -12.167
  253   3HZ   LYS  31          3HZ       LYS  31  -6.485  -1.623 -10.771
  254    H    ALA  32           H        ALA  32  -3.700   3.959  -5.941
  255    HA   ALA  32           HA       ALA  32  -2.446   2.233  -4.136
  256   1HB   ALA  32          1HB       ALA  32  -2.202   4.192  -2.689
  257   2HB   ALA  32          2HB       ALA  32  -1.837   4.584  -4.370
  258   3HB   ALA  32          3HB       ALA  32  -3.382   5.063  -3.670
  259    H    ILE  33           H        ILE  33  -5.507   3.991  -3.834
  260    HA   ILE  33           HA       ILE  33  -6.290   2.926  -1.352
  261    HB   ILE  33           HB       ILE  33  -7.964   3.997  -3.627
  262   1HG1  ILE  33          1HG1      ILE  33  -7.038   5.303  -1.057
  263   2HG1  ILE  33          2HG1      ILE  33  -6.335   5.587  -2.644
  264   1HG2  ILE  33          1HG2      ILE  33  -9.760   4.251  -2.002
  265   2HG2  ILE  33          2HG2      ILE  33  -9.287   2.559  -2.161
  266   3HG2  ILE  33          3HG2      ILE  33  -8.759   3.493  -0.763
  267   1HD1  ILE  33          1HD1      ILE  33  -8.439   6.523  -3.422
  268   2HD1  ILE  33          2HD1      ILE  33  -9.165   6.213  -1.844
  269   3HD1  ILE  33          3HD1      ILE  33  -7.848   7.375  -1.995
  270    H    GLU  34           H        GLU  34  -6.980   1.936  -4.678
  271    HA   GLU  34           HA       GLU  34  -8.760  -0.134  -4.189
  272   1HB   GLU  34          1HB       GLU  34  -8.176   0.799  -6.432
  273   2HB   GLU  34          2HB       GLU  34  -6.647  -0.059  -6.354
  274   1HG   GLU  34          1HG       GLU  34  -8.152  -1.305  -7.716
  275   2HG   GLU  34          2HG       GLU  34  -7.904  -2.188  -6.211
  276    H    PHE  35           H        PHE  35  -5.204  -0.276  -4.428
  277    HA   PHE  35           HA       PHE  35  -4.988  -3.053  -4.034
  278   1HB   PHE  35          1HB       PHE  35  -3.010  -0.844  -3.450
  279   2HB   PHE  35          2HB       PHE  35  -2.620  -2.556  -3.369
  280    HD1  PHE  35           HD1      PHE  35  -4.278  -3.379  -5.808
  281    HD2  PHE  35           HD2      PHE  35  -1.483  -0.239  -5.145
  282    HE1  PHE  35           HE1      PHE  35  -3.720  -3.374  -8.204
  283    HE2  PHE  35           HE2      PHE  35  -0.924  -0.225  -7.541
  284    HZ   PHE  35           HZ       PHE  35  -2.044  -1.794  -9.073
  285    H    ALA  36           H        ALA  36  -4.986  -0.357  -1.758
  286    HA   ALA  36           HA       ALA  36  -4.354  -1.850   0.549
  287   1HB   ALA  36          1HB       ALA  36  -4.177   0.593   0.454
  288   2HB   ALA  36          2HB       ALA  36  -5.934   0.712   0.339
  289   3HB   ALA  36          3HB       ALA  36  -5.189   0.069   1.801
  290    H    LYS  37           H        LYS  37  -7.455  -0.979  -0.949
  291    HA   LYS  37           HA       LYS  37  -8.959  -2.196   1.167
  292   1HB   LYS  37          1HB       LYS  37  -9.828  -1.185  -1.537
  293   2HB   LYS  37          2HB       LYS  37 -10.927  -1.797  -0.306
  294   1HG   LYS  37          1HG       LYS  37  -9.743   0.003   1.195
  295   2HG   LYS  37          2HG       LYS  37  -9.366   0.734  -0.368
  296   1HD   LYS  37          1HD       LYS  37 -11.423   1.677   0.429
  297   2HD   LYS  37          2HD       LYS  37 -11.789   0.617  -0.934
  298   1HE   LYS  37          1HE       LYS  37 -12.334  -1.184   0.711
  299   2HE   LYS  37          2HE       LYS  37 -12.136   0.003   2.000
  300   1HZ   LYS  37          1HZ       LYS  37 -14.454  -0.235   1.406
  301   2HZ   LYS  37          2HZ       LYS  37 -13.908   1.317   0.995
  302   3HZ   LYS  37          3HZ       LYS  37 -14.110   0.144  -0.214
  303    H    GLN  38           H        GLN  38  -7.651  -3.307  -1.874
  304    HA   GLN  38           HA       GLN  38  -9.153  -5.681  -2.084
  305   1HB   GLN  38          1HB       GLN  38  -6.315  -5.056  -2.907
  306   2HB   GLN  38          2HB       GLN  38  -7.073  -6.610  -3.222
  307   1HG   GLN  38          1HG       GLN  38  -8.861  -5.398  -4.468
  308   2HG   GLN  38          2HG       GLN  38  -7.919  -3.923  -4.271
  309   1HE2  GLN  38          2HE2      GLN  38  -6.503  -7.085  -4.800
  310   2HE2  GLN  38          1HE2      GLN  38  -5.902  -6.748  -6.385
  311    H    TRP  39           H        TRP  39  -6.235  -4.876  -0.270
  312    HA   TRP  39           HA       TRP  39  -5.893  -7.425   0.911
  313   1HB   TRP  39          1HB       TRP  39  -4.088  -5.780   0.890
  314   2HB   TRP  39          2HB       TRP  39  -5.043  -4.687   1.887
  315    HD1  TRP  39           HD1      TRP  39  -3.658  -8.312   2.208
  316    HE1  TRP  39           HE1      TRP  39  -2.883  -8.648   4.644
  317    HE3  TRP  39           HE3      TRP  39  -4.955  -3.741   4.100
  318    HZ2  TRP  39           HZ2      TRP  39  -2.821  -7.156   7.039
  319    HZ3  TRP  39           HZ3      TRP  39  -4.499  -3.275   6.472
  320    HH2  TRP  39           HH2      TRP  39  -3.455  -4.949   7.910
  321    H    LEU  40           H        LEU  40  -7.585  -4.488   1.965
  322    HA   LEU  40           HA       LEU  40  -8.452  -5.376   4.461
  323   1HB   LEU  40          1HB       LEU  40  -9.808  -3.512   2.517
  324   2HB   LEU  40          2HB       LEU  40 -10.318  -3.740   4.178
  325    HG   LEU  40           HG       LEU  40  -7.662  -2.619   3.284
  326   1HD1  LEU  40          1HD1      LEU  40 -10.034  -1.307   4.604
  327   2HD1  LEU  40          2HD1      LEU  40  -8.494  -0.531   4.235
  328   3HD1  LEU  40          3HD1      LEU  40  -9.534  -1.095   2.927
  329   1HD2  LEU  40          1HD2      LEU  40  -8.795  -2.989   6.055
  330   2HD2  LEU  40          2HD2      LEU  40  -7.452  -3.893   5.356
  331   3HD2  LEU  40          3HD2      LEU  40  -7.289  -2.163   5.658
  332    H    SER  41           H        SER  41  -9.913  -5.820   1.270
  333    HA   SER  41           HA       SER  41 -12.251  -7.117   2.239
  334   1HB   SER  41          1HB       SER  41 -11.010  -7.295  -0.518
  335   2HB   SER  41          2HB       SER  41 -12.681  -7.666  -0.090
  336    HG   SER  41           HG       SER  41 -11.381  -5.168  -0.231
  337    H    SER  42           H        SER  42  -9.023  -8.171   1.603
  338    HA   SER  42           HA       SER  42  -9.698 -10.962   1.344
  339   1HB   SER  42          1HB       SER  42  -6.998  -9.650   1.751
  340   2HB   SER  42          2HB       SER  42  -7.279 -11.318   1.254
  341    HG   SER  42           HG       SER  42  -7.924  -8.949  -0.180
  342    H    ILE  43           H        ILE  43  -8.735  -8.781   3.908
  343    HA   ILE  43           HA       ILE  43  -8.382 -11.008   5.765
  344    HB   ILE  43           HB       ILE  43  -7.746  -9.304   7.423
  345   1HG1  ILE  43          1HG1      ILE  43  -8.104  -7.333   5.154
  346   2HG1  ILE  43          2HG1      ILE  43  -9.159  -7.464   6.558
  347   1HG2  ILE  43          1HG2      ILE  43  -6.302  -9.105   4.784
  348   2HG2  ILE  43          2HG2      ILE  43  -5.643  -8.618   6.346
  349   3HG2  ILE  43          3HG2      ILE  43  -6.034 -10.311   6.043
  350   1HD1  ILE  43          1HD1      ILE  43  -7.610  -5.612   6.784
  351   2HD1  ILE  43          2HD1      ILE  43  -7.301  -6.842   8.010
  352   3HD1  ILE  43          3HD1      ILE  43  -6.244  -6.714   6.604
  353    H    GLY  44           H        GLY  44 -10.926  -9.354   4.559
  354   1HA   GLY  44          1HA       GLY  44 -13.148  -9.522   5.159
  355   2HA   GLY  44          2HA       GLY  44 -12.651 -10.332   6.634
  356    H    GLU  45           H        GLU  45 -11.265  -7.243   5.869
  357    HA   GLU  45           HA       GLU  45 -12.457  -6.093   8.227
  358   1HB   GLU  45          1HB       GLU  45 -10.076  -5.686   7.147
  359   2HB   GLU  45          2HB       GLU  45 -10.931  -4.457   6.235
  360   1HG   GLU  45          1HG       GLU  45 -10.708  -4.629   9.228
  361   2HG   GLU  45          2HG       GLU  45  -9.869  -3.494   8.176
  362    H    GLU  46           H        GLU  46 -12.231  -4.557   5.047
  363    HA   GLU  46           HA       GLU  46 -13.751  -3.743   3.574
  364   1HB   GLU  46          1HB       GLU  46 -15.707  -5.595   4.930
  365   2HB   GLU  46          2HB       GLU  46 -15.810  -4.953   3.296
  366   1HG   GLU  46          1HG       GLU  46 -13.974  -6.266   2.573
  367   2HG   GLU  46          2HG       GLU  46 -13.580  -6.739   4.226
  368    H    GLY  47           H        GLY  47 -13.671  -2.663   6.502
  369   1HA   GLY  47          1HA       GLY  47 -16.344  -1.404   6.452
  370   2HA   GLY  47          2HA       GLY  47 -15.436  -1.723   7.921
  371    H    ALA  48           H        ALA  48 -12.927  -0.818   7.086
  372    HA   ALA  48           HA       ALA  48 -13.225   1.947   7.644
  373   1HB   ALA  48          1HB       ALA  48 -10.780   0.450   6.721
  374   2HB   ALA  48          2HB       ALA  48 -10.803   2.053   7.455
  375   3HB   ALA  48          3HB       ALA  48 -11.299   0.646   8.395
  376    H    THR  49           H        THR  49 -13.867   3.427   6.265
  377    HA   THR  49           HA       THR  49 -13.641   3.166   3.431
  378    HB   THR  49           HB       THR  49 -14.319   5.620   5.071
  379    HG1  THR  49           HG1      THR  49 -16.153   3.852   3.802
  380   1HG2  THR  49          1HG2      THR  49 -13.735   6.156   2.758
  381   2HG2  THR  49          2HG2      THR  49 -14.880   4.945   2.177
  382   3HG2  THR  49          3HG2      THR  49 -15.465   6.375   3.028
  383    H    VAL  50           H        VAL  50 -11.769   3.386   2.405
  384    HA   VAL  50           HA       VAL  50  -9.701   5.095   3.582
  385    HB   VAL  50           HB       VAL  50  -9.445   2.975   1.439
  386   1HG1  VAL  50          1HG1      VAL  50  -7.034   3.221   1.756
  387   2HG1  VAL  50          2HG1      VAL  50  -7.764   4.729   1.203
  388   3HG1  VAL  50          3HG1      VAL  50  -7.313   4.535   2.897
  389   1HG2  VAL  50          1HG2      VAL  50  -9.986   2.029   3.624
  390   2HG2  VAL  50          2HG2      VAL  50  -8.327   1.649   3.159
  391   3HG2  VAL  50          3HG2      VAL  50  -8.641   2.915   4.346
  392    H    THR  51           H        THR  51  -9.796   7.114   2.835
  393    HA   THR  51           HA       THR  51 -10.094   7.503  -0.069
  394    HB   THR  51           HB       THR  51 -10.432   9.884   0.435
  395    HG1  THR  51           HG1      THR  51 -10.102   9.033   3.150
  396   1HG2  THR  51          1HG2      THR  51 -12.396   8.442   0.391
  397   2HG2  THR  51          2HG2      THR  51 -12.183   8.074   2.102
  398   3HG2  THR  51          3HG2      THR  51 -12.591   9.714   1.597
  399    H    SER  52           H        SER  52  -8.708   9.860  -0.391
  400    HA   SER  52           HA       SER  52  -6.010   8.927  -0.439
  401   1HB   SER  52          1HB       SER  52  -7.096  10.429  -2.161
  402   2HB   SER  52          2HB       SER  52  -6.980  11.739  -0.986
  403    HG   SER  52           HG       SER  52  -5.040  10.587  -2.562
  404    H    GLU  53           H        GLU  53  -7.895  10.462   1.905
  405    HA   GLU  53           HA       GLU  53  -5.718  11.781   3.252
  406   1HB   GLU  53          1HB       GLU  53  -8.598  11.261   3.953
  407   2HB   GLU  53          2HB       GLU  53  -7.474  11.991   5.087
  408   1HG   GLU  53          1HG       GLU  53  -8.243  13.077   2.390
  409   2HG   GLU  53          2HG       GLU  53  -8.754  13.701   3.960
  410    H    GLU  54           H        GLU  54  -7.458   8.732   3.486
  411    HA   GLU  54           HA       GLU  54  -6.034   7.877   5.835
  412   1HB   GLU  54          1HB       GLU  54  -7.804   6.425   3.869
  413   2HB   GLU  54          2HB       GLU  54  -6.955   5.582   5.155
  414   1HG   GLU  54          1HG       GLU  54  -9.195   5.991   5.860
  415   2HG   GLU  54          2HG       GLU  54  -8.117   7.020   6.802
  416    H    CYS  55           H        CYS  55  -5.886   7.175   2.364
  417    HA   CYS  55           HA       CYS  55  -3.327   5.819   2.742
  418   1HB   CYS  55          1HB       CYS  55  -5.169   4.929   1.202
  419   2HB   CYS  55          2HB       CYS  55  -4.772   6.263   0.127
  420    HG   CYS  55           HG       CYS  55  -2.504   3.894   1.104
  421    H    ARG  56           H        ARG  56  -1.941   7.438   3.242
  422    HA   ARG  56           HA       ARG  56  -1.910   9.905   1.697
  423   1HB   ARG  56          1HB       ARG  56  -0.050   9.093   3.935
  424   2HB   ARG  56          2HB       ARG  56  -0.426  10.720   3.384
  425   1HG   ARG  56          1HG       ARG  56  -2.542  10.693   4.372
  426   2HG   ARG  56          2HG       ARG  56  -2.536   8.937   4.545
  427   1HD   ARG  56          1HD       ARG  56  -2.167   9.840   6.703
  428   2HD   ARG  56          2HD       ARG  56  -0.623   9.202   6.145
  429    HE   ARG  56           HE       ARG  56  -1.264  12.072   5.948
  430   1HH1  ARG  56          1HH1      ARG  56   0.872   9.465   6.941
  431   2HH1  ARG  56          2HH1      ARG  56   2.085  10.551   7.570
  432   1HH2  ARG  56          1HH2      ARG  56   0.313  13.475   6.771
  433   2HH2  ARG  56          2HH2      ARG  56   1.769  12.834   7.467
  434    H    PHE  57           H        PHE  57   0.298  10.708   0.965
  435    HA   PHE  57           HA       PHE  57   1.791   8.476  -0.208
  436   1HB   PHE  57          1HB       PHE  57   0.968  10.251  -1.750
  437   2HB   PHE  57          2HB       PHE  57   1.970  11.419  -0.894
  438    HD1  PHE  57           HD1      PHE  57   4.015  11.912  -1.802
  439    HD2  PHE  57           HD2      PHE  57   2.316   8.077  -2.519
  440    HE1  PHE  57           HE1      PHE  57   5.932  11.331  -3.231
  441    HE2  PHE  57           HE2      PHE  57   4.226   7.493  -3.949
  442    HZ   PHE  57           HZ       PHE  57   6.037   9.119  -4.305
  443    H    CYS  58           H        CYS  58   3.480   7.815   0.909
  444    HA   CYS  58           HA       CYS  58   4.605   9.465   2.983
  445   1HB   CYS  58          1HB       CYS  58   4.184   6.992   3.199
  446   2HB   CYS  58          2HB       CYS  58   5.498   6.727   2.061
  447    HG   CYS  58           HG       CYS  58   5.831   6.565   5.125
  448    H    HIS  59           H        HIS  59   6.130   7.617   0.327
  449    HA   HIS  59           HA       HIS  59   7.571   9.798  -0.721
  450   1HB   HIS  59          1HB       HIS  59   9.850   9.219   0.014
  451   2HB   HIS  59          2HB       HIS  59   8.846   9.706   1.368
  452    HD1  HIS  59           HD1      HIS  59   8.751   8.122   3.313
  453    HD2  HIS  59           HD2      HIS  59  10.258   6.336  -0.128
  454    HE1  HIS  59           HE1      HIS  59   9.513   5.827   4.010
  455    HE2  HIS  59           HE2      HIS  59  10.629   4.862   1.960
  456    H    SER  60           H        SER  60   9.593   8.862  -1.988
  457    HA   SER  60           HA       SER  60   8.953   6.175  -3.018
  458   1HB   SER  60          1HB       SER  60   9.810   8.563  -4.682
  459   2HB   SER  60          2HB       SER  60   9.505   6.935  -5.287
  460    HG   SER  60           HG       SER  60   7.769   8.911  -4.986
  461    H    GLU  61           H        GLU  61  10.711   4.835  -3.118
  462    HA   GLU  61           HA       GLU  61  13.375   6.018  -3.110
  463   1HB   GLU  61          1HB       GLU  61  14.127   4.750  -1.172
  464   2HB   GLU  61          2HB       GLU  61  12.810   5.825  -0.731
  465   1HG   GLU  61          1HG       GLU  61  11.254   3.952  -0.768
  466   2HG   GLU  61          2HG       GLU  61  12.562   2.870  -1.247
  467    H    LYS  62           H        LYS  62  15.076   4.238  -3.154
  468    HA   LYS  62           HA       LYS  62  14.499   2.520  -5.350
  469   1HB   LYS  62          1HB       LYS  62  16.719   3.576  -4.901
  470   2HB   LYS  62          2HB       LYS  62  16.909   2.501  -3.524
  471   1HG   LYS  62          1HG       LYS  62  16.983   0.584  -4.931
  472   2HG   LYS  62          2HG       LYS  62  16.525   1.538  -6.344
  473   1HD   LYS  62          1HD       LYS  62  18.618   2.823  -6.120
  474   2HD   LYS  62          2HD       LYS  62  19.080   1.797  -4.761
  475   1HE   LYS  62          1HE       LYS  62  19.131  -0.145  -6.187
  476   2HE   LYS  62          2HE       LYS  62  18.516   0.794  -7.546
  477   1HZ   LYS  62          1HZ       LYS  62  20.539   2.120  -7.492
  478   2HZ   LYS  62          2HZ       LYS  62  21.131   1.204  -6.199
  479   3HZ   LYS  62          3HZ       LYS  62  20.899   0.478  -7.715
  480    H    ALA  63           H        ALA  63  13.763   0.512  -5.338
  481    HA   ALA  63           HA       ALA  63  12.863  -0.570  -2.833
  482   1HB   ALA  63          1HB       ALA  63  11.648  -2.153  -4.169
  483   2HB   ALA  63          2HB       ALA  63  11.475  -0.545  -4.869
  484   3HB   ALA  63          3HB       ALA  63  12.576  -1.712  -5.601
  485    HA   PRO  64           HA       PRO  64  16.100  -3.644  -2.421
  486   1HB   PRO  64          1HB       PRO  64  14.991  -4.978  -0.349
  487   2HB   PRO  64          2HB       PRO  64  15.806  -3.424  -0.142
  488   1HG   PRO  64          1HG       PRO  64  12.883  -4.028  -0.302
  489   2HG   PRO  64          2HG       PRO  64  13.736  -2.891   0.756
  490   1HD   PRO  64          1HD       PRO  64  12.403  -2.141  -1.511
  491   2HD   PRO  64          2HD       PRO  64  13.780  -1.247  -0.839
  492    H    ASP  65           H        ASP  65  16.311  -5.809  -2.987
  493    HA   ASP  65           HA       ASP  65  14.574  -6.826  -4.898
  494   1HB   ASP  65          1HB       ASP  65  16.926  -7.488  -4.705
  495   2HB   ASP  65          2HB       ASP  65  16.569  -8.352  -3.214
  496    H    GLU  66           H        GLU  66  14.507  -7.207  -1.466
  497    HA   GLU  66           HA       GLU  66  13.056  -9.513  -1.071
  498   1HB   GLU  66          1HB       GLU  66  14.042  -8.027   0.690
  499   2HB   GLU  66          2HB       GLU  66  12.696  -6.925   0.451
  500   1HG   GLU  66          1HG       GLU  66  12.208  -8.219   2.364
  501   2HG   GLU  66          2HG       GLU  66  11.163  -8.804   1.069
  502    H    VAL  67           H        VAL  67  11.852  -6.299  -1.970
  503    HA   VAL  67           HA       VAL  67   9.106  -7.314  -1.874
  504    HB   VAL  67           HB       VAL  67   8.378  -4.996  -2.097
  505   1HG1  VAL  67          1HG1      VAL  67   9.222  -4.143   0.043
  506   2HG1  VAL  67          2HG1      VAL  67   8.803  -5.854   0.132
  507   3HG1  VAL  67          3HG1      VAL  67  10.493  -5.364   0.020
  508   1HG2  VAL  67          1HG2      VAL  67  10.006  -3.152  -2.052
  509   2HG2  VAL  67          2HG2      VAL  67  11.318  -4.321  -2.201
  510   3HG2  VAL  67          3HG2      VAL  67  10.154  -4.131  -3.512
  511    H    ILE  68           H        ILE  68  11.580  -6.878  -4.097
  512    HA   ILE  68           HA       ILE  68  10.232  -5.833  -6.334
  513    HB   ILE  68           HB       ILE  68  12.606  -7.703  -6.246
  514   1HG1  ILE  68          1HG1      ILE  68  13.005  -5.580  -5.108
  515   2HG1  ILE  68          2HG1      ILE  68  13.918  -5.649  -6.611
  516   1HG2  ILE  68          1HG2      ILE  68  11.563  -7.815  -8.426
  517   2HG2  ILE  68          2HG2      ILE  68  11.532  -6.054  -8.531
  518   3HG2  ILE  68          3HG2      ILE  68  13.073  -6.910  -8.532
  519   1HD1  ILE  68          1HD1      ILE  68  12.232  -4.250  -7.691
  520   2HD1  ILE  68          2HD1      ILE  68  11.333  -4.174  -6.175
  521   3HD1  ILE  68          3HD1      ILE  68  12.942  -3.460  -6.283
  522    H    GLU  69           H        GLU  69  10.839  -9.181  -5.349
  523    HA   GLU  69           HA       GLU  69   9.704 -10.410  -7.592
  524   1HB   GLU  69          1HB       GLU  69   9.573 -12.431  -6.141
  525   2HB   GLU  69          2HB       GLU  69  11.147 -11.648  -6.127
  526   1HG   GLU  69          1HG       GLU  69  10.433 -10.513  -3.994
  527   2HG   GLU  69          2HG       GLU  69   9.034 -11.589  -3.993
  528    H    ALA  70           H        ALA  70   8.225  -9.054  -4.756
  529    HA   ALA  70           HA       ALA  70   5.698 -10.392  -5.169
  530   1HB   ALA  70          1HB       ALA  70   6.395  -8.142  -3.288
  531   2HB   ALA  70          2HB       ALA  70   4.927  -9.117  -3.253
  532   3HB   ALA  70          3HB       ALA  70   6.488  -9.861  -2.906
  533    H    ILE  71           H        ILE  71   6.842  -7.014  -5.306
  534    HA   ILE  71           HA       ILE  71   4.374  -5.949  -6.183
  535    HB   ILE  71           HB       ILE  71   7.143  -4.787  -6.554
  536   1HG1  ILE  71          1HG1      ILE  71   5.146  -4.324  -4.331
  537   2HG1  ILE  71          2HG1      ILE  71   6.559  -5.365  -4.197
  538   1HG2  ILE  71          1HG2      ILE  71   4.444  -3.438  -6.534
  539   2HG2  ILE  71          2HG2      ILE  71   6.005  -2.632  -6.680
  540   3HG2  ILE  71          3HG2      ILE  71   5.448  -3.712  -7.958
  541   1HD1  ILE  71          1HD1      ILE  71   8.012  -3.454  -4.564
  542   2HD1  ILE  71          2HD1      ILE  71   6.603  -2.407  -4.733
  543   3HD1  ILE  71          3HD1      ILE  71   6.941  -3.186  -3.188
  544    H    LYS  72           H        LYS  72   7.138  -7.250  -7.904
  545    HA   LYS  72           HA       LYS  72   6.322  -6.288 -10.471
  546   1HB   LYS  72          1HB       LYS  72   8.671  -6.821  -9.878
  547   2HB   LYS  72          2HB       LYS  72   8.239  -8.519  -9.763
  548   1HG   LYS  72          1HG       LYS  72   7.829  -8.664 -12.091
  549   2HG   LYS  72          2HG       LYS  72   7.904  -6.912 -12.278
  550   1HD   LYS  72          1HD       LYS  72   9.957  -7.958 -13.076
  551   2HD   LYS  72          2HD       LYS  72  10.275  -6.947 -11.666
  552   1HE   LYS  72          1HE       LYS  72  11.500  -9.032 -11.502
  553   2HE   LYS  72          2HE       LYS  72  10.268  -8.946 -10.245
  554   1HZ   LYS  72          1HZ       LYS  72   9.917 -10.399 -12.813
  555   2HZ   LYS  72          2HZ       LYS  72  10.423 -11.130 -11.366
  556   3HZ   LYS  72          3HZ       LYS  72   8.883 -10.428 -11.465
  557    H    GLN  73           H        GLN  73   5.231  -8.768  -8.469
  558    HA   GLN  73           HA       GLN  73   4.237 -10.390 -10.692
  559   1HB   GLN  73          1HB       GLN  73   5.285 -11.614  -8.872
  560   2HB   GLN  73          2HB       GLN  73   4.196 -10.869  -7.708
  561   1HG   GLN  73          1HG       GLN  73   2.300 -11.986  -8.779
  562   2HG   GLN  73          2HG       GLN  73   3.402 -12.740  -9.929
  563   1HE2  GLN  73          2HE2      GLN  73   4.792 -14.354  -9.233
  564   2HE2  GLN  73          1HE2      GLN  73   4.525 -15.207  -7.743
  565    H    ASN  74           H        ASN  74   2.883  -9.187  -7.616
  566    HA   ASN  74           HA       ASN  74   0.228  -9.248  -8.802
  567   1HB   ASN  74          1HB       ASN  74  -0.407  -8.461  -6.402
  568   2HB   ASN  74          2HB       ASN  74   0.099 -10.125  -6.666
  569   1HD2  ASN  74          2HD2      ASN  74   1.927 -10.862  -5.729
  570   2HD2  ASN  74          1HD2      ASN  74   2.885  -9.932  -4.632
  571    H    GLY  75           H        GLY  75   2.362  -6.842  -7.267
  572   1HA   GLY  75          1HA       GLY  75   2.476  -4.740  -8.617
  573   2HA   GLY  75          2HA       GLY  75   0.722  -4.788  -8.614
  574    H    TYR  76           H        TYR  76   1.419  -5.842  -5.628
  575    HA   TYR  76           HA       TYR  76   2.028  -3.267  -4.443
  576   1HB   TYR  76          1HB       TYR  76  -0.025  -3.107  -3.144
  577   2HB   TYR  76          2HB       TYR  76  -0.401  -3.117  -4.861
  578    HD1  TYR  76           HD1      TYR  76  -1.067  -4.607  -1.695
  579    HD2  TYR  76           HD2      TYR  76  -1.170  -5.365  -5.881
  580    HE1  TYR  76           HE1      TYR  76  -2.634  -6.461  -1.314
  581    HE2  TYR  76           HE2      TYR  76  -2.739  -7.222  -5.511
  582    HH   TYR  76           HH       TYR  76  -3.366  -8.764  -3.692
  583    H    PHE  77           H        PHE  77   3.268  -3.578  -2.730
  584    HA   PHE  77           HA       PHE  77   3.070  -6.157  -1.324
  585   1HB   PHE  77          1HB       PHE  77   5.294  -5.612  -2.310
  586   2HB   PHE  77          2HB       PHE  77   5.363  -4.181  -1.290
  587    HD1  PHE  77           HD1      PHE  77   5.423  -7.852  -1.318
  588    HD2  PHE  77           HD2      PHE  77   5.919  -4.338   1.028
  589    HE1  PHE  77           HE1      PHE  77   6.441  -9.195   0.473
  590    HE2  PHE  77           HE2      PHE  77   6.942  -5.674   2.823
  591    HZ   PHE  77           HZ       PHE  77   7.205  -8.107   2.544
  592    H    ILE  78           H        ILE  78   1.924  -6.059   0.475
  593    HA   ILE  78           HA       ILE  78   1.696  -3.523   1.911
  594    HB   ILE  78           HB       ILE  78   0.273  -6.143   2.420
  595   1HG1  ILE  78          1HG1      ILE  78  -0.359  -5.177   0.259
  596   2HG1  ILE  78          2HG1      ILE  78  -1.687  -5.050   1.408
  597   1HG2  ILE  78          1HG2      ILE  78  -1.226  -4.808   3.834
  598   2HG2  ILE  78          2HG2      ILE  78   0.435  -4.775   4.426
  599   3HG2  ILE  78          3HG2      ILE  78  -0.218  -3.388   3.553
  600   1HD1  ILE  78          1HD1      ILE  78  -1.470  -3.029   0.087
  601   2HD1  ILE  78          2HD1      ILE  78  -1.130  -2.702   1.786
  602   3HD1  ILE  78          3HD1      ILE  78   0.195  -2.835   0.630
  603    H    TYR  79           H        TYR  79   3.265  -3.131   3.320
  604    HA   TYR  79           HA       TYR  79   4.336  -5.361   4.906
  605   1HB   TYR  79          1HB       TYR  79   6.027  -4.035   3.758
  606   2HB   TYR  79          2HB       TYR  79   5.386  -2.556   4.464
  607    HD1  TYR  79           HD1      TYR  79   6.165  -1.788   6.528
  608    HD2  TYR  79           HD2      TYR  79   7.011  -5.784   5.342
  609    HE1  TYR  79           HE1      TYR  79   7.673  -2.031   8.452
  610    HE2  TYR  79           HE2      TYR  79   8.524  -6.038   7.265
  611    HH   TYR  79           HH       TYR  79   8.600  -3.838   9.843
  612    H    LYS  80           H        LYS  80   3.189  -5.668   6.724
  613    HA   LYS  80           HA       LYS  80   1.649  -3.581   7.924
  614   1HB   LYS  80          1HB       LYS  80   2.360  -6.247   9.154
  615   2HB   LYS  80          2HB       LYS  80   1.000  -5.210   9.565
  616   1HG   LYS  80          1HG       LYS  80   0.061  -5.603   7.322
  617   2HG   LYS  80          2HG       LYS  80   1.398  -6.702   6.979
  618   1HD   LYS  80          1HD       LYS  80   0.629  -7.885   9.165
  619   2HD   LYS  80          2HD       LYS  80  -0.887  -7.030   8.879
  620   1HE   LYS  80          1HE       LYS  80  -1.091  -9.173   7.871
  621   2HE   LYS  80          2HE       LYS  80  -0.888  -8.001   6.567
  622   1HZ   LYS  80          1HZ       LYS  80   1.223  -9.767   7.685
  623   2HZ   LYS  80          2HZ       LYS  80   0.481  -9.929   6.169
  624   3HZ   LYS  80          3HZ       LYS  80   1.478  -8.594   6.489
  625    H    MET  81           H        MET  81   2.822  -1.930   8.716
  626    HA   MET  81           HA       MET  81   5.256  -2.203  10.151
  627   1HB   MET  81          1HB       MET  81   3.303   0.101  10.264
  628   2HB   MET  81          2HB       MET  81   5.012   0.148  10.666
  629   1HG   MET  81          1HG       MET  81   5.633  -0.125   8.391
  630   2HG   MET  81          2HG       MET  81   3.970  -0.474   7.920
  631   1HE   MET  81          1HE       MET  81   5.455   3.652   9.334
  632   2HE   MET  81          2HE       MET  81   6.496   2.244   9.137
  633   3HE   MET  81          3HE       MET  81   5.284   2.272  10.418
  634    H    GLU  82           H        GLU  82   2.112  -1.007  11.271
  635    HA   GLU  82           HA       GLU  82   2.082  -2.722  13.559
  636   1HB   GLU  82          1HB       GLU  82   2.121  -0.865  15.227
  637   2HB   GLU  82          2HB       GLU  82   3.662  -1.140  14.428
  638   1HG   GLU  82          1HG       GLU  82   3.174   0.757  12.924
  639   2HG   GLU  82          2HG       GLU  82   1.698   1.061  13.839
  640    H    GLY  83           H        GLY  83   0.041  -3.249  13.731
  641   1HA   GLY  83          1HA       GLY  83  -2.002  -1.187  13.800
  642   2HA   GLY  83          2HA       GLY  83  -2.137  -2.340  12.479
  643    H    CYS  84           H        CYS  84  -1.361  -4.669  13.684
  644    HA   CYS  84           HA       CYS  84  -3.714  -5.232  15.262
  645   1HB   CYS  84          1HB       CYS  84  -3.013  -6.773  13.477
  646   2HB   CYS  84          2HB       CYS  84  -1.490  -7.052  14.310
  647    HG   CYS  84           HG       CYS  84  -4.604  -8.028  15.338
  648    H    ASN  85           H        ASN  85  -3.150  -3.973  17.118
  649    HA   ASN  85           HA       ASN  85  -1.732  -5.564  19.060
  650   1HB   ASN  85          1HB       ASN  85  -0.345  -3.672  19.887
  651   2HB   ASN  85          2HB       ASN  85   0.122  -4.217  18.283
  652   1HD2  ASN  85          2HD2      ASN  85  -0.113  -2.864  16.554
  653   2HD2  ASN  85          1HD2      ASN  85  -0.516  -1.189  16.717
  Start of MODEL    9
    1    H    MET   1           H        MET   1  12.150  -2.106 -10.552
    2    HA   MET   1           HA       MET   1  11.123   0.047 -10.691
    3   1HB   MET   1          1HB       MET   1   8.928  -0.587  -9.527
    4   2HB   MET   1          2HB       MET   1   9.550  -1.686 -10.746
    5   1HG   MET   1          1HG       MET   1   8.758  -3.003  -8.960
    6   2HG   MET   1          2HG       MET   1  10.516  -3.056  -8.895
    7   1HE   MET   1          1HE       MET   1   7.835  -0.686  -5.986
    8   2HE   MET   1          2HE       MET   1   7.240  -1.708  -7.294
    9   3HE   MET   1          3HE       MET   1   8.056  -0.188  -7.662
   10    H    GLN   2           H        GLN   2   9.557   1.489  -9.295
   11    HA   GLN   2           HA       GLN   2  11.205   2.393  -7.020
   12   1HB   GLN   2          1HB       GLN   2   9.269   4.016  -8.684
   13   2HB   GLN   2          2HB       GLN   2  10.330   4.626  -7.422
   14   1HG   GLN   2          1HG       GLN   2  12.275   3.960  -8.791
   15   2HG   GLN   2          2HG       GLN   2  11.164   3.478 -10.073
   16   1HE2  GLN   2          2HE2      GLN   2  13.225   5.475 -10.183
   17   2HE2  GLN   2          1HE2      GLN   2  12.450   6.983 -10.524
   18    H    ILE   3           H        ILE   3  10.332   2.155  -5.064
   19    HA   ILE   3           HA       ILE   3   7.563   1.357  -4.875
   20    HB   ILE   3           HB       ILE   3   8.091   1.282  -2.362
   21   1HG1  ILE   3          1HG1      ILE   3  10.918   1.411  -3.439
   22   2HG1  ILE   3          2HG1      ILE   3  10.140   2.672  -2.488
   23   1HG2  ILE   3          1HG2      ILE   3   9.255  -0.904  -2.632
   24   2HG2  ILE   3          2HG2      ILE   3   7.825  -0.709  -3.645
   25   3HG2  ILE   3          3HG2      ILE   3   9.432  -0.540  -4.347
   26   1HD1  ILE   3          1HD1      ILE   3  11.628   1.325  -1.125
   27   2HD1  ILE   3          2HD1      ILE   3   9.954   1.135  -0.604
   28   3HD1  ILE   3          3HD1      ILE   3  10.728  -0.129  -1.559
   29    H    HIS   4           H        HIS   4   6.196   3.000  -5.183
   30    HA   HIS   4           HA       HIS   4   6.384   5.496  -3.791
   31   1HB   HIS   4          1HB       HIS   4   4.120   4.071  -5.200
   32   2HB   HIS   4          2HB       HIS   4   3.858   5.571  -4.319
   33    HD1  HIS   4           HD1      HIS   4   3.607   7.362  -5.997
   34    HD2  HIS   4           HD2      HIS   4   6.642   4.705  -7.014
   35    HE1  HIS   4           HE1      HIS   4   4.637   8.283  -8.092
   36    HE2  HIS   4           HE2      HIS   4   6.635   6.811  -8.523
   37    H    VAL   5           H        VAL   5   6.405   5.500  -1.640
   38    HA   VAL   5           HA       VAL   5   5.140   3.343  -0.176
   39    HB   VAL   5           HB       VAL   5   6.595   5.724   0.977
   40   1HG1  VAL   5          1HG1      VAL   5   6.015   2.981   2.086
   41   2HG1  VAL   5          2HG1      VAL   5   6.959   4.233   2.890
   42   3HG1  VAL   5          3HG1      VAL   5   5.244   4.491   2.572
   43   1HG2  VAL   5          1HG2      VAL   5   8.067   4.604  -0.605
   44   2HG2  VAL   5          2HG2      VAL   5   8.594   4.308   1.051
   45   3HG2  VAL   5          3HG2      VAL   5   7.734   3.051   0.162
   46    H    TYR   6           H        TYR   6   3.131   3.438   0.473
   47    HA   TYR   6           HA       TYR   6   1.932   6.075   0.995
   48   1HB   TYR   6          1HB       TYR   6   0.635   3.479   0.141
   49   2HB   TYR   6          2HB       TYR   6  -0.263   4.906   0.641
   50    HD1  TYR   6           HD1      TYR   6  -0.289   6.914  -0.777
   51    HD2  TYR   6           HD2      TYR   6   1.659   3.346  -2.024
   52    HE1  TYR   6           HE1      TYR   6  -0.279   7.735  -3.095
   53    HE2  TYR   6           HE2      TYR   6   1.682   4.162  -4.341
   54    HH   TYR   6           HH       TYR   6   0.277   5.788  -5.719
   55    H    ASP   7           H        ASP   7   2.120   6.419   3.116
   56    HA   ASP   7           HA       ASP   7   1.844   4.402   5.113
   57   1HB   ASP   7          1HB       ASP   7   1.816   7.421   5.195
   58   2HB   ASP   7          2HB       ASP   7   1.599   6.439   6.632
   59    H    THR   8           H        THR   8  -0.097   3.352   4.802
   60    HA   THR   8           HA       THR   8  -2.521   4.959   4.556
   61    HB   THR   8           HB       THR   8  -2.241   1.957   4.338
   62    HG1  THR   8           HG1      THR   8  -0.981   3.190   2.770
   63   1HG2  THR   8          1HG2      THR   8  -4.388   3.863   3.391
   64   2HG2  THR   8          2HG2      THR   8  -4.352   2.126   3.091
   65   3HG2  THR   8          3HG2      THR   8  -4.528   2.733   4.737
   66    H    TYR   9           H        TYR   9  -3.575   5.491   6.314
   67    HA   TYR   9           HA       TYR   9  -3.372   3.796   8.698
   68   1HB   TYR   9          1HB       TYR   9  -4.144   6.683   8.292
   69   2HB   TYR   9          2HB       TYR   9  -4.449   5.841   9.809
   70    HD1  TYR   9           HD1      TYR   9  -1.679   6.661   7.437
   71    HD2  TYR   9           HD2      TYR   9  -2.815   5.814  11.447
   72    HE1  TYR   9           HE1      TYR   9   0.606   7.176   8.187
   73    HE2  TYR   9           HE2      TYR   9  -0.536   6.324  12.208
   74    HH   TYR   9           HH       TYR   9   1.855   7.707  10.074
   75    H    VAL  10           H        VAL  10  -4.867   2.218   8.439
   76    HA   VAL  10           HA       VAL  10  -7.618   2.996   7.772
   77    HB   VAL  10           HB       VAL  10  -6.479   0.213   8.073
   78   1HG1  VAL  10          1HG1      VAL  10  -9.081   1.188   6.906
   79   2HG1  VAL  10          2HG1      VAL  10  -8.506  -0.479   6.872
   80   3HG1  VAL  10          3HG1      VAL  10  -8.874   0.294   8.413
   81   1HG2  VAL  10          1HG2      VAL  10  -6.470   0.123   5.626
   82   2HG2  VAL  10          2HG2      VAL  10  -6.963   1.815   5.565
   83   3HG2  VAL  10          3HG2      VAL  10  -5.391   1.378   6.233
   84    H    LYS  11           H        LYS  11  -8.892   3.455   9.439
   85    HA   LYS  11           HA       LYS  11  -8.172   2.548  12.094
   86   1HB   LYS  11          1HB       LYS  11 -10.447   4.330  11.200
   87   2HB   LYS  11          2HB       LYS  11  -9.948   4.051  12.865
   88   1HG   LYS  11          1HG       LYS  11  -7.738   5.025  12.319
   89   2HG   LYS  11          2HG       LYS  11  -8.341   5.400  10.705
   90   1HD   LYS  11          1HD       LYS  11  -8.581   7.393  11.911
   91   2HD   LYS  11          2HD       LYS  11 -10.198   6.692  11.886
   92   1HE   LYS  11          1HE       LYS  11  -8.278   6.302  14.169
   93   2HE   LYS  11          2HE       LYS  11  -9.414   7.646  14.098
   94   1HZ   LYS  11          1HZ       LYS  11 -11.232   6.034  13.998
   95   2HZ   LYS  11          2HZ       LYS  11 -10.123   4.757  14.117
   96   3HZ   LYS  11          3HZ       LYS  11 -10.304   5.841  15.405
   97    H    ALA  12           H        ALA  12  -9.003   0.840  13.064
   98    HA   ALA  12           HA       ALA  12 -10.928  -0.807  11.757
   99   1HB   ALA  12          1HB       ALA  12  -9.110  -1.747  13.097
  100   2HB   ALA  12          2HB       ALA  12  -9.809  -1.026  14.547
  101   3HB   ALA  12          3HB       ALA  12 -10.688  -2.282  13.676
  102    H    LYS  13           H        LYS  13 -12.751  -1.747  13.241
  103    HA   LYS  13           HA       LYS  13 -14.626   0.369  13.406
  104   1HB   LYS  13          1HB       LYS  13 -14.948  -2.475  14.349
  105   2HB   LYS  13          2HB       LYS  13 -16.236  -1.341  13.953
  106   1HG   LYS  13          1HG       LYS  13 -15.364  -1.266  11.626
  107   2HG   LYS  13          2HG       LYS  13 -14.226  -2.539  12.065
  108   1HD   LYS  13          1HD       LYS  13 -16.146  -3.971  12.688
  109   2HD   LYS  13          2HD       LYS  13 -17.232  -2.705  12.106
  110   1HE   LYS  13          1HE       LYS  13 -15.179  -4.202  10.497
  111   2HE   LYS  13          2HE       LYS  13 -16.929  -4.384  10.391
  112   1HZ   LYS  13          1HZ       LYS  13 -16.916  -1.920   9.799
  113   2HZ   LYS  13          2HZ       LYS  13 -15.253  -2.110   9.526
  114   3HZ   LYS  13          3HZ       LYS  13 -16.372  -3.007   8.617
  115    H    ASP  14           H        ASP  14 -13.158  -1.749  15.854
  116    HA   ASP  14           HA       ASP  14 -13.655   0.314  17.869
  117   1HB   ASP  14          1HB       ASP  14 -14.477  -1.395  19.485
  118   2HB   ASP  14          2HB       ASP  14 -15.569  -1.135  18.130
  119    H    GLY  15           H        GLY  15 -11.457  -1.398  16.363
  120   1HA   GLY  15          1HA       GLY  15  -9.959  -2.314  18.701
  121   2HA   GLY  15          2HA       GLY  15  -9.548  -2.627  17.021
  122    H    HIS  16           H        HIS  16  -7.975  -1.480  16.147
  123    HA   HIS  16           HA       HIS  16  -7.258   1.110  17.337
  124   1HB   HIS  16          1HB       HIS  16  -4.830   0.448  17.136
  125   2HB   HIS  16          2HB       HIS  16  -5.728  -0.402  18.388
  126    HD1  HIS  16           HD1      HIS  16  -5.544  -2.875  18.367
  127    HD2  HIS  16           HD2      HIS  16  -4.527  -1.204  14.696
  128    HE1  HIS  16           HE1      HIS  16  -4.756  -4.794  16.943
  129    HE2  HIS  16           HE2      HIS  16  -4.266  -3.775  14.688
  130    H    VAL  17           H        VAL  17  -5.118   1.793  15.823
  131    HA   VAL  17           HA       VAL  17  -6.362   2.063  13.190
  132    HB   VAL  17           HB       VAL  17  -3.980   3.533  14.341
  133   1HG1  VAL  17          1HG1      VAL  17  -5.607   4.059  11.854
  134   2HG1  VAL  17          2HG1      VAL  17  -4.313   5.085  12.474
  135   3HG1  VAL  17          3HG1      VAL  17  -3.950   3.455  11.906
  136   1HG2  VAL  17          1HG2      VAL  17  -5.515   5.421  14.610
  137   2HG2  VAL  17          2HG2      VAL  17  -6.854   4.412  14.063
  138   3HG2  VAL  17          3HG2      VAL  17  -6.024   4.034  15.572
  139    H    MET  18           H        MET  18  -5.792   0.650  11.702
  140    HA   MET  18           HA       MET  18  -3.281  -0.785  11.882
  141   1HB   MET  18          1HB       MET  18  -5.523  -0.951   9.856
  142   2HB   MET  18          2HB       MET  18  -4.121  -2.010   9.893
  143   1HG   MET  18          1HG       MET  18  -4.796  -2.821  12.097
  144   2HG   MET  18          2HG       MET  18  -6.206  -1.765  12.049
  145   1HE   MET  18          1HE       MET  18  -4.668  -3.743   9.025
  146   2HE   MET  18          2HE       MET  18  -5.559  -5.263   9.109
  147   3HE   MET  18          3HE       MET  18  -4.414  -4.842  10.382
  148    H    HIS  19           H        HIS  19  -1.609   0.497  11.359
  149    HA   HIS  19           HA       HIS  19  -1.727   1.829   8.745
  150   1HB   HIS  19          1HB       HIS  19   0.184   3.240   9.564
  151   2HB   HIS  19          2HB       HIS  19  -1.336   3.502  10.403
  152    HD1  HIS  19           HD1      HIS  19   2.185   2.575  10.953
  153    HD2  HIS  19           HD2      HIS  19  -1.385   2.439  13.080
  154    HE1  HIS  19           HE1      HIS  19   2.842   2.278  13.360
  155    HE2  HIS  19           HE2      HIS  19   0.663   2.026  14.608
  156    H    PHE  20           H        PHE  20  -0.699   0.866   7.207
  157    HA   PHE  20           HA       PHE  20   1.700  -0.705   7.819
  158   1HB   PHE  20          1HB       PHE  20   0.860  -2.393   6.109
  159   2HB   PHE  20          2HB       PHE  20   0.029  -2.380   7.659
  160    HD1  PHE  20           HD1      PHE  20  -0.255  -1.728   4.087
  161    HD2  PHE  20           HD2      PHE  20  -2.250  -1.532   7.840
  162    HE1  PHE  20           HE1      PHE  20  -2.406  -1.451   2.926
  163    HE2  PHE  20           HE2      PHE  20  -4.403  -1.252   6.686
  164    HZ   PHE  20           HZ       PHE  20  -4.483  -1.211   4.224
  165    H    ASP  21           H        ASP  21   3.076  -1.084   5.954
  166    HA   ASP  21           HA       ASP  21   3.217   1.322   4.349
  167   1HB   ASP  21          1HB       ASP  21   5.099  -1.046   4.391
  168   2HB   ASP  21          2HB       ASP  21   5.417   0.530   3.682
  169    H    VAL  22           H        VAL  22   2.080   1.407   2.525
  170    HA   VAL  22           HA       VAL  22   1.745  -1.018   0.918
  171    HB   VAL  22           HB       VAL  22   0.530   1.726   0.515
  172   1HG1  VAL  22          1HG1      VAL  22  -0.981   0.582  -1.053
  173   2HG1  VAL  22          2HG1      VAL  22   0.702   0.497  -1.575
  174   3HG1  VAL  22          3HG1      VAL  22  -0.063  -0.909  -0.833
  175   1HG2  VAL  22          1HG2      VAL  22  -0.291   0.692   2.552
  176   2HG2  VAL  22          2HG2      VAL  22  -1.549   0.696   1.314
  177   3HG2  VAL  22          3HG2      VAL  22  -0.667  -0.789   1.669
  178    H    PHE  23           H        PHE  23   3.275  -1.438  -0.503
  179    HA   PHE  23           HA       PHE  23   4.759   0.791  -1.720
  180   1HB   PHE  23          1HB       PHE  23   5.453  -2.150  -1.570
  181   2HB   PHE  23          2HB       PHE  23   6.449  -0.907  -2.316
  182    HD1  PHE  23           HD1      PHE  23   7.171   1.054  -0.782
  183    HD2  PHE  23           HD2      PHE  23   5.787  -2.710   0.641
  184    HE1  PHE  23           HE1      PHE  23   8.288   1.460   1.371
  185    HE2  PHE  23           HE2      PHE  23   6.900  -2.308   2.798
  186    HZ   PHE  23           HZ       PHE  23   8.152  -0.221   3.163
  187    H    THR  24           H        THR  24   4.203   1.356  -3.707
  188    HA   THR  24           HA       THR  24   3.433  -0.747  -5.610
  189    HB   THR  24           HB       THR  24   1.767   0.921  -6.592
  190    HG1  THR  24           HG1      THR  24   2.147   2.071  -4.012
  191   1HG2  THR  24          1HG2      THR  24   1.180  -0.235  -3.864
  192   2HG2  THR  24          2HG2      THR  24  -0.023   0.264  -5.054
  193   3HG2  THR  24          3HG2      THR  24   1.052  -1.090  -5.401
  194    H    ASP  25           H        ASP  25   4.035  -0.346  -7.758
  195    HA   ASP  25           HA       ASP  25   6.002   1.784  -8.109
  196   1HB   ASP  25          1HB       ASP  25   6.595  -0.471  -8.890
  197   2HB   ASP  25          2HB       ASP  25   5.200  -0.475  -9.960
  198    H    VAL  26           H        VAL  26   2.819   0.860  -9.105
  199    HA   VAL  26           HA       VAL  26   2.516   2.456 -11.382
  200    HB   VAL  26           HB       VAL  26   0.368   1.665  -9.407
  201   1HG1  VAL  26          1HG1      VAL  26  -0.341   3.411 -10.962
  202   2HG1  VAL  26          2HG1      VAL  26   0.178   2.415 -12.322
  203   3HG1  VAL  26          3HG1      VAL  26  -1.158   1.885 -11.301
  204   1HG2  VAL  26          1HG2      VAL  26   1.389   0.207 -11.844
  205   2HG2  VAL  26          2HG2      VAL  26   1.593  -0.293 -10.164
  206   3HG2  VAL  26          3HG2      VAL  26  -0.016  -0.260 -10.886
  207    H    ARG  27           H        ARG  27   2.426   4.580 -11.617
  208    HA   ARG  27           HA       ARG  27   2.258   6.331  -9.336
  209   1HB   ARG  27          1HB       ARG  27   2.466   6.848 -12.302
  210   2HB   ARG  27          2HB       ARG  27   2.284   8.142 -11.132
  211   1HG   ARG  27          1HG       ARG  27   4.572   8.027 -11.634
  212   2HG   ARG  27          2HG       ARG  27   4.393   7.291 -10.042
  213   1HD   ARG  27          1HD       ARG  27   4.710   5.126 -10.892
  214   2HD   ARG  27          2HD       ARG  27   4.421   5.645 -12.554
  215    HE   ARG  27           HE       ARG  27   6.594   7.056 -11.979
  216   1HH1  ARG  27          1HH1      ARG  27   5.901   3.703 -11.241
  217   2HH1  ARG  27          2HH1      ARG  27   7.549   3.190 -11.429
  218   1HH2  ARG  27          1HH2      ARG  27   8.767   6.381 -12.218
  219   2HH2  ARG  27          2HH2      ARG  27   9.173   4.705 -11.969
  220    H    ASP  28           H        ASP  28   0.148   5.714  -8.588
  221    HA   ASP  28           HA       ASP  28  -1.962   7.313  -9.716
  222   1HB   ASP  28          1HB       ASP  28  -1.951   5.194 -11.104
  223   2HB   ASP  28          2HB       ASP  28  -2.364   4.316  -9.636
  224    H    ASP  29           H        ASP  29  -3.353   7.918  -8.148
  225    HA   ASP  29           HA       ASP  29  -2.812   7.076  -5.450
  226   1HB   ASP  29          1HB       ASP  29  -4.968   8.916  -6.518
  227   2HB   ASP  29          2HB       ASP  29  -4.596   8.674  -4.816
  228    H    LYS  30           H        LYS  30  -5.371   6.590  -7.808
  229    HA   LYS  30           HA       LYS  30  -7.230   5.359  -6.077
  230   1HB   LYS  30          1HB       LYS  30  -8.021   6.194  -8.173
  231   2HB   LYS  30          2HB       LYS  30  -6.857   5.231  -9.070
  232   1HG   LYS  30          1HG       LYS  30  -8.028   3.184  -8.338
  233   2HG   LYS  30          2HG       LYS  30  -9.226   4.193  -7.523
  234   1HD   LYS  30          1HD       LYS  30 -10.010   5.082  -9.562
  235   2HD   LYS  30          2HD       LYS  30  -8.609   4.484 -10.451
  236   1HE   LYS  30          1HE       LYS  30 -10.515   3.111 -10.965
  237   2HE   LYS  30          2HE       LYS  30  -9.364   2.173 -10.020
  238   1HZ   LYS  30          1HZ       LYS  30 -11.630   1.811  -9.282
  239   2HZ   LYS  30          2HZ       LYS  30 -10.728   2.546  -8.056
  240   3HZ   LYS  30          3HZ       LYS  30 -11.827   3.464  -8.966
  241    H    LYS  31           H        LYS  31  -4.711   4.055  -8.207
  242    HA   LYS  31           HA       LYS  31  -5.186   1.343  -7.796
  243   1HB   LYS  31          1HB       LYS  31  -2.710   2.899  -8.458
  244   2HB   LYS  31          2HB       LYS  31  -2.620   1.164  -8.191
  245   1HG   LYS  31          1HG       LYS  31  -4.264   2.581 -10.277
  246   2HG   LYS  31          2HG       LYS  31  -2.812   1.615 -10.546
  247   1HD   LYS  31          1HD       LYS  31  -4.030  -0.343  -9.583
  248   2HD   LYS  31          2HD       LYS  31  -5.486   0.651  -9.543
  249   1HE   LYS  31          1HE       LYS  31  -3.902  -0.161 -11.973
  250   2HE   LYS  31          2HE       LYS  31  -5.513  -0.717 -11.522
  251   1HZ   LYS  31          1HZ       LYS  31  -4.710   1.978 -12.449
  252   2HZ   LYS  31          2HZ       LYS  31  -5.815   0.914 -13.163
  253   3HZ   LYS  31          3HZ       LYS  31  -6.201   1.685 -11.703
  254    H    ALA  32           H        ALA  32  -3.229   3.583  -5.869
  255    HA   ALA  32           HA       ALA  32  -2.130   1.737  -4.085
  256   1HB   ALA  32          1HB       ALA  32  -2.946   4.585  -3.512
  257   2HB   ALA  32          2HB       ALA  32  -1.806   3.617  -2.576
  258   3HB   ALA  32          3HB       ALA  32  -1.418   4.079  -4.232
  259    H    ILE  33           H        ILE  33  -5.093   3.669  -3.767
  260    HA   ILE  33           HA       ILE  33  -5.970   2.529  -1.342
  261    HB   ILE  33           HB       ILE  33  -7.593   3.798  -3.555
  262   1HG1  ILE  33          1HG1      ILE  33  -6.518   5.000  -0.994
  263   2HG1  ILE  33          2HG1      ILE  33  -5.808   5.239  -2.587
  264   1HG2  ILE  33          1HG2      ILE  33  -9.310   4.149  -1.865
  265   2HG2  ILE  33          2HG2      ILE  33  -8.962   2.430  -2.067
  266   3HG2  ILE  33          3HG2      ILE  33  -8.323   3.304  -0.673
  267   1HD1  ILE  33          1HD1      ILE  33  -8.569   6.089  -1.739
  268   2HD1  ILE  33          2HD1      ILE  33  -7.165   7.140  -1.927
  269   3HD1  ILE  33          3HD1      ILE  33  -7.857   6.333  -3.334
  270    H    GLU  34           H        GLU  34  -6.642   1.774  -4.712
  271    HA   GLU  34           HA       GLU  34  -8.622  -0.141  -4.473
  272   1HB   GLU  34          1HB       GLU  34  -7.604   0.892  -6.585
  273   2HB   GLU  34          2HB       GLU  34  -6.335  -0.313  -6.438
  274   1HG   GLU  34          1HG       GLU  34  -7.743  -1.336  -7.909
  275   2HG   GLU  34          2HG       GLU  34  -8.331  -1.988  -6.380
  276    H    PHE  35           H        PHE  35  -5.105  -0.595  -4.549
  277    HA   PHE  35           HA       PHE  35  -5.218  -3.420  -4.282
  278   1HB   PHE  35          1HB       PHE  35  -2.950  -1.472  -3.845
  279   2HB   PHE  35          2HB       PHE  35  -2.764  -3.222  -3.821
  280    HD1  PHE  35           HD1      PHE  35  -4.718  -3.806  -6.086
  281    HD2  PHE  35           HD2      PHE  35  -1.544  -1.001  -5.685
  282    HE1  PHE  35           HE1      PHE  35  -4.399  -3.826  -8.525
  283    HE2  PHE  35           HE2      PHE  35  -1.218  -1.016  -8.123
  284    HZ   PHE  35           HZ       PHE  35  -2.647  -2.431  -9.545
  285    H    ALA  36           H        ALA  36  -4.737  -0.782  -1.991
  286    HA   ALA  36           HA       ALA  36  -4.171  -2.358   0.269
  287   1HB   ALA  36          1HB       ALA  36  -5.517   0.341   0.155
  288   2HB   ALA  36          2HB       ALA  36  -4.766  -0.388   1.576
  289   3HB   ALA  36          3HB       ALA  36  -3.775   0.059   0.188
  290    H    LYS  37           H        LYS  37  -7.230  -1.102  -1.024
  291    HA   LYS  37           HA       LYS  37  -8.821  -2.131   1.080
  292   1HB   LYS  37          1HB       LYS  37  -9.316  -0.846  -1.522
  293   2HB   LYS  37          2HB       LYS  37 -10.603  -1.900  -0.943
  294   1HG   LYS  37          1HG       LYS  37 -10.623  -0.678   1.173
  295   2HG   LYS  37          2HG       LYS  37  -9.387   0.411   0.549
  296   1HD   LYS  37          1HD       LYS  37 -10.860   1.260  -1.117
  297   2HD   LYS  37          2HD       LYS  37 -12.057   0.005  -0.787
  298   1HE   LYS  37          1HE       LYS  37 -11.198   2.029   1.268
  299   2HE   LYS  37          2HE       LYS  37 -12.548   2.300   0.166
  300   1HZ   LYS  37          1HZ       LYS  37 -13.753   0.544   1.107
  301   2HZ   LYS  37          2HZ       LYS  37 -12.403  -0.092   1.912
  302   3HZ   LYS  37          3HZ       LYS  37 -13.097   1.363   2.437
  303    H    GLN  38           H        GLN  38  -7.815  -3.468  -2.007
  304    HA   GLN  38           HA       GLN  38  -9.438  -5.757  -1.990
  305   1HB   GLN  38          1HB       GLN  38  -6.647  -5.353  -3.071
  306   2HB   GLN  38          2HB       GLN  38  -7.574  -6.828  -3.322
  307   1HG   GLN  38          1HG       GLN  38  -9.333  -5.483  -4.423
  308   2HG   GLN  38          2HG       GLN  38  -8.305  -4.060  -4.256
  309   1HE2  GLN  38          2HE2      GLN  38  -7.087  -7.260  -4.958
  310   2HE2  GLN  38          1HE2      GLN  38  -6.590  -6.926  -6.578
  311    H    TRP  39           H        TRP  39  -6.370  -5.085  -0.390
  312    HA   TRP  39           HA       TRP  39  -6.079  -7.679   0.758
  313   1HB   TRP  39          1HB       TRP  39  -4.177  -6.141   0.490
  314   2HB   TRP  39          2HB       TRP  39  -4.924  -5.008   1.610
  315    HD1  TRP  39           HD1      TRP  39  -3.435  -8.580   1.602
  316    HE1  TRP  39           HE1      TRP  39  -2.482  -9.049   3.946
  317    HE3  TRP  39           HE3      TRP  39  -4.920  -4.293   3.964
  318    HZ2  TRP  39           HZ2      TRP  39  -2.366  -7.773   6.456
  319    HZ3  TRP  39           HZ3      TRP  39  -4.344  -3.999   6.337
  320    HH2  TRP  39           HH2      TRP  39  -3.095  -5.702   7.556
  321    H    LEU  40           H        LEU  40  -7.354  -4.592   1.905
  322    HA   LEU  40           HA       LEU  40  -7.963  -5.387   4.529
  323   1HB   LEU  40          1HB       LEU  40  -9.133  -3.225   2.787
  324   2HB   LEU  40          2HB       LEU  40  -9.469  -3.390   4.502
  325    HG   LEU  40           HG       LEU  40  -6.665  -3.064   3.454
  326   1HD1  LEU  40          1HD1      LEU  40  -8.564  -0.891   4.327
  327   2HD1  LEU  40          2HD1      LEU  40  -6.849  -0.686   3.968
  328   3HD1  LEU  40          3HD1      LEU  40  -7.968  -1.152   2.687
  329   1HD2  LEU  40          1HD2      LEU  40  -6.234  -2.299   5.735
  330   2HD2  LEU  40          2HD2      LEU  40  -7.930  -2.559   6.147
  331   3HD2  LEU  40          3HD2      LEU  40  -6.905  -3.930   5.723
  332    H    SER  41           H        SER  41  -9.807  -5.674   1.540
  333    HA   SER  41           HA       SER  41 -12.201  -6.507   2.890
  334   1HB   SER  41          1HB       SER  41 -12.892  -7.212   0.538
  335   2HB   SER  41          2HB       SER  41 -12.536  -5.500   0.766
  336    HG   SER  41           HG       SER  41 -10.771  -5.682  -0.417
  337    H    SER  42           H        SER  42  -9.364  -8.065   1.593
  338    HA   SER  42           HA       SER  42 -10.357 -10.711   1.572
  339   1HB   SER  42          1HB       SER  42  -7.523  -9.690   1.873
  340   2HB   SER  42          2HB       SER  42  -7.959 -11.373   1.571
  341    HG   SER  42           HG       SER  42  -8.418  -9.130  -0.119
  342    H    ILE  43           H        ILE  43  -8.799  -8.745   4.064
  343    HA   ILE  43           HA       ILE  43  -8.746 -10.922   5.954
  344    HB   ILE  43           HB       ILE  43  -7.919  -9.320   7.573
  345   1HG1  ILE  43          1HG1      ILE  43  -8.475  -7.223   5.460
  346   2HG1  ILE  43          2HG1      ILE  43  -9.325  -7.398   6.991
  347   1HG2  ILE  43          1HG2      ILE  43  -6.322 -10.252   6.021
  348   2HG2  ILE  43          2HG2      ILE  43  -6.670  -8.978   4.852
  349   3HG2  ILE  43          3HG2      ILE  43  -5.891  -8.580   6.383
  350   1HD1  ILE  43          1HD1      ILE  43  -7.716  -5.583   7.068
  351   2HD1  ILE  43          2HD1      ILE  43  -7.274  -6.867   8.192
  352   3HD1  ILE  43          3HD1      ILE  43  -6.415  -6.705   6.661
  353    H    GLY  44           H        GLY  44 -11.180  -9.029   4.789
  354   1HA   GLY  44          1HA       GLY  44 -13.418  -9.165   5.386
  355   2HA   GLY  44          2HA       GLY  44 -12.941  -9.931   6.891
  356    H    GLU  45           H        GLU  45 -11.786  -6.804   5.704
  357    HA   GLU  45           HA       GLU  45 -13.258  -5.546   7.932
  358   1HB   GLU  45          1HB       GLU  45 -10.584  -5.577   7.687
  359   2HB   GLU  45          2HB       GLU  45 -10.924  -4.169   6.693
  360   1HG   GLU  45          1HG       GLU  45 -11.706  -4.541   9.575
  361   2HG   GLU  45          2HG       GLU  45 -10.399  -3.531   8.968
  362    H    GLU  46           H        GLU  46 -12.338  -5.369   4.572
  363    HA   GLU  46           HA       GLU  46 -13.226  -4.296   2.772
  364   1HB   GLU  46          1HB       GLU  46 -15.068  -2.983   4.767
  365   2HB   GLU  46          2HB       GLU  46 -15.078  -2.614   3.048
  366   1HG   GLU  46          1HG       GLU  46 -15.685  -4.886   2.521
  367   2HG   GLU  46          2HG       GLU  46 -15.563  -5.342   4.220
  368    H    GLY  47           H        GLY  47 -12.145  -2.629   5.612
  369   1HA   GLY  47          1HA       GLY  47 -10.123  -1.415   5.495
  370   2HA   GLY  47          2HA       GLY  47 -10.464  -1.053   3.813
  371    H    ALA  48           H        ALA  48 -13.153  -0.597   5.811
  372    HA   ALA  48           HA       ALA  48 -14.303   1.271   6.432
  373   1HB   ALA  48          1HB       ALA  48 -12.623   1.178   8.202
  374   2HB   ALA  48          2HB       ALA  48 -11.528   2.162   7.229
  375   3HB   ALA  48          3HB       ALA  48 -13.043   2.848   7.819
  376    H    THR  49           H        THR  49 -13.252   3.999   6.478
  377    HA   THR  49           HA       THR  49 -13.559   4.634   3.658
  378    HB   THR  49           HB       THR  49 -13.310   6.523   6.009
  379    HG1  THR  49           HG1      THR  49 -15.231   4.893   5.707
  380   1HG2  THR  49          1HG2      THR  49 -12.821   7.553   3.840
  381   2HG2  THR  49          2HG2      THR  49 -14.351   6.951   3.204
  382   3HG2  THR  49          3HG2      THR  49 -14.345   8.152   4.497
  383    H    VAL  50           H        VAL  50 -11.716   4.457   2.524
  384    HA   VAL  50           HA       VAL  50  -9.331   5.811   3.589
  385    HB   VAL  50           HB       VAL  50  -9.426   3.303   1.896
  386   1HG1  VAL  50          1HG1      VAL  50  -7.658   4.775   1.076
  387   2HG1  VAL  50          2HG1      VAL  50  -7.027   4.945   2.714
  388   3HG1  VAL  50          3HG1      VAL  50  -6.975   3.378   1.907
  389   1HG2  VAL  50          1HG2      VAL  50  -8.294   3.856   4.637
  390   2HG2  VAL  50          2HG2      VAL  50  -9.744   2.918   4.276
  391   3HG2  VAL  50          3HG2      VAL  50  -8.162   2.329   3.764
  392    H    THR  51           H        THR  51  -9.247   7.678   2.566
  393    HA   THR  51           HA       THR  51  -9.426   7.649  -0.380
  394    HB   THR  51           HB       THR  51  -9.450  10.255   1.039
  395    HG1  THR  51           HG1      THR  51 -10.909   9.417   2.410
  396   1HG2  THR  51          1HG2      THR  51 -11.179  10.757  -0.631
  397   2HG2  THR  51          2HG2      THR  51  -9.740  10.085  -1.396
  398   3HG2  THR  51          3HG2      THR  51 -11.164   9.074  -1.157
  399    H    SER  52           H        SER  52  -8.037  10.075  -0.806
  400    HA   SER  52           HA       SER  52  -5.344   9.203  -0.602
  401   1HB   SER  52          1HB       SER  52  -6.317  11.986  -1.287
  402   2HB   SER  52          2HB       SER  52  -4.800  11.226  -1.776
  403    HG   SER  52           HG       SER  52  -6.354  11.164  -3.459
  404    H    GLU  53           H        GLU  53  -7.358  10.593   1.648
  405    HA   GLU  53           HA       GLU  53  -5.392  12.170   3.035
  406   1HB   GLU  53          1HB       GLU  53  -8.093  11.225   4.000
  407   2HB   GLU  53          2HB       GLU  53  -7.138  12.545   4.645
  408   1HG   GLU  53          1HG       GLU  53  -8.530  12.435   1.991
  409   2HG   GLU  53          2HG       GLU  53  -8.920  13.463   3.369
  410    H    GLU  54           H        GLU  54  -7.155   9.140   3.581
  411    HA   GLU  54           HA       GLU  54  -5.730   8.445   5.944
  412   1HB   GLU  54          1HB       GLU  54  -7.413   6.777   4.064
  413   2HB   GLU  54          2HB       GLU  54  -6.759   6.184   5.582
  414   1HG   GLU  54          1HG       GLU  54  -9.073   6.788   5.852
  415   2HG   GLU  54          2HG       GLU  54  -8.054   7.874   6.793
  416    H    CYS  55           H        CYS  55  -5.395   7.682   2.536
  417    HA   CYS  55           HA       CYS  55  -3.037   6.051   3.057
  418   1HB   CYS  55          1HB       CYS  55  -4.802   5.451   1.321
  419   2HB   CYS  55          2HB       CYS  55  -4.215   6.815   0.377
  420    HG   CYS  55           HG       CYS  55  -2.408   4.037   1.232
  421    H    ARG  56           H        ARG  56  -1.399   7.373   3.681
  422    HA   ARG  56           HA       ARG  56  -1.082   9.992   2.461
  423   1HB   ARG  56          1HB       ARG  56   0.512   8.613   4.623
  424   2HB   ARG  56          2HB       ARG  56   0.726  10.280   4.114
  425   1HG   ARG  56          1HG       ARG  56  -1.510  10.822   4.901
  426   2HG   ARG  56          2HG       ARG  56  -1.756   9.138   5.381
  427   1HD   ARG  56          1HD       ARG  56   0.109   9.298   6.939
  428   2HD   ARG  56          2HD       ARG  56   0.402  10.962   6.440
  429    HE   ARG  56           HE       ARG  56  -2.262  10.594   7.407
  430   1HH1  ARG  56          1HH1      ARG  56   1.070  10.963   8.415
  431   2HH1  ARG  56          2HH1      ARG  56   0.669  11.699   9.940
  432   1HH2  ARG  56          1HH2      ARG  56  -2.806  11.568   9.411
  433   2HH2  ARG  56          2HH2      ARG  56  -1.540  12.023  10.518
  434    H    PHE  57           H        PHE  57  -0.028  10.104   0.567
  435    HA   PHE  57           HA       PHE  57   2.131   8.306  -0.073
  436   1HB   PHE  57          1HB       PHE  57   0.786   9.193  -1.895
  437   2HB   PHE  57          2HB       PHE  57   1.180  10.844  -1.425
  438    HD1  PHE  57           HD1      PHE  57   2.963   7.679  -2.285
  439    HD2  PHE  57           HD2      PHE  57   2.791  11.915  -2.655
  440    HE1  PHE  57           HE1      PHE  57   4.936   7.626  -3.752
  441    HE2  PHE  57           HE2      PHE  57   4.765  11.869  -4.123
  442    HZ   PHE  57           HZ       PHE  57   5.838   9.723  -4.672
  443    H    CYS  58           H        CYS  58   4.094   8.489   0.793
  444    HA   CYS  58           HA       CYS  58   4.889  11.110   1.819
  445   1HB   CYS  58          1HB       CYS  58   6.706   9.774   2.984
  446   2HB   CYS  58          2HB       CYS  58   5.053   9.476   3.507
  447    HG   CYS  58           HG       CYS  58   5.285   6.946   3.336
  448    H    HIS  59           H        HIS  59   6.432   8.395   0.037
  449    HA   HIS  59           HA       HIS  59   7.650  10.241  -1.782
  450   1HB   HIS  59          1HB       HIS  59   9.984   9.814  -1.203
  451   2HB   HIS  59          2HB       HIS  59   9.140  10.562   0.142
  452    HD1  HIS  59           HD1      HIS  59   9.077   9.286   2.340
  453    HD2  HIS  59           HD2      HIS  59  10.649   7.063  -0.809
  454    HE1  HIS  59           HE1      HIS  59  10.042   7.205   3.383
  455    HE2  HIS  59           HE2      HIS  59  11.133   5.953   1.476
  456    H    SER  60           H        SER  60   9.487   9.016  -3.015
  457    HA   SER  60           HA       SER  60   8.735   6.204  -3.450
  458   1HB   SER  60          1HB       SER  60   9.291   8.171  -5.689
  459   2HB   SER  60          2HB       SER  60   8.744   6.501  -5.845
  460    HG   SER  60           HG       SER  60   7.291   8.743  -5.525
  461    H    GLU  61           H        GLU  61  10.535   4.962  -3.300
  462    HA   GLU  61           HA       GLU  61  13.105   6.228  -3.951
  463   1HB   GLU  61          1HB       GLU  61  14.127   5.129  -1.997
  464   2HB   GLU  61          2HB       GLU  61  12.889   6.289  -1.542
  465   1HG   GLU  61          1HG       GLU  61  11.305   4.455  -1.198
  466   2HG   GLU  61          2HG       GLU  61  12.563   3.298  -1.631
  467    H    LYS  62           H        LYS  62  14.890   4.613  -4.139
  468    HA   LYS  62           HA       LYS  62  14.220   2.596  -5.999
  469   1HB   LYS  62          1HB       LYS  62  16.414   3.828  -5.836
  470   2HB   LYS  62          2HB       LYS  62  16.789   2.851  -4.425
  471   1HG   LYS  62          1HG       LYS  62  16.002   1.256  -6.725
  472   2HG   LYS  62          2HG       LYS  62  17.422   2.256  -7.027
  473   1HD   LYS  62          1HD       LYS  62  18.463   1.337  -4.987
  474   2HD   LYS  62          2HD       LYS  62  17.058   0.291  -4.767
  475   1HE   LYS  62          1HE       LYS  62  17.509  -0.835  -6.844
  476   2HE   LYS  62          2HE       LYS  62  18.815   0.290  -7.215
  477   1HZ   LYS  62          1HZ       LYS  62  20.041  -0.541  -5.318
  478   2HZ   LYS  62          2HZ       LYS  62  18.776  -1.602  -4.924
  479   3HZ   LYS  62          3HZ       LYS  62  19.648  -1.819  -6.363
  480    H    ALA  63           H        ALA  63  13.329   0.725  -5.595
  481    HA   ALA  63           HA       ALA  63  12.779  -0.091  -2.935
  482   1HB   ALA  63          1HB       ALA  63  11.503  -1.860  -3.948
  483   2HB   ALA  63          2HB       ALA  63  11.230  -0.355  -4.826
  484   3HB   ALA  63          3HB       ALA  63  12.295  -1.587  -5.500
  485    HA   PRO  64           HA       PRO  64  16.028  -3.093  -2.176
  486   1HB   PRO  64          1HB       PRO  64  13.966  -4.472  -0.573
  487   2HB   PRO  64          2HB       PRO  64  15.538  -3.841  -0.073
  488   1HG   PRO  64          1HG       PRO  64  13.254  -2.646   0.658
  489   2HG   PRO  64          2HG       PRO  64  14.717  -1.712   0.292
  490   1HD   PRO  64          1HD       PRO  64  12.289  -2.177  -1.400
  491   2HD   PRO  64          2HD       PRO  64  13.243  -0.695  -1.180
  492    H    ASP  65           H        ASP  65  16.519  -5.125  -2.958
  493    HA   ASP  65           HA       ASP  65  15.057  -5.917  -5.226
  494   1HB   ASP  65          1HB       ASP  65  17.547  -6.224  -4.753
  495   2HB   ASP  65          2HB       ASP  65  17.087  -7.644  -3.820
  496    H    GLU  66           H        GLU  66  14.917  -6.940  -1.933
  497    HA   GLU  66           HA       GLU  66  13.716  -9.448  -2.195
  498   1HB   GLU  66          1HB       GLU  66  14.645  -8.539  -0.096
  499   2HB   GLU  66          2HB       GLU  66  13.312  -7.398  -0.012
  500   1HG   GLU  66          1HG       GLU  66  11.734  -9.204   0.244
  501   2HG   GLU  66          2HG       GLU  66  13.023 -10.393   0.050
  502    H    VAL  67           H        VAL  67  12.228  -6.213  -2.033
  503    HA   VAL  67           HA       VAL  67   9.571  -7.354  -2.031
  504    HB   VAL  67           HB       VAL  67   8.725  -5.088  -1.989
  505   1HG1  VAL  67          1HG1      VAL  67  11.088  -5.427  -0.153
  506   2HG1  VAL  67          2HG1      VAL  67   9.750  -4.305   0.091
  507   3HG1  VAL  67          3HG1      VAL  67   9.458  -6.043   0.114
  508   1HG2  VAL  67          1HG2      VAL  67  10.263  -4.022  -3.536
  509   2HG2  VAL  67          2HG2      VAL  67  10.229  -3.143  -2.007
  510   3HG2  VAL  67          3HG2      VAL  67  11.584  -4.209  -2.382
  511    H    ILE  68           H        ILE  68  11.846  -6.593  -4.377
  512    HA   ILE  68           HA       ILE  68  10.279  -5.562  -6.460
  513    HB   ILE  68           HB       ILE  68  12.734  -7.314  -6.651
  514   1HG1  ILE  68          1HG1      ILE  68  13.074  -5.236  -5.356
  515   2HG1  ILE  68          2HG1      ILE  68  13.976  -5.224  -6.868
  516   1HG2  ILE  68          1HG2      ILE  68  11.481  -5.506  -8.714
  517   2HG2  ILE  68          2HG2      ILE  68  13.011  -6.365  -8.892
  518   3HG2  ILE  68          3HG2      ILE  68  11.502  -7.269  -8.751
  519   1HD1  ILE  68          1HD1      ILE  68  12.239  -3.805  -7.858
  520   2HD1  ILE  68          2HD1      ILE  68  11.390  -3.795  -6.311
  521   3HD1  ILE  68          3HD1      ILE  68  12.992  -3.068  -6.444
  522    H    GLU  69           H        GLU  69  11.125  -8.931  -5.665
  523    HA   GLU  69           HA       GLU  69   9.673  -9.989  -7.878
  524   1HB   GLU  69          1HB       GLU  69  10.129 -12.179  -6.899
  525   2HB   GLU  69          2HB       GLU  69  11.575 -11.187  -6.936
  526   1HG   GLU  69          1HG       GLU  69  11.813 -11.972  -4.847
  527   2HG   GLU  69          2HG       GLU  69  10.730 -10.637  -4.455
  528    H    ALA  70           H        ALA  70   8.830  -9.060  -4.672
  529    HA   ALA  70           HA       ALA  70   6.423 -10.591  -4.485
  530   1HB   ALA  70          1HB       ALA  70   7.235  -8.103  -2.979
  531   2HB   ALA  70          2HB       ALA  70   5.920  -9.197  -2.548
  532   3HB   ALA  70          3HB       ALA  70   7.590  -9.760  -2.493
  533    H    ILE  71           H        ILE  71   7.122  -7.171  -5.142
  534    HA   ILE  71           HA       ILE  71   4.452  -6.461  -5.783
  535    HB   ILE  71           HB       ILE  71   7.037  -5.110  -6.598
  536   1HG1  ILE  71          1HG1      ILE  71   5.185  -4.560  -4.267
  537   2HG1  ILE  71          2HG1      ILE  71   6.737  -5.381  -4.150
  538   1HG2  ILE  71          1HG2      ILE  71   4.219  -4.025  -6.525
  539   2HG2  ILE  71          2HG2      ILE  71   5.674  -3.098  -6.893
  540   3HG2  ILE  71          3HG2      ILE  71   5.153  -4.388  -7.976
  541   1HD1  ILE  71          1HD1      ILE  71   6.311  -2.538  -5.033
  542   2HD1  ILE  71          2HD1      ILE  71   6.898  -3.064  -3.455
  543   3HD1  ILE  71          3HD1      ILE  71   7.866  -3.360  -4.898
  544    H    LYS  72           H        LYS  72   7.062  -7.876  -7.571
  545    HA   LYS  72           HA       LYS  72   6.278  -7.422 -10.198
  546   1HB   LYS  72          1HB       LYS  72   8.403  -8.455  -9.616
  547   2HB   LYS  72          2HB       LYS  72   7.573  -9.863  -8.974
  548   1HG   LYS  72          1HG       LYS  72   6.653 -10.216 -11.299
  549   2HG   LYS  72          2HG       LYS  72   7.805  -8.991 -11.836
  550   1HD   LYS  72          1HD       LYS  72   8.767 -11.180 -12.157
  551   2HD   LYS  72          2HD       LYS  72   9.636 -10.348 -10.865
  552   1HE   LYS  72          1HE       LYS  72   8.339 -11.582  -9.197
  553   2HE   LYS  72          2HE       LYS  72   7.461 -12.407 -10.485
  554   1HZ   LYS  72          1HZ       LYS  72  10.368 -12.615  -9.910
  555   2HZ   LYS  72          2HZ       LYS  72   9.198 -13.821  -9.668
  556   3HZ   LYS  72          3HZ       LYS  72   9.598 -13.330 -11.242
  557    H    GLN  73           H        GLN  73   5.120  -9.799  -7.875
  558    HA   GLN  73           HA       GLN  73   3.561 -11.141  -9.933
  559   1HB   GLN  73          1HB       GLN  73   3.915 -11.794  -7.007
  560   2HB   GLN  73          2HB       GLN  73   3.039 -12.780  -8.166
  561   1HG   GLN  73          1HG       GLN  73   5.952 -12.094  -8.434
  562   2HG   GLN  73          2HG       GLN  73   5.359 -13.539  -7.624
  563   1HE2  GLN  73          2HE2      GLN  73   3.862 -12.196 -10.506
  564   2HE2  GLN  73          1HE2      GLN  73   4.313 -13.486 -11.569
  565    H    ASN  74           H        ASN  74   3.032  -9.303  -6.955
  566    HA   ASN  74           HA       ASN  74   0.162  -9.656  -7.150
  567   1HB   ASN  74          1HB       ASN  74   1.812  -7.996  -5.233
  568   2HB   ASN  74          2HB       ASN  74   0.078  -8.265  -5.106
  569   1HD2  ASN  74          2HD2      ASN  74   2.241  -8.916  -3.257
  570   2HD2  ASN  74          1HD2      ASN  74   2.134 -10.621  -2.976
  571    H    GLY  75           H        GLY  75   2.535  -7.214  -7.906
  572   1HA   GLY  75          1HA       GLY  75   2.166  -5.307  -9.247
  573   2HA   GLY  75          2HA       GLY  75   0.436  -5.467  -8.958
  574    H    TYR  76           H        TYR  76   1.673  -5.994  -6.073
  575    HA   TYR  76           HA       TYR  76   2.292  -3.344  -5.174
  576   1HB   TYR  76          1HB       TYR  76   0.323  -3.138  -3.687
  577   2HB   TYR  76          2HB       TYR  76  -0.136  -3.125  -5.387
  578    HD1  TYR  76           HD1      TYR  76  -0.338  -4.947  -2.231
  579    HD2  TYR  76           HD2      TYR  76  -1.328  -5.038  -6.367
  580    HE1  TYR  76           HE1      TYR  76  -1.933  -6.766  -1.804
  581    HE2  TYR  76           HE2      TYR  76  -2.925  -6.859  -5.948
  582    HH   TYR  76           HH       TYR  76  -3.937  -7.735  -2.824
  583    H    PHE  77           H        PHE  77   2.484  -3.367  -2.711
  584    HA   PHE  77           HA       PHE  77   2.690  -6.034  -1.560
  585   1HB   PHE  77          1HB       PHE  77   4.937  -5.564  -2.482
  586   2HB   PHE  77          2HB       PHE  77   5.010  -4.089  -1.524
  587    HD1  PHE  77           HD1      PHE  77   4.665  -7.775  -1.220
  588    HD2  PHE  77           HD2      PHE  77   5.863  -4.139   0.640
  589    HE1  PHE  77           HE1      PHE  77   5.615  -9.053   0.655
  590    HE2  PHE  77           HE2      PHE  77   6.815  -5.410   2.520
  591    HZ   PHE  77           HZ       PHE  77   6.693  -7.869   2.530
  592    H    ILE  78           H        ILE  78   1.775  -6.027   0.356
  593    HA   ILE  78           HA       ILE  78   1.624  -3.511   1.872
  594    HB   ILE  78           HB       ILE  78  -0.096  -5.981   1.872
  595   1HG1  ILE  78          1HG1      ILE  78  -1.926  -4.293   1.883
  596   2HG1  ILE  78          2HG1      ILE  78  -0.715  -3.018   1.845
  597   1HG2  ILE  78          1HG2      ILE  78   0.482  -5.702   4.201
  598   2HG2  ILE  78          2HG2      ILE  78   0.067  -3.989   4.131
  599   3HG2  ILE  78          3HG2      ILE  78  -1.191  -5.210   3.942
  600   1HD1  ILE  78          1HD1      ILE  78  -1.649  -3.387  -0.349
  601   2HD1  ILE  78          2HD1      ILE  78   0.055  -3.842  -0.329
  602   3HD1  ILE  78          3HD1      ILE  78  -1.191  -5.089  -0.282
  603    H    TYR  79           H        TYR  79   3.275  -3.330   3.242
  604    HA   TYR  79           HA       TYR  79   4.328  -5.712   4.550
  605   1HB   TYR  79          1HB       TYR  79   5.998  -4.134   3.784
  606   2HB   TYR  79          2HB       TYR  79   5.215  -2.821   4.659
  607    HD1  TYR  79           HD1      TYR  79   6.026  -2.248   6.754
  608    HD2  TYR  79           HD2      TYR  79   6.742  -6.173   5.282
  609    HE1  TYR  79           HE1      TYR  79   7.387  -2.737   8.741
  610    HE2  TYR  79           HE2      TYR  79   8.109  -6.672   7.263
  611    HH   TYR  79           HH       TYR  79   8.148  -4.659  10.019
  612    H    LYS  80           H        LYS  80   3.489  -6.399   6.361
  613    HA   LYS  80           HA       LYS  80   1.629  -4.872   7.885
  614   1HB   LYS  80          1HB       LYS  80   3.057  -7.438   8.621
  615   2HB   LYS  80          2HB       LYS  80   1.636  -6.783   9.423
  616   1HG   LYS  80          1HG       LYS  80   0.318  -7.096   7.414
  617   2HG   LYS  80          2HG       LYS  80   1.742  -7.670   6.545
  618   1HD   LYS  80          1HD       LYS  80   1.916  -9.554   8.117
  619   2HD   LYS  80          2HD       LYS  80   0.462  -8.987   8.939
  620   1HE   LYS  80          1HE       LYS  80  -0.798  -9.264   6.836
  621   2HE   LYS  80          2HE       LYS  80   0.657  -9.901   6.071
  622   1HZ   LYS  80          1HZ       LYS  80  -0.759 -11.102   8.393
  623   2HZ   LYS  80          2HZ       LYS  80  -0.792 -11.685   6.804
  624   3HZ   LYS  80          3HZ       LYS  80   0.657 -11.713   7.685
  625    H    MET  81           H        MET  81   2.735  -2.996   8.450
  626    HA   MET  81           HA       MET  81   5.199  -2.848   9.766
  627   1HB   MET  81          1HB       MET  81   4.065  -0.915   8.722
  628   2HB   MET  81          2HB       MET  81   2.840  -0.960   9.981
  629   1HG   MET  81          1HG       MET  81   4.687  -0.582  11.643
  630   2HG   MET  81          2HG       MET  81   5.756  -0.291  10.272
  631   1HE   MET  81          1HE       MET  81   3.779   1.206   8.242
  632   2HE   MET  81          2HE       MET  81   5.432   1.736   8.550
  633   3HE   MET  81          3HE       MET  81   4.103   2.891   8.649
  634    H    GLU  82           H        GLU  82   1.998  -2.335  11.225
  635    HA   GLU  82           HA       GLU  82   2.384  -4.156  13.343
  636   1HB   GLU  82          1HB       GLU  82   2.526  -2.523  15.206
  637   2HB   GLU  82          2HB       GLU  82   3.969  -2.543  14.202
  638   1HG   GLU  82          1HG       GLU  82   3.146  -0.539  13.034
  639   2HG   GLU  82          2HG       GLU  82   1.762  -0.501  14.125
  640    H    GLY  83           H        GLY  83   0.610  -3.962  14.973
  641   1HA   GLY  83          1HA       GLY  83  -1.622  -3.690  15.479
  642   2HA   GLY  83          2HA       GLY  83  -1.658  -2.322  14.371
  643    H    CYS  84           H        CYS  84  -0.454  -5.313  13.219
  644    HA   CYS  84           HA       CYS  84  -2.934  -5.722  11.687
  645   1HB   CYS  84          1HB       CYS  84  -0.105  -6.032  10.652
  646   2HB   CYS  84          2HB       CYS  84  -1.585  -6.256   9.727
  647    HG   CYS  84           HG       CYS  84  -0.720  -3.250  11.117
  648    H    ASN  85           H        ASN  85  -2.726  -7.985  10.533
  649    HA   ASN  85           HA       ASN  85  -1.719  -9.915  12.515
  650   1HB   ASN  85          1HB       ASN  85  -4.311  -9.790  11.033
  651   2HB   ASN  85          2HB       ASN  85  -3.630 -11.372  11.383
  652   1HD2  ASN  85          2HD2      ASN  85  -2.980  -8.790  13.573
  653   2HD2  ASN  85          1HD2      ASN  85  -4.049  -9.310  14.835
  Start of MODEL   10
    1    H    MET   1           H        MET   1  15.189   0.082  -8.979
    2    HA   MET   1           HA       MET   1  13.020   0.069  -9.939
    3   1HB   MET   1          1HB       MET   1  12.610  -2.366  -9.390
    4   2HB   MET   1          2HB       MET   1  12.257  -1.867  -7.742
    5   1HG   MET   1          1HG       MET   1  10.429  -0.449  -8.600
    6   2HG   MET   1          2HG       MET   1  10.754  -1.060 -10.221
    7   1HE   MET   1          1HE       MET   1  10.675  -2.847  -6.685
    8   2HE   MET   1          2HE       MET   1   9.040  -3.504  -6.714
    9   3HE   MET   1          3HE       MET   1   9.289  -1.758  -6.709
   10    H    GLN   2           H        GLN   2  11.589   1.641  -9.223
   11    HA   GLN   2           HA       GLN   2  12.265   2.822  -6.641
   12   1HB   GLN   2          1HB       GLN   2  11.042   4.769  -7.385
   13   2HB   GLN   2          2HB       GLN   2  12.125   4.258  -8.672
   14   1HG   GLN   2          1HG       GLN   2  10.221   3.145  -9.784
   15   2HG   GLN   2          2HG       GLN   2   9.158   3.762  -8.521
   16   1HE2  GLN   2          2HE2      GLN   2   9.035   4.238 -11.358
   17   2HE2  GLN   2          1HE2      GLN   2   9.185   5.949 -11.585
   18    H    ILE   3           H        ILE   3  10.962   2.730  -4.887
   19    HA   ILE   3           HA       ILE   3   8.311   1.525  -5.307
   20    HB   ILE   3           HB       ILE   3   8.415   1.174  -2.750
   21   1HG1  ILE   3          1HG1      ILE   3  11.358   1.427  -3.401
   22   2HG1  ILE   3          2HG1      ILE   3  10.438   2.468  -2.320
   23   1HG2  ILE   3          1HG2      ILE   3  10.009  -0.446  -4.714
   24   2HG2  ILE   3          2HG2      ILE   3   9.565  -1.001  -3.099
   25   3HG2  ILE   3          3HG2      ILE   3   8.311  -0.639  -4.284
   26   1HD1  ILE   3          1HD1      ILE   3  11.759   0.905  -1.051
   27   2HD1  ILE   3          2HD1      ILE   3  10.044   0.541  -0.844
   28   3HD1  ILE   3          3HD1      ILE   3  11.037  -0.454  -1.914
   29    H    HIS   4           H        HIS   4   6.604   2.680  -5.024
   30    HA   HIS   4           HA       HIS   4   6.802   5.321  -3.822
   31   1HB   HIS   4          1HB       HIS   4   4.452   3.919  -5.127
   32   2HB   HIS   4          2HB       HIS   4   4.481   5.601  -4.612
   33    HD1  HIS   4           HD1      HIS   4   3.971   4.710  -7.570
   34    HD2  HIS   4           HD2      HIS   4   7.630   5.914  -6.027
   35    HE1  HIS   4           HE1      HIS   4   5.299   5.539  -9.539
   36    HE2  HIS   4           HE2      HIS   4   7.375   6.537  -8.518
   37    H    VAL   5           H        VAL   5   6.744   5.331  -1.682
   38    HA   VAL   5           HA       VAL   5   5.446   3.215  -0.216
   39    HB   VAL   5           HB       VAL   5   6.722   5.721   0.886
   40   1HG1  VAL   5          1HG1      VAL   5   6.996   4.379   2.920
   41   2HG1  VAL   5          2HG1      VAL   5   5.299   4.550   2.470
   42   3HG1  VAL   5          3HG1      VAL   5   6.150   3.040   2.143
   43   1HG2  VAL   5          1HG2      VAL   5   7.985   3.036   0.342
   44   2HG2  VAL   5          2HG2      VAL   5   8.325   4.539  -0.516
   45   3HG2  VAL   5          3HG2      VAL   5   8.753   4.381   1.188
   46    H    TYR   6           H        TYR   6   3.269   3.319  -0.280
   47    HA   TYR   6           HA       TYR   6   1.958   5.875   0.235
   48   1HB   TYR   6          1HB       TYR   6   1.027   3.224  -0.800
   49   2HB   TYR   6          2HB       TYR   6  -0.141   4.332  -0.088
   50    HD1  TYR   6           HD1      TYR   6   2.427   4.055  -2.764
   51    HD2  TYR   6           HD2      TYR   6  -0.996   6.128  -1.320
   52    HE1  TYR   6           HE1      TYR   6   2.273   5.275  -4.894
   53    HE2  TYR   6           HE2      TYR   6  -1.158   7.354  -3.444
   54    HH   TYR   6           HH       TYR   6   0.076   7.954  -5.323
   55    H    ASP   7           H        ASP   7   1.953   6.389   2.292
   56    HA   ASP   7           HA       ASP   7   1.757   4.533   4.449
   57   1HB   ASP   7          1HB       ASP   7   2.817   6.828   4.564
   58   2HB   ASP   7          2HB       ASP   7   1.197   7.506   4.504
   59    H    THR   8           H        THR   8  -0.057   3.362   4.576
   60    HA   THR   8           HA       THR   8  -2.612   4.703   4.073
   61    HB   THR   8           HB       THR   8  -2.126   1.730   4.273
   62    HG1  THR   8           HG1      THR   8  -0.946   2.900   2.537
   63   1HG2  THR   8          1HG2      THR   8  -4.240   1.594   3.027
   64   2HG2  THR   8          2HG2      THR   8  -4.456   2.444   4.558
   65   3HG2  THR   8          3HG2      THR   8  -4.367   3.353   3.050
   66    H    TYR   9           H        TYR   9  -3.211   5.612   5.956
   67    HA   TYR   9           HA       TYR   9  -3.055   4.151   8.454
   68   1HB   TYR   9          1HB       TYR   9  -4.546   6.727   7.904
   69   2HB   TYR   9          2HB       TYR   9  -4.063   6.097   9.470
   70    HD1  TYR   9           HD1      TYR   9  -1.488   5.869   9.863
   71    HD2  TYR   9           HD2      TYR   9  -3.238   8.289   6.834
   72    HE1  TYR   9           HE1      TYR   9   0.571   7.210   9.747
   73    HE2  TYR   9           HE2      TYR   9  -1.186   9.629   6.705
   74    HH   TYR   9           HH       TYR   9   1.712   8.655   7.943
   75    H    VAL  10           H        VAL  10  -4.441   2.457   8.605
   76    HA   VAL  10           HA       VAL  10  -7.204   2.907   7.698
   77    HB   VAL  10           HB       VAL  10  -5.753   0.305   8.232
   78   1HG1  VAL  10          1HG1      VAL  10  -8.107   0.128   8.852
   79   2HG1  VAL  10          2HG1      VAL  10  -8.578   0.769   7.278
   80   3HG1  VAL  10          3HG1      VAL  10  -7.771  -0.795   7.387
   81   1HG2  VAL  10          1HG2      VAL  10  -5.070   1.391   6.163
   82   2HG2  VAL  10          2HG2      VAL  10  -6.023  -0.052   5.821
   83   3HG2  VAL  10          3HG2      VAL  10  -6.757   1.545   5.671
   84    H    LYS  11           H        LYS  11  -8.447   3.582   9.251
   85    HA   LYS  11           HA       LYS  11  -7.827   3.130  12.016
   86   1HB   LYS  11          1HB       LYS  11 -10.323   4.380  10.859
   87   2HB   LYS  11          2HB       LYS  11  -9.696   4.565  12.491
   88   1HG   LYS  11          1HG       LYS  11  -7.773   5.778  11.637
   89   2HG   LYS  11          2HG       LYS  11  -8.363   5.567   9.986
   90   1HD   LYS  11          1HD       LYS  11 -10.462   6.756  10.705
   91   2HD   LYS  11          2HD       LYS  11  -9.635   7.139  12.215
   92   1HE   LYS  11          1HE       LYS  11  -8.713   7.914   9.453
   93   2HE   LYS  11          2HE       LYS  11  -9.503   8.982  10.612
   94   1HZ   LYS  11          1HZ       LYS  11  -6.845   7.700  10.904
   95   2HZ   LYS  11          2HZ       LYS  11  -7.163   9.345  10.680
   96   3HZ   LYS  11          3HZ       LYS  11  -7.610   8.581  12.129
   97    H    ALA  12           H        ALA  12  -8.102   1.045  12.594
   98    HA   ALA  12           HA       ALA  12 -10.225  -0.621  11.797
   99   1HB   ALA  12          1HB       ALA  12  -8.180  -1.499  12.808
  100   2HB   ALA  12          2HB       ALA  12  -8.586  -0.714  14.333
  101   3HB   ALA  12          3HB       ALA  12  -9.601  -2.018  13.714
  102    H    LYS  13           H        LYS  13 -12.178  -1.091  12.800
  103    HA   LYS  13           HA       LYS  13 -13.536   1.112  13.911
  104   1HB   LYS  13          1HB       LYS  13 -14.395  -1.786  13.968
  105   2HB   LYS  13          2HB       LYS  13 -15.435  -0.369  14.057
  106   1HG   LYS  13          1HG       LYS  13 -14.893   0.235  11.795
  107   2HG   LYS  13          2HG       LYS  13 -13.709  -1.066  11.691
  108   1HD   LYS  13          1HD       LYS  13 -15.642  -1.841  10.573
  109   2HD   LYS  13          2HD       LYS  13 -15.614  -2.664  12.131
  110   1HE   LYS  13          1HE       LYS  13 -17.214  -1.008  13.005
  111   2HE   LYS  13          2HE       LYS  13 -17.273  -0.251  11.412
  112   1HZ   LYS  13          1HZ       LYS  13 -18.153  -2.990  12.133
  113   2HZ   LYS  13          2HZ       LYS  13 -19.126  -1.705  11.606
  114   3HZ   LYS  13          3HZ       LYS  13 -18.030  -2.436  10.535
  115    H    ASP  14           H        ASP  14 -11.707  -1.436  15.278
  116    HA   ASP  14           HA       ASP  14 -12.536  -1.397  17.953
  117   1HB   ASP  14          1HB       ASP  14 -10.970  -3.056  17.118
  118   2HB   ASP  14          2HB       ASP  14  -9.788  -1.805  16.754
  119    H    GLY  15           H        GLY  15 -10.865   0.969  16.086
  120   1HA   GLY  15          1HA       GLY  15 -10.385   3.171  16.798
  121   2HA   GLY  15          2HA       GLY  15 -10.454   2.622  18.469
  122    H    HIS  16           H        HIS  16  -8.664   1.356  15.701
  123    HA   HIS  16           HA       HIS  16  -6.134   2.003  17.044
  124   1HB   HIS  16          1HB       HIS  16  -7.077  -0.452  17.374
  125   2HB   HIS  16          2HB       HIS  16  -6.462  -0.675  15.741
  126    HD1  HIS  16           HD1      HIS  16  -5.355  -0.089  19.262
  127    HD2  HIS  16           HD2      HIS  16  -3.681  -0.807  15.525
  128    HE1  HIS  16           HE1      HIS  16  -2.936  -0.619  19.693
  129    HE2  HIS  16           HE2      HIS  16  -2.021  -1.307  17.449
  130    H    VAL  17           H        VAL  17  -4.470   2.481  15.600
  131    HA   VAL  17           HA       VAL  17  -5.430   2.933  12.875
  132    HB   VAL  17           HB       VAL  17  -2.900   3.989  14.148
  133   1HG1  VAL  17          1HG1      VAL  17  -2.862   3.940  11.701
  134   2HG1  VAL  17          2HG1      VAL  17  -4.380   4.838  11.658
  135   3HG1  VAL  17          3HG1      VAL  17  -2.926   5.595  12.308
  136   1HG2  VAL  17          1HG2      VAL  17  -4.860   4.797  15.358
  137   2HG2  VAL  17          2HG2      VAL  17  -4.118   6.099  14.427
  138   3HG2  VAL  17          3HG2      VAL  17  -5.591   5.325  13.842
  139    H    MET  18           H        MET  18  -5.102   1.295  11.571
  140    HA   MET  18           HA       MET  18  -2.766  -0.405  11.762
  141   1HB   MET  18          1HB       MET  18  -5.107  -0.333   9.847
  142   2HB   MET  18          2HB       MET  18  -3.797  -1.501   9.735
  143   1HG   MET  18          1HG       MET  18  -5.389  -1.213  12.250
  144   2HG   MET  18          2HG       MET  18  -5.981  -2.181  10.902
  145   1HE   MET  18          1HE       MET  18  -4.860  -4.383  10.038
  146   2HE   MET  18          2HE       MET  18  -3.280  -4.955  10.571
  147   3HE   MET  18          3HE       MET  18  -3.413  -3.445   9.668
  148    H    HIS  19           H        HIS  19  -0.938   0.665  11.145
  149    HA   HIS  19           HA       HIS  19  -1.003   2.061   8.568
  150   1HB   HIS  19          1HB       HIS  19  -0.039   3.398  10.357
  151   2HB   HIS  19          2HB       HIS  19   1.088   2.111  10.761
  152    HD1  HIS  19           HD1      HIS  19   2.503   4.602  10.283
  153    HD2  HIS  19           HD2      HIS  19   1.351   2.210   7.076
  154    HE1  HIS  19           HE1      HIS  19   4.077   5.167   8.404
  155    HE2  HIS  19           HE2      HIS  19   3.442   3.620   6.512
  156    H    PHE  20           H        PHE  20  -0.847   0.550   7.072
  157    HA   PHE  20           HA       PHE  20   1.658  -0.980   7.060
  158   1HB   PHE  20          1HB       PHE  20   0.566  -2.544   5.458
  159   2HB   PHE  20          2HB       PHE  20  -0.178  -2.557   7.048
  160    HD1  PHE  20           HD1      PHE  20  -0.604  -1.615   3.533
  161    HD2  PHE  20           HD2      PHE  20  -2.426  -1.793   7.373
  162    HE1  PHE  20           HE1      PHE  20  -2.805  -1.250   2.501
  163    HE2  PHE  20           HE2      PHE  20  -4.629  -1.425   6.348
  164    HZ   PHE  20           HZ       PHE  20  -4.820  -1.156   3.910
  165    H    ASP  21           H        ASP  21   2.927  -0.808   5.219
  166    HA   ASP  21           HA       ASP  21   2.289   1.598   3.682
  167   1HB   ASP  21          1HB       ASP  21   4.904   0.115   4.022
  168   2HB   ASP  21          2HB       ASP  21   4.694   1.558   3.037
  169    H    VAL  22           H        VAL  22   1.483   1.411   1.751
  170    HA   VAL  22           HA       VAL  22   1.580  -1.126   0.351
  171    HB   VAL  22           HB       VAL  22   0.293   1.474  -0.513
  172   1HG1  VAL  22          1HG1      VAL  22  -1.001   0.065  -2.043
  173   2HG1  VAL  22          2HG1      VAL  22   0.728  -0.046  -2.369
  174   3HG1  VAL  22          3HG1      VAL  22  -0.093  -1.349  -1.510
  175   1HG2  VAL  22          1HG2      VAL  22  -0.924  -0.912   0.875
  176   2HG2  VAL  22          2HG2      VAL  22  -0.671   0.685   1.578
  177   3HG2  VAL  22          3HG2      VAL  22  -1.813   0.477   0.251
  178    H    PHE  23           H        PHE  23   3.536  -1.488  -0.519
  179    HA   PHE  23           HA       PHE  23   4.991   0.642  -1.833
  180   1HB   PHE  23          1HB       PHE  23   5.592  -2.306  -1.507
  181   2HB   PHE  23          2HB       PHE  23   6.664  -1.164  -2.309
  182    HD1  PHE  23           HD1      PHE  23   7.632   0.727  -0.988
  183    HD2  PHE  23           HD2      PHE  23   5.569  -2.516   0.834
  184    HE1  PHE  23           HE1      PHE  23   8.659   1.295   1.174
  185    HE2  PHE  23           HE2      PHE  23   6.592  -1.955   3.001
  186    HZ   PHE  23           HZ       PHE  23   8.139  -0.047   3.172
  187    H    THR  24           H        THR  24   4.514   1.232  -3.815
  188    HA   THR  24           HA       THR  24   3.767  -0.839  -5.764
  189    HB   THR  24           HB       THR  24   2.276   0.967  -6.813
  190    HG1  THR  24           HG1      THR  24   2.320   1.995  -4.155
  191   1HG2  THR  24          1HG2      THR  24   1.360  -1.019  -5.733
  192   2HG2  THR  24          2HG2      THR  24   1.490  -0.237  -4.156
  193   3HG2  THR  24          3HG2      THR  24   0.372   0.396  -5.365
  194    H    ASP  25           H        ASP  25   4.582  -0.576  -7.817
  195    HA   ASP  25           HA       ASP  25   6.595   1.491  -8.208
  196   1HB   ASP  25          1HB       ASP  25   7.179  -0.748  -8.928
  197   2HB   ASP  25          2HB       ASP  25   5.719  -0.868  -9.901
  198    H    VAL  26           H        VAL  26   3.349   0.764  -9.050
  199    HA   VAL  26           HA       VAL  26   3.073   2.524 -11.272
  200    HB   VAL  26           HB       VAL  26   0.901   1.604  -9.378
  201   1HG1  VAL  26          1HG1      VAL  26   0.787   2.494 -12.255
  202   2HG1  VAL  26          2HG1      VAL  26  -0.577   1.904 -11.306
  203   3HG1  VAL  26          3HG1      VAL  26   0.224   3.411 -10.858
  204   1HG2  VAL  26          1HG2      VAL  26   0.527  -0.264 -10.909
  205   2HG2  VAL  26          2HG2      VAL  26   1.928   0.234 -11.861
  206   3HG2  VAL  26          3HG2      VAL  26   2.144  -0.327 -10.203
  207    H    ARG  27           H        ARG  27   2.313   4.645 -11.311
  208    HA   ARG  27           HA       ARG  27   2.588   6.076  -8.771
  209   1HB   ARG  27          1HB       ARG  27   2.769   8.105 -10.236
  210   2HB   ARG  27          2HB       ARG  27   4.054   6.924 -10.436
  211   1HG   ARG  27          1HG       ARG  27   3.012   6.102 -12.470
  212   2HG   ARG  27          2HG       ARG  27   1.675   7.237 -12.257
  213   1HD   ARG  27          1HD       ARG  27   3.202   9.113 -12.472
  214   2HD   ARG  27          2HD       ARG  27   4.571   8.009 -12.601
  215    HE   ARG  27           HE       ARG  27   3.741   7.312 -14.742
  216   1HH1  ARG  27          1HH1      ARG  27   2.215  10.148 -13.369
  217   2HH1  ARG  27          2HH1      ARG  27   1.584  10.716 -14.887
  218   1HH2  ARG  27          1HH2      ARG  27   2.963   8.083 -16.766
  219   2HH2  ARG  27          2HH2      ARG  27   2.011   9.539 -16.822
  220    H    ASP  28           H        ASP  28   0.207   4.648  -9.238
  221    HA   ASP  28           HA       ASP  28  -1.760   6.781  -9.730
  222   1HB   ASP  28          1HB       ASP  28  -1.944   4.658 -11.084
  223   2HB   ASP  28          2HB       ASP  28  -2.280   3.804  -9.582
  224    H    ASP  29           H        ASP  29  -2.713   7.636  -8.018
  225    HA   ASP  29           HA       ASP  29  -1.958   6.759  -5.414
  226   1HB   ASP  29          1HB       ASP  29  -3.911   8.916  -6.239
  227   2HB   ASP  29          2HB       ASP  29  -3.288   8.671  -4.610
  228    H    LYS  30           H        LYS  30  -5.017   6.726  -7.223
  229    HA   LYS  30           HA       LYS  30  -6.479   5.856  -4.915
  230   1HB   LYS  30          1HB       LYS  30  -8.398   6.065  -6.162
  231   2HB   LYS  30          2HB       LYS  30  -7.339   7.190  -6.992
  232   1HG   LYS  30          1HG       LYS  30  -6.878   5.485  -8.691
  233   2HG   LYS  30          2HG       LYS  30  -7.979   4.381  -7.862
  234   1HD   LYS  30          1HD       LYS  30  -9.741   6.198  -8.124
  235   2HD   LYS  30          2HD       LYS  30  -8.622   6.967  -9.252
  236   1HE   LYS  30          1HE       LYS  30 -10.188   5.628 -10.491
  237   2HE   LYS  30          2HE       LYS  30  -8.595   4.880 -10.578
  238   1HZ   LYS  30          1HZ       LYS  30 -10.729   4.054  -8.684
  239   2HZ   LYS  30          2HZ       LYS  30 -10.413   3.287 -10.160
  240   3HZ   LYS  30          3HZ       LYS  30  -9.245   3.275  -8.932
  241    H    LYS  31           H        LYS  31  -4.873   4.303  -7.600
  242    HA   LYS  31           HA       LYS  31  -5.935   1.730  -7.378
  243   1HB   LYS  31          1HB       LYS  31  -3.280   2.807  -8.230
  244   2HB   LYS  31          2HB       LYS  31  -3.460   1.074  -8.008
  245   1HG   LYS  31          1HG       LYS  31  -5.216   2.733  -9.800
  246   2HG   LYS  31          2HG       LYS  31  -3.785   1.856 -10.343
  247   1HD   LYS  31          1HD       LYS  31  -4.820  -0.234  -9.450
  248   2HD   LYS  31          2HD       LYS  31  -6.287   0.695  -9.130
  249   1HE   LYS  31          1HE       LYS  31  -4.992   0.395 -11.836
  250   2HE   LYS  31          2HE       LYS  31  -6.355  -0.565 -11.263
  251   1HZ   LYS  31          1HZ       LYS  31  -7.654   1.464 -11.065
  252   2HZ   LYS  31          2HZ       LYS  31  -6.346   2.390 -11.623
  253   3HZ   LYS  31          3HZ       LYS  31  -7.093   1.263 -12.645
  254    H    ALA  32           H        ALA  32  -3.243   3.229  -5.626
  255    HA   ALA  32           HA       ALA  32  -2.545   1.016  -4.054
  256   1HB   ALA  32          1HB       ALA  32  -1.421   2.604  -2.604
  257   2HB   ALA  32          2HB       ALA  32  -1.147   3.022  -4.297
  258   3HB   ALA  32          3HB       ALA  32  -2.313   3.937  -3.339
  259    H    ILE  33           H        ILE  33  -4.917   3.573  -3.569
  260    HA   ILE  33           HA       ILE  33  -5.747   2.860  -0.975
  261    HB   ILE  33           HB       ILE  33  -7.386   4.150  -3.166
  262   1HG1  ILE  33          1HG1      ILE  33  -5.758   5.430  -0.957
  263   2HG1  ILE  33          2HG1      ILE  33  -5.273   5.350  -2.646
  264   1HG2  ILE  33          1HG2      ILE  33  -8.741   5.051  -1.337
  265   2HG2  ILE  33          2HG2      ILE  33  -8.767   3.288  -1.355
  266   3HG2  ILE  33          3HG2      ILE  33  -7.774   4.142  -0.175
  267   1HD1  ILE  33          1HD1      ILE  33  -6.177   7.529  -2.095
  268   2HD1  ILE  33          2HD1      ILE  33  -7.209   6.703  -3.262
  269   3HD1  ILE  33          3HD1      ILE  33  -7.686   6.786  -1.566
  270    H    GLU  34           H        GLU  34  -6.966   1.920  -4.184
  271    HA   GLU  34           HA       GLU  34  -9.045   0.263  -3.252
  272   1HB   GLU  34          1HB       GLU  34  -7.507   0.165  -5.850
  273   2HB   GLU  34          2HB       GLU  34  -8.963  -0.767  -5.521
  274   1HG   GLU  34          1HG       GLU  34 -10.204   1.330  -5.192
  275   2HG   GLU  34          2HG       GLU  34  -8.744   2.238  -5.584
  276    H    PHE  35           H        PHE  35  -5.642  -0.383  -3.945
  277    HA   PHE  35           HA       PHE  35  -5.745  -3.179  -3.634
  278   1HB   PHE  35          1HB       PHE  35  -3.479  -1.244  -3.124
  279   2HB   PHE  35          2HB       PHE  35  -3.300  -2.995  -3.104
  280    HD1  PHE  35           HD1      PHE  35  -5.152  -3.589  -5.437
  281    HD2  PHE  35           HD2      PHE  35  -2.038  -0.733  -4.917
  282    HE1  PHE  35           HE1      PHE  35  -4.753  -3.586  -7.865
  283    HE2  PHE  35           HE2      PHE  35  -1.638  -0.723  -7.343
  284    HZ   PHE  35           HZ       PHE  35  -2.996  -2.150  -8.820
  285    H    ALA  36           H        ALA  36  -5.265  -0.563  -1.308
  286    HA   ALA  36           HA       ALA  36  -4.843  -2.165   0.966
  287   1HB   ALA  36          1HB       ALA  36  -5.439  -0.178   2.254
  288   2HB   ALA  36          2HB       ALA  36  -4.359   0.231   0.922
  289   3HB   ALA  36          3HB       ALA  36  -6.083   0.580   0.797
  290    H    LYS  37           H        LYS  37  -7.805  -0.777  -0.419
  291    HA   LYS  37           HA       LYS  37  -9.552  -1.845   1.543
  292   1HB   LYS  37          1HB       LYS  37 -10.129  -1.010  -1.305
  293   2HB   LYS  37          2HB       LYS  37 -11.349  -1.333  -0.080
  294   1HG   LYS  37          1HG       LYS  37 -10.410   0.508   1.279
  295   2HG   LYS  37          2HG       LYS  37  -9.287   0.861  -0.034
  296   1HD   LYS  37          1HD       LYS  37 -11.180   2.358  -0.164
  297   2HD   LYS  37          2HD       LYS  37 -11.215   1.245  -1.532
  298   1HE   LYS  37          1HE       LYS  37 -12.884  -0.115  -0.412
  299   2HE   LYS  37          2HE       LYS  37 -12.809   0.926   1.008
  300   1HZ   LYS  37          1HZ       LYS  37 -14.707   1.522  -0.277
  301   2HZ   LYS  37          2HZ       LYS  37 -13.571   2.773  -0.424
  302   3HZ   LYS  37          3HZ       LYS  37 -13.787   1.669  -1.697
  303    H    GLN  38           H        GLN  38  -8.227  -3.088  -1.434
  304    HA   GLN  38           HA       GLN  38  -9.926  -5.337  -1.712
  305   1HB   GLN  38          1HB       GLN  38  -8.138  -4.245  -3.331
  306   2HB   GLN  38          2HB       GLN  38  -7.067  -5.421  -2.584
  307   1HG   GLN  38          1HG       GLN  38  -8.596  -7.216  -3.267
  308   2HG   GLN  38          2HG       GLN  38  -9.620  -6.015  -4.055
  309   1HE2  GLN  38          2HE2      GLN  38  -6.627  -7.758  -4.179
  310   2HE2  GLN  38          1HE2      GLN  38  -6.208  -7.318  -5.797
  311    H    TRP  39           H        TRP  39  -6.900  -4.756  -0.020
  312    HA   TRP  39           HA       TRP  39  -6.540  -7.380   0.979
  313   1HB   TRP  39          1HB       TRP  39  -4.734  -5.717   0.933
  314   2HB   TRP  39          2HB       TRP  39  -5.608  -4.717   2.085
  315    HD1  TRP  39           HD1      TRP  39  -3.840  -8.153   1.909
  316    HE1  TRP  39           HE1      TRP  39  -2.979  -8.730   4.269
  317    HE3  TRP  39           HE3      TRP  39  -5.824  -4.207   4.485
  318    HZ2  TRP  39           HZ2      TRP  39  -3.124  -7.654   6.869
  319    HZ3  TRP  39           HZ3      TRP  39  -5.414  -4.056   6.907
  320    HH2  TRP  39           HH2      TRP  39  -4.092  -5.744   8.073
  321    H    LEU  40           H        LEU  40  -8.181  -4.501   2.230
  322    HA   LEU  40           HA       LEU  40  -9.002  -5.575   4.697
  323   1HB   LEU  40          1HB       LEU  40 -10.317  -3.484   2.963
  324   2HB   LEU  40          2HB       LEU  40 -10.784  -3.834   4.615
  325    HG   LEU  40           HG       LEU  40  -8.082  -2.791   3.759
  326   1HD1  LEU  40          1HD1      LEU  40 -10.389  -1.401   5.113
  327   2HD1  LEU  40          2HD1      LEU  40  -8.799  -0.704   4.804
  328   3HD1  LEU  40          3HD1      LEU  40  -9.848  -1.138   3.455
  329   1HD2  LEU  40          1HD2      LEU  40  -9.267  -3.207   6.502
  330   2HD2  LEU  40          2HD2      LEU  40  -7.978  -4.167   5.776
  331   3HD2  LEU  40          3HD2      LEU  40  -7.707  -2.465   6.151
  332    H    SER  41           H        SER  41 -10.232  -5.963   1.470
  333    HA   SER  41           HA       SER  41 -12.769  -7.021   2.247
  334   1HB   SER  41          1HB       SER  41 -12.274  -5.934   0.025
  335   2HB   SER  41          2HB       SER  41 -11.361  -7.378  -0.407
  336    HG   SER  41           HG       SER  41 -14.109  -7.354   0.354
  337    H    SER  42           H        SER  42  -9.613  -8.384   1.491
  338    HA   SER  42           HA       SER  42 -10.612 -11.077   1.430
  339   1HB   SER  42          1HB       SER  42  -8.027 -11.530   1.425
  340   2HB   SER  42          2HB       SER  42  -8.817 -10.856  -0.000
  341    HG   SER  42           HG       SER  42  -7.902  -8.950   0.362
  342    H    ILE  43           H        ILE  43  -9.310  -8.967   3.869
  343    HA   ILE  43           HA       ILE  43  -8.857 -11.169   5.708
  344    HB   ILE  43           HB       ILE  43  -8.291  -9.485   7.376
  345   1HG1  ILE  43          1HG1      ILE  43  -8.933  -7.430   5.250
  346   2HG1  ILE  43          2HG1      ILE  43  -9.948  -7.775   6.647
  347   1HG2  ILE  43          1HG2      ILE  43  -7.010  -8.958   4.701
  348   2HG2  ILE  43          2HG2      ILE  43  -6.326  -8.534   6.270
  349   3HG2  ILE  43          3HG2      ILE  43  -6.566 -10.228   5.841
  350   1HD1  ILE  43          1HD1      ILE  43  -7.133  -6.715   6.732
  351   2HD1  ILE  43          2HD1      ILE  43  -8.608  -5.780   6.990
  352   3HD1  ILE  43          3HD1      ILE  43  -8.156  -7.048   8.129
  353    H    GLY  44           H        GLY  44 -11.500  -9.466   4.621
  354   1HA   GLY  44          1HA       GLY  44 -13.715  -9.814   5.201
  355   2HA   GLY  44          2HA       GLY  44 -13.172 -10.720   6.604
  356    H    GLU  45           H        GLU  45 -12.347  -7.390   5.724
  357    HA   GLU  45           HA       GLU  45 -13.648  -6.521   8.215
  358   1HB   GLU  45          1HB       GLU  45 -11.108  -6.137   7.685
  359   2HB   GLU  45          2HB       GLU  45 -11.695  -4.830   6.677
  360   1HG   GLU  45          1HG       GLU  45 -12.171  -5.131   9.632
  361   2HG   GLU  45          2HG       GLU  45 -11.019  -4.038   8.871
  362    H    GLU  46           H        GLU  46 -12.802  -4.668   5.328
  363    HA   GLU  46           HA       GLU  46 -13.993  -3.494   3.800
  364   1HB   GLU  46          1HB       GLU  46 -16.208  -5.431   4.470
  365   2HB   GLU  46          2HB       GLU  46 -16.083  -4.452   3.014
  366   1HG   GLU  46          1HG       GLU  46 -14.091  -5.651   2.347
  367   2HG   GLU  46          2HG       GLU  46 -14.139  -6.598   3.833
  368    H    GLY  47           H        GLY  47 -14.162  -2.632   6.653
  369   1HA   GLY  47          1HA       GLY  47 -16.747  -1.203   6.467
  370   2HA   GLY  47          2HA       GLY  47 -16.019  -1.685   7.992
  371    H    ALA  48           H        ALA  48 -13.362  -0.958   7.398
  372    HA   ALA  48           HA       ALA  48 -13.370   1.728   8.207
  373   1HB   ALA  48          1HB       ALA  48 -11.104   0.160   6.986
  374   2HB   ALA  48          2HB       ALA  48 -10.956   1.648   7.923
  375   3HB   ALA  48          3HB       ALA  48 -11.545   0.175   8.694
  376    H    THR  49           H        THR  49 -13.714   3.517   7.105
  377    HA   THR  49           HA       THR  49 -13.772   3.569   4.243
  378    HB   THR  49           HB       THR  49 -13.973   5.879   6.190
  379    HG1  THR  49           HG1      THR  49 -15.921   4.125   5.067
  380   1HG2  THR  49          1HG2      THR  49 -13.469   6.578   3.896
  381   2HG2  THR  49          2HG2      THR  49 -14.834   5.632   3.303
  382   3HG2  THR  49          3HG2      THR  49 -15.115   7.026   4.346
  383    H    VAL  50           H        VAL  50 -11.954   3.595   3.105
  384    HA   VAL  50           HA       VAL  50  -9.682   5.187   4.110
  385    HB   VAL  50           HB       VAL  50  -9.582   2.810   2.241
  386   1HG1  VAL  50          1HG1      VAL  50  -7.795   4.403   1.813
  387   2HG1  VAL  50          2HG1      VAL  50  -7.367   4.407   3.524
  388   3HG1  VAL  50          3HG1      VAL  50  -7.153   2.943   2.565
  389   1HG2  VAL  50          1HG2      VAL  50 -10.178   2.132   4.505
  390   2HG2  VAL  50          2HG2      VAL  50  -8.538   1.619   4.110
  391   3HG2  VAL  50          3HG2      VAL  50  -8.797   3.022   5.147
  392    H    THR  51           H        THR  51  -9.313   6.984   3.019
  393    HA   THR  51           HA       THR  51  -9.679   6.967   0.099
  394    HB   THR  51           HB       THR  51 -10.434   9.330   0.206
  395    HG1  THR  51           HG1      THR  51 -10.050   8.872   2.948
  396   1HG2  THR  51          1HG2      THR  51 -12.092   7.552   0.009
  397   2HG2  THR  51          2HG2      THR  51 -12.157   7.403   1.765
  398   3HG2  THR  51          3HG2      THR  51 -12.716   8.882   0.987
  399    H    SER  52           H        SER  52  -8.775   9.642  -0.255
  400    HA   SER  52           HA       SER  52  -5.978   9.185  -0.254
  401   1HB   SER  52          1HB       SER  52  -5.999  11.661  -1.037
  402   2HB   SER  52          2HB       SER  52  -6.764  10.442  -2.057
  403    HG   SER  52           HG       SER  52  -7.861  12.614  -0.994
  404    H    GLU  53           H        GLU  53  -8.017  10.398   2.165
  405    HA   GLU  53           HA       GLU  53  -6.033  12.090   3.421
  406   1HB   GLU  53          1HB       GLU  53  -8.662  12.210   3.564
  407   2HB   GLU  53          2HB       GLU  53  -8.458  11.014   4.833
  408   1HG   GLU  53          1HG       GLU  53  -6.917  13.570   4.918
  409   2HG   GLU  53          2HG       GLU  53  -8.600  13.529   5.428
  410    H    GLU  54           H        GLU  54  -7.464   8.907   3.897
  411    HA   GLU  54           HA       GLU  54  -5.825   8.198   6.117
  412   1HB   GLU  54          1HB       GLU  54  -7.517   6.524   4.253
  413   2HB   GLU  54          2HB       GLU  54  -6.703   5.888   5.673
  414   1HG   GLU  54          1HG       GLU  54  -8.956   6.242   6.272
  415   2HG   GLU  54          2HG       GLU  54  -8.022   7.520   7.044
  416    H    CYS  55           H        CYS  55  -5.781   7.385   2.652
  417    HA   CYS  55           HA       CYS  55  -3.151   6.134   3.031
  418   1HB   CYS  55          1HB       CYS  55  -4.947   4.860   1.828
  419   2HB   CYS  55          2HB       CYS  55  -4.917   6.092   0.572
  420    HG   CYS  55           HG       CYS  55  -2.569   3.733   1.295
  421    H    ARG  56           H        ARG  56  -1.508   7.490   2.820
  422    HA   ARG  56           HA       ARG  56  -1.731   9.661   0.833
  423   1HB   ARG  56          1HB       ARG  56  -0.195   9.667   3.436
  424   2HB   ARG  56          2HB       ARG  56  -0.246  10.986   2.273
  425   1HG   ARG  56          1HG       ARG  56  -2.656  11.212   2.654
  426   2HG   ARG  56          2HG       ARG  56  -2.578   9.912   3.844
  427   1HD   ARG  56          1HD       ARG  56  -1.009  11.244   5.176
  428   2HD   ARG  56          2HD       ARG  56  -1.120  12.545   3.991
  429    HE   ARG  56           HE       ARG  56  -3.620  11.671   5.197
  430   1HH1  ARG  56          1HH1      ARG  56  -0.980  13.993   5.207
  431   2HH1  ARG  56          2HH1      ARG  56  -1.888  15.190   6.087
  432   1HH2  ARG  56          1HH2      ARG  56  -4.791  13.249   6.364
  433   2HH2  ARG  56          2HH2      ARG  56  -4.026  14.771   6.745
  434    H    PHE  57           H        PHE  57   0.433  10.467   0.087
  435    HA   PHE  57           HA       PHE  57   2.173   8.173  -0.466
  436   1HB   PHE  57          1HB       PHE  57   1.319   9.342  -2.428
  437   2HB   PHE  57          2HB       PHE  57   1.929  10.873  -1.816
  438    HD1  PHE  57           HD1      PHE  57   3.120   7.476  -2.776
  439    HD2  PHE  57           HD2      PHE  57   3.961  11.641  -2.558
  440    HE1  PHE  57           HE1      PHE  57   5.230   7.110  -3.983
  441    HE2  PHE  57           HE2      PHE  57   6.073  11.281  -3.767
  442    HZ   PHE  57           HZ       PHE  57   6.709   9.013  -4.480
  443    H    CYS  58           H        CYS  58   3.997   7.990   0.669
  444    HA   CYS  58           HA       CYS  58   4.973  10.180   2.270
  445   1HB   CYS  58          1HB       CYS  58   6.176   7.445   1.782
  446   2HB   CYS  58          2HB       CYS  58   6.665   8.579   3.035
  447    HG   CYS  58           HG       CYS  58   5.199   6.463   4.179
  448    H    HIS  59           H        HIS  59   6.674   8.060  -0.022
  449    HA   HIS  59           HA       HIS  59   7.608  10.108  -1.699
  450   1HB   HIS  59          1HB       HIS  59   9.989  10.165  -1.073
  451   2HB   HIS  59          2HB       HIS  59   8.974  10.791   0.214
  452    HD1  HIS  59           HD1      HIS  59   9.252   9.743   2.485
  453    HD2  HIS  59           HD2      HIS  59  11.023   7.504  -0.538
  454    HE1  HIS  59           HE1      HIS  59  10.528   7.921   3.649
  455    HE2  HIS  59           HE2      HIS  59  11.349   6.427   1.790
  456    H    SER  60           H        SER  60   9.688   9.239  -2.888
  457    HA   SER  60           HA       SER  60   9.236   6.379  -3.435
  458   1HB   SER  60          1HB       SER  60  10.560   8.440  -5.219
  459   2HB   SER  60          2HB       SER  60  10.103   6.796  -5.662
  460    HG   SER  60           HG       SER  60   8.523   8.193  -6.410
  461    H    GLU  61           H        GLU  61  10.862   4.979  -2.980
  462    HA   GLU  61           HA       GLU  61  13.566   6.078  -2.693
  463   1HB   GLU  61          1HB       GLU  61  13.919   4.639  -0.684
  464   2HB   GLU  61          2HB       GLU  61  12.786   5.958  -0.437
  465   1HG   GLU  61          1HG       GLU  61  10.926   4.342  -0.770
  466   2HG   GLU  61          2HG       GLU  61  12.125   3.051  -0.839
  467    H    LYS  62           H        LYS  62  15.162   4.127  -2.377
  468    HA   LYS  62           HA       LYS  62  14.803   2.546  -4.758
  469   1HB   LYS  62          1HB       LYS  62  16.968   3.578  -4.223
  470   2HB   LYS  62          2HB       LYS  62  17.073   2.605  -2.764
  471   1HG   LYS  62          1HG       LYS  62  17.478   0.651  -3.942
  472   2HG   LYS  62          2HG       LYS  62  16.808   1.300  -5.442
  473   1HD   LYS  62          1HD       LYS  62  19.273   1.130  -5.490
  474   2HD   LYS  62          2HD       LYS  62  18.700   2.785  -5.691
  475   1HE   LYS  62          1HE       LYS  62  19.065   3.072  -3.206
  476   2HE   LYS  62          2HE       LYS  62  19.902   1.521  -3.240
  477   1HZ   LYS  62          1HZ       LYS  62  21.518   2.408  -4.744
  478   2HZ   LYS  62          2HZ       LYS  62  20.657   3.861  -4.909
  479   3HZ   LYS  62          3HZ       LYS  62  21.389   3.472  -3.429
  480    H    ALA  63           H        ALA  63  14.185   0.509  -4.886
  481    HA   ALA  63           HA       ALA  63  12.940  -0.594  -2.549
  482   1HB   ALA  63          1HB       ALA  63  11.912  -2.146  -4.056
  483   2HB   ALA  63          2HB       ALA  63  11.877  -0.539  -4.782
  484   3HB   ALA  63          3HB       ALA  63  13.055  -1.728  -5.333
  485    HA   PRO  64           HA       PRO  64  15.999  -3.788  -1.689
  486   1HB   PRO  64          1HB       PRO  64  13.853  -5.009  -0.121
  487   2HB   PRO  64          2HB       PRO  64  15.403  -4.370   0.429
  488   1HG   PRO  64          1HG       PRO  64  13.049  -3.167   0.998
  489   2HG   PRO  64          2HG       PRO  64  14.559  -2.262   0.781
  490   1HD   PRO  64          1HD       PRO  64  12.290  -2.655  -1.132
  491   2HD   PRO  64          2HD       PRO  64  13.247  -1.195  -0.802
  492    H    ASP  65           H        ASP  65  16.228  -5.958  -2.347
  493    HA   ASP  65           HA       ASP  65  14.907  -6.638  -4.692
  494   1HB   ASP  65          1HB       ASP  65  16.104  -8.765  -4.539
  495   2HB   ASP  65          2HB       ASP  65  17.153  -7.414  -4.148
  496    H    GLU  66           H        GLU  66  14.175  -7.529  -1.385
  497    HA   GLU  66           HA       GLU  66  12.536  -9.754  -1.909
  498   1HB   GLU  66          1HB       GLU  66  13.442  -9.124   0.323
  499   2HB   GLU  66          2HB       GLU  66  12.303  -7.787   0.375
  500   1HG   GLU  66          1HG       GLU  66  11.470  -9.628   1.680
  501   2HG   GLU  66          2HG       GLU  66  10.444  -9.389   0.265
  502    H    VAL  67           H        VAL  67  11.832  -6.294  -1.831
  503    HA   VAL  67           HA       VAL  67   8.983  -6.760  -2.016
  504    HB   VAL  67           HB       VAL  67   8.658  -4.461  -1.794
  505   1HG1  VAL  67          1HG1      VAL  67  11.255  -5.019  -0.378
  506   2HG1  VAL  67          2HG1      VAL  67  10.109  -3.740   0.027
  507   3HG1  VAL  67          3HG1      VAL  67   9.642  -5.432   0.210
  508   1HG2  VAL  67          1HG2      VAL  67  10.362  -2.749  -2.199
  509   2HG2  VAL  67          2HG2      VAL  67  11.494  -4.001  -2.709
  510   3HG2  VAL  67          3HG2      VAL  67  10.033  -3.699  -3.648
  511    H    ILE  68           H        ILE  68  11.626  -6.281  -4.159
  512    HA   ILE  68           HA       ILE  68  10.264  -4.994  -6.267
  513    HB   ILE  68           HB       ILE  68  12.822  -6.589  -6.253
  514   1HG1  ILE  68          1HG1      ILE  68  12.348  -3.610  -6.409
  515   2HG1  ILE  68          2HG1      ILE  68  12.616  -4.469  -4.897
  516   1HG2  ILE  68          1HG2      ILE  68  11.881  -6.588  -8.508
  517   2HG2  ILE  68          2HG2      ILE  68  11.695  -4.836  -8.437
  518   3HG2  ILE  68          3HG2      ILE  68  13.306  -5.553  -8.424
  519   1HD1  ILE  68          1HD1      ILE  68  14.633  -3.402  -5.643
  520   2HD1  ILE  68          2HD1      ILE  68  14.817  -5.154  -5.695
  521   3HD1  ILE  68          3HD1      ILE  68  14.548  -4.255  -7.188
  522    H    GLU  69           H        GLU  69  11.182  -8.441  -5.885
  523    HA   GLU  69           HA       GLU  69   9.776  -9.169  -8.261
  524   1HB   GLU  69          1HB       GLU  69  10.950 -10.801  -6.019
  525   2HB   GLU  69          2HB       GLU  69  10.092 -11.533  -7.370
  526   1HG   GLU  69          1HG       GLU  69  11.701 -10.373  -8.898
  527   2HG   GLU  69          2HG       GLU  69  12.618  -9.909  -7.466
  528    H    ALA  70           H        ALA  70   8.852  -8.695  -4.984
  529    HA   ALA  70           HA       ALA  70   6.464 -10.257  -5.051
  530   1HB   ALA  70          1HB       ALA  70   5.868  -9.078  -3.003
  531   2HB   ALA  70          2HB       ALA  70   7.540  -9.633  -2.944
  532   3HB   ALA  70          3HB       ALA  70   7.186  -7.936  -3.265
  533    H    ILE  71           H        ILE  71   7.169  -6.796  -5.462
  534    HA   ILE  71           HA       ILE  71   4.496  -6.048  -6.086
  535    HB   ILE  71           HB       ILE  71   7.092  -4.650  -6.767
  536   1HG1  ILE  71          1HG1      ILE  71   5.141  -4.151  -4.511
  537   2HG1  ILE  71          2HG1      ILE  71   6.675  -4.998  -4.341
  538   1HG2  ILE  71          1HG2      ILE  71   4.265  -3.598  -6.795
  539   2HG2  ILE  71          2HG2      ILE  71   5.720  -2.637  -7.048
  540   3HG2  ILE  71          3HG2      ILE  71   5.278  -3.892  -8.206
  541   1HD1  ILE  71          1HD1      ILE  71   6.843  -2.697  -3.593
  542   2HD1  ILE  71          2HD1      ILE  71   7.863  -2.978  -5.005
  543   3HD1  ILE  71          3HD1      ILE  71   6.327  -2.131  -5.181
  544    H    LYS  72           H        LYS  72   7.294  -6.985  -8.012
  545    HA   LYS  72           HA       LYS  72   6.222  -6.424 -10.551
  546   1HB   LYS  72          1HB       LYS  72   8.619  -6.856 -10.051
  547   2HB   LYS  72          2HB       LYS  72   8.233  -8.547  -9.785
  548   1HG   LYS  72          1HG       LYS  72   7.629  -8.832 -12.085
  549   2HG   LYS  72          2HG       LYS  72   7.801  -7.102 -12.387
  550   1HD   LYS  72          1HD       LYS  72  10.027  -8.954 -11.528
  551   2HD   LYS  72          2HD       LYS  72   9.748  -8.392 -13.178
  552   1HE   LYS  72          1HE       LYS  72  10.072  -6.077 -12.440
  553   2HE   LYS  72          2HE       LYS  72  10.355  -6.642 -10.795
  554   1HZ   LYS  72          1HZ       LYS  72  12.328  -7.772 -11.510
  555   2HZ   LYS  72          2HZ       LYS  72  12.017  -7.402 -13.138
  556   3HZ   LYS  72          3HZ       LYS  72  12.410  -6.163 -12.043
  557    H    GLN  73           H        GLN  73   5.696  -9.010  -8.330
  558    HA   GLN  73           HA       GLN  73   4.531 -10.797 -10.273
  559   1HB   GLN  73          1HB       GLN  73   5.763 -11.718  -8.397
  560   2HB   GLN  73          2HB       GLN  73   4.699 -10.906  -7.259
  561   1HG   GLN  73          1HG       GLN  73   2.818 -12.279  -8.175
  562   2HG   GLN  73          2HG       GLN  73   4.018 -13.182  -9.101
  563   1HE2  GLN  73          2HE2      GLN  73   5.436 -14.555  -8.026
  564   2HE2  GLN  73          1HE2      GLN  73   5.207 -15.017  -6.370
  565    H    ASN  74           H        ASN  74   3.331  -8.895  -7.497
  566    HA   ASN  74           HA       ASN  74   0.601  -9.698  -8.203
  567   1HB   ASN  74          1HB       ASN  74   1.663  -8.368  -5.705
  568   2HB   ASN  74          2HB       ASN  74  -0.010  -8.847  -5.962
  569   1HD2  ASN  74          2HD2      ASN  74   3.217  -9.927  -5.319
  570   2HD2  ASN  74          1HD2      ASN  74   2.810 -11.562  -4.925
  571    H    GLY  75           H        GLY  75   2.666  -6.973  -8.364
  572   1HA   GLY  75          1HA       GLY  75   2.078  -4.995  -9.540
  573   2HA   GLY  75          2HA       GLY  75   0.390  -5.293  -9.149
  574    H    TYR  76           H        TYR  76   1.186  -5.915  -6.328
  575    HA   TYR  76           HA       TYR  76   2.088  -3.352  -5.323
  576   1HB   TYR  76          1HB       TYR  76   0.113  -2.947  -3.964
  577   2HB   TYR  76          2HB       TYR  76  -0.347  -3.036  -5.658
  578    HD1  TYR  76           HD1      TYR  76  -0.930  -4.297  -2.369
  579    HD2  TYR  76           HD2      TYR  76  -1.370  -5.246  -6.494
  580    HE1  TYR  76           HE1      TYR  76  -2.640  -5.965  -1.795
  581    HE2  TYR  76           HE2      TYR  76  -3.080  -6.923  -5.929
  582    HH   TYR  76           HH       TYR  76  -3.771  -8.293  -3.997
  583    H    PHE  77           H        PHE  77   2.696  -3.417  -3.119
  584    HA   PHE  77           HA       PHE  77   2.749  -6.117  -1.941
  585   1HB   PHE  77          1HB       PHE  77   4.976  -5.424  -2.783
  586   2HB   PHE  77          2HB       PHE  77   4.911  -4.005  -1.743
  587    HD1  PHE  77           HD1      PHE  77   5.884  -4.111   0.342
  588    HD2  PHE  77           HD2      PHE  77   4.682  -7.720  -1.565
  589    HE1  PHE  77           HE1      PHE  77   6.903  -5.411   2.165
  590    HE2  PHE  77           HE2      PHE  77   5.697  -9.026   0.256
  591    HZ   PHE  77           HZ       PHE  77   6.810  -7.870   2.125
  592    H    ILE  78           H        ILE  78   1.445  -6.140  -0.252
  593    HA   ILE  78           HA       ILE  78   0.984  -3.713   1.305
  594    HB   ILE  78           HB       ILE  78  -0.270  -6.457   1.548
  595   1HG1  ILE  78          1HG1      ILE  78  -0.888  -5.316  -0.530
  596   2HG1  ILE  78          2HG1      ILE  78  -2.261  -5.400   0.568
  597   1HG2  ILE  78          1HG2      ILE  78  -0.987  -3.874   2.927
  598   2HG2  ILE  78          2HG2      ILE  78  -1.916  -5.372   3.010
  599   3HG2  ILE  78          3HG2      ILE  78  -0.287  -5.306   3.684
  600   1HD1  ILE  78          1HD1      ILE  78  -2.137  -3.244  -0.535
  601   2HD1  ILE  78          2HD1      ILE  78  -1.896  -3.076   1.204
  602   3HD1  ILE  78          3HD1      ILE  78  -0.516  -2.994   0.110
  603    H    TYR  79           H        TYR  79   2.743  -3.357   2.555
  604    HA   TYR  79           HA       TYR  79   3.804  -5.567   4.148
  605   1HB   TYR  79          1HB       TYR  79   5.448  -4.238   2.943
  606   2HB   TYR  79          2HB       TYR  79   4.837  -2.762   3.681
  607    HD1  TYR  79           HD1      TYR  79   5.944  -1.920   5.523
  608    HD2  TYR  79           HD2      TYR  79   6.266  -6.074   4.665
  609    HE1  TYR  79           HE1      TYR  79   7.554  -2.169   7.362
  610    HE2  TYR  79           HE2      TYR  79   7.879  -6.334   6.503
  611    HH   TYR  79           HH       TYR  79   8.413  -3.881   8.836
  612    H    LYS  80           H        LYS  80   2.516  -5.873   5.886
  613    HA   LYS  80           HA       LYS  80   1.322  -3.774   7.376
  614   1HB   LYS  80          1HB       LYS  80   1.898  -6.647   8.120
  615   2HB   LYS  80          2HB       LYS  80   1.015  -5.533   9.153
  616   1HG   LYS  80          1HG       LYS  80  -0.763  -6.469   8.144
  617   2HG   LYS  80          2HG       LYS  80  -0.414  -5.261   6.908
  618   1HD   LYS  80          1HD       LYS  80  -0.753  -7.367   5.817
  619   2HD   LYS  80          2HD       LYS  80   0.966  -6.978   5.727
  620   1HE   LYS  80          1HE       LYS  80   1.453  -8.487   7.536
  621   2HE   LYS  80          2HE       LYS  80  -0.263  -8.781   7.807
  622   1HZ   LYS  80          1HZ       LYS  80   1.238  -9.514   5.347
  623   2HZ   LYS  80          2HZ       LYS  80   0.781 -10.582   6.579
  624   3HZ   LYS  80          3HZ       LYS  80  -0.405  -9.821   5.640
  625    H    MET  81           H        MET  81   2.527  -2.261   8.269
  626    HA   MET  81           HA       MET  81   5.213  -2.936   9.149
  627   1HB   MET  81          1HB       MET  81   4.783  -1.091   7.517
  628   2HB   MET  81          2HB       MET  81   3.960  -0.213   8.796
  629   1HG   MET  81          1HG       MET  81   6.785  -1.130   9.140
  630   2HG   MET  81          2HG       MET  81   6.410   0.349   8.259
  631   1HE   MET  81          1HE       MET  81   5.106   2.416   9.350
  632   2HE   MET  81          2HE       MET  81   4.501   2.404  11.007
  633   3HE   MET  81          3HE       MET  81   3.819   1.299   9.810
  634    H    GLU  82           H        GLU  82   2.401  -1.090  10.393
  635    HA   GLU  82           HA       GLU  82   3.050  -1.984  13.082
  636   1HB   GLU  82          1HB       GLU  82   4.359   0.170  12.560
  637   2HB   GLU  82          2HB       GLU  82   2.799   0.977  12.583
  638   1HG   GLU  82          1HG       GLU  82   3.787   1.270  14.713
  639   2HG   GLU  82          2HG       GLU  82   2.472   0.110  14.899
  640    H    GLY  83           H        GLY  83   1.289  -1.866  14.497
  641   1HA   GLY  83          1HA       GLY  83  -0.849  -0.820  15.062
  642   2HA   GLY  83          2HA       GLY  83  -1.207  -0.779  13.342
  643    H    CYS  84           H        CYS  84   0.207  -3.594  13.489
  644    HA   CYS  84           HA       CYS  84  -2.295  -5.026  13.577
  645   1HB   CYS  84          1HB       CYS  84   0.511  -6.038  13.069
  646   2HB   CYS  84          2HB       CYS  84  -0.980  -6.935  12.784
  647    HG   CYS  84           HG       CYS  84  -1.278  -4.143  11.169
  648    H    ASN  85           H        ASN  85  -2.018  -7.369  14.598
  649    HA   ASN  85           HA       ASN  85  -0.988  -7.004  17.326
  650   1HB   ASN  85          1HB       ASN  85  -3.430  -6.970  17.349
  651   2HB   ASN  85          2HB       ASN  85  -3.478  -8.493  16.465
  652   1HD2  ASN  85          2HD2      ASN  85  -2.744  -6.964  19.501
  653   2HD2  ASN  85          1HD2      ASN  85  -2.750  -8.414  20.458
  Start of MODEL   11
    1    H    MET   1           H        MET   1  15.865  -1.833  -7.814
    2    HA   MET   1           HA       MET   1  14.769   0.249  -8.586
    3   1HB   MET   1          1HB       MET   1  13.848  -1.900  -9.208
    4   2HB   MET   1          2HB       MET   1  13.082  -2.076  -7.637
    5   1HG   MET   1          1HG       MET   1  11.601  -0.208  -8.135
    6   2HG   MET   1          2HG       MET   1  12.382  -0.000  -9.701
    7   1HE   MET   1          1HE       MET   1   9.186  -0.473  -8.985
    8   2HE   MET   1          2HE       MET   1   8.731  -1.459 -10.376
    9   3HE   MET   1          3HE       MET   1   9.779  -0.058 -10.592
   10    H    GLN   2           H        GLN   2  13.229   1.876  -8.164
   11    HA   GLN   2           HA       GLN   2  12.901   2.481  -5.347
   12   1HB   GLN   2          1HB       GLN   2  12.131   4.018  -7.828
   13   2HB   GLN   2          2HB       GLN   2  11.871   4.599  -6.189
   14   1HG   GLN   2          1HG       GLN   2  14.344   4.391  -5.829
   15   2HG   GLN   2          2HG       GLN   2  14.492   4.075  -7.558
   16   1HE2  GLN   2          2HE2      GLN   2  12.128   6.266  -6.220
   17   2HE2  GLN   2          1HE2      GLN   2  12.847   7.718  -6.820
   18    H    ILE   3           H        ILE   3  10.956   2.786  -4.288
   19    HA   ILE   3           HA       ILE   3   8.593   1.590  -5.595
   20    HB   ILE   3           HB       ILE   3   7.898   0.950  -3.235
   21   1HG1  ILE   3          1HG1      ILE   3  10.857   1.331  -2.709
   22   2HG1  ILE   3          2HG1      ILE   3   9.597   2.376  -2.085
   23   1HG2  ILE   3          1HG2      ILE   3  10.290  -0.376  -4.483
   24   2HG2  ILE   3          2HG2      ILE   3   9.214  -1.117  -3.298
   25   3HG2  ILE   3          3HG2      ILE   3   8.599  -0.667  -4.890
   26   1HD1  ILE   3          1HD1      ILE   3   9.938  -0.542  -1.452
   27   2HD1  ILE   3          2HD1      ILE   3  10.340   0.812  -0.396
   28   3HD1  ILE   3          3HD1      ILE   3   8.659   0.502  -0.830
   29    H    HIS   4           H        HIS   4   6.551   2.400  -4.990
   30    HA   HIS   4           HA       HIS   4   6.595   5.134  -3.940
   31   1HB   HIS   4          1HB       HIS   4   4.433   3.518  -5.310
   32   2HB   HIS   4          2HB       HIS   4   4.159   5.116  -4.630
   33    HD1  HIS   4           HD1      HIS   4   3.516   5.872  -7.067
   34    HD2  HIS   4           HD2      HIS   4   7.473   4.707  -6.568
   35    HE1  HIS   4           HE1      HIS   4   4.733   6.732  -9.091
   36    HE2  HIS   4           HE2      HIS   4   7.068   5.799  -8.876
   37    H    VAL   5           H        VAL   5   6.506   5.221  -1.781
   38    HA   VAL   5           HA       VAL   5   5.138   3.114  -0.310
   39    HB   VAL   5           HB       VAL   5   6.740   5.469   0.708
   40   1HG1  VAL   5          1HG1      VAL   5   5.111   4.735   2.361
   41   2HG1  VAL   5          2HG1      VAL   5   5.649   3.066   2.174
   42   3HG1  VAL   5          3HG1      VAL   5   6.740   4.272   2.856
   43   1HG2  VAL   5          1HG2      VAL   5   7.460   2.552   0.436
   44   2HG2  VAL   5          2HG2      VAL   5   8.090   3.876  -0.547
   45   3HG2  VAL   5          3HG2      VAL   5   8.467   3.798   1.174
   46    H    TYR   6           H        TYR   6   3.038   3.294  -0.045
   47    HA   TYR   6           HA       TYR   6   1.883   5.944   0.453
   48   1HB   TYR   6          1HB       TYR   6   0.611   3.333  -0.387
   49   2HB   TYR   6          2HB       TYR   6  -0.318   4.754   0.078
   50    HD1  TYR   6           HD1      TYR   6  -0.770   6.455  -1.481
   51    HD2  TYR   6           HD2      TYR   6   2.186   3.528  -2.380
   52    HE1  TYR   6           HE1      TYR   6  -0.634   7.307  -3.787
   53    HE2  TYR   6           HE2      TYR   6   2.328   4.372  -4.684
   54    HH   TYR   6           HH       TYR   6   0.864   7.330  -5.663
   55    H    ASP   7           H        ASP   7   2.142   6.349   2.548
   56    HA   ASP   7           HA       ASP   7   1.935   4.449   4.649
   57   1HB   ASP   7          1HB       ASP   7   3.157   6.630   4.791
   58   2HB   ASP   7          2HB       ASP   7   1.608   7.461   4.762
   59    H    THR   8           H        THR   8   0.049   3.387   4.983
   60    HA   THR   8           HA       THR   8  -2.437   4.826   4.394
   61    HB   THR   8           HB       THR   8  -2.100   1.843   4.701
   62    HG1  THR   8           HG1      THR   8  -0.832   2.969   2.943
   63   1HG2  THR   8          1HG2      THR   8  -4.398   2.688   4.884
   64   2HG2  THR   8          2HG2      THR   8  -4.211   3.527   3.343
   65   3HG2  THR   8          3HG2      THR   8  -4.175   1.764   3.398
   66    H    TYR   9           H        TYR   9  -3.724   5.441   5.981
   67    HA   TYR   9           HA       TYR   9  -3.428   4.210   8.637
   68   1HB   TYR   9          1HB       TYR   9  -4.886   6.756   7.890
   69   2HB   TYR   9          2HB       TYR   9  -4.567   6.172   9.516
   70    HD1  TYR   9           HD1      TYR   9  -2.216   6.176  10.377
   71    HD2  TYR   9           HD2      TYR   9  -3.287   8.032   6.700
   72    HE1  TYR   9           HE1      TYR   9  -0.138   7.489  10.437
   73    HE2  TYR   9           HE2      TYR   9  -1.208   9.342   6.748
   74    HH   TYR   9           HH       TYR   9   1.367   8.627   8.678
   75    H    VAL  10           H        VAL  10  -4.687   2.304   8.074
   76    HA   VAL  10           HA       VAL  10  -7.513   2.804   7.530
   77    HB   VAL  10           HB       VAL  10  -6.065   0.166   7.818
   78   1HG1  VAL  10          1HG1      VAL  10  -8.095  -0.836   6.903
   79   2HG1  VAL  10          2HG1      VAL  10  -8.422  -0.013   8.428
   80   3HG1  VAL  10          3HG1      VAL  10  -8.877   0.744   6.902
   81   1HG2  VAL  10          1HG2      VAL  10  -6.352  -0.004   5.387
   82   2HG2  VAL  10          2HG2      VAL  10  -7.030   1.624   5.367
   83   3HG2  VAL  10          3HG2      VAL  10  -5.349   1.374   5.841
   84    H    LYS  11           H        LYS  11  -8.235   3.727   9.369
   85    HA   LYS  11           HA       LYS  11  -7.561   2.644  11.957
   86   1HB   LYS  11          1HB       LYS  11  -7.676   5.061  11.599
   87   2HB   LYS  11          2HB       LYS  11  -9.367   4.928  11.147
   88   1HG   LYS  11          1HG       LYS  11  -9.907   4.165  13.408
   89   2HG   LYS  11          2HG       LYS  11  -8.206   4.316  13.856
   90   1HD   LYS  11          1HD       LYS  11  -9.486   6.273  14.573
   91   2HD   LYS  11          2HD       LYS  11  -8.279   6.707  13.361
   92   1HE   LYS  11          1HE       LYS  11 -10.060   6.591  11.630
   93   2HE   LYS  11          2HE       LYS  11 -11.236   6.308  12.912
   94   1HZ   LYS  11          1HZ       LYS  11 -10.608   8.457  13.876
   95   2HZ   LYS  11          2HZ       LYS  11  -9.543   8.727  12.585
   96   3HZ   LYS  11          3HZ       LYS  11 -11.210   8.622  12.303
   97    H    ALA  12           H        ALA  12  -8.586   0.872  12.637
   98    HA   ALA  12           HA       ALA  12 -11.193   0.103  11.837
   99   1HB   ALA  12          1HB       ALA  12  -9.545  -1.513  12.667
  100   2HB   ALA  12          2HB       ALA  12  -9.622  -0.768  14.264
  101   3HB   ALA  12          3HB       ALA  12 -11.041  -1.578  13.598
  102    H    LYS  13           H        LYS  13 -13.155   0.284  12.932
  103    HA   LYS  13           HA       LYS  13 -13.437   2.859  14.104
  104   1HB   LYS  13          1HB       LYS  13 -15.480   0.659  13.783
  105   2HB   LYS  13          2HB       LYS  13 -15.833   2.339  14.167
  106   1HG   LYS  13          1HG       LYS  13 -14.608   1.298  11.620
  107   2HG   LYS  13          2HG       LYS  13 -16.237   1.938  11.830
  108   1HD   LYS  13          1HD       LYS  13 -15.338   4.127  12.375
  109   2HD   LYS  13          2HD       LYS  13 -13.694   3.501  12.277
  110   1HE   LYS  13          1HE       LYS  13 -14.199   4.693  10.250
  111   2HE   LYS  13          2HE       LYS  13 -14.087   2.971   9.888
  112   1HZ   LYS  13          1HZ       LYS  13 -16.457   2.817   9.810
  113   2HZ   LYS  13          2HZ       LYS  13 -16.640   4.422  10.340
  114   3HZ   LYS  13          3HZ       LYS  13 -15.980   4.099   8.809
  115    H    ASP  14           H        ASP  14 -13.558  -0.418  15.377
  116    HA   ASP  14           HA       ASP  14 -13.356   0.750  18.069
  117   1HB   ASP  14          1HB       ASP  14 -15.688  -0.156  17.573
  118   2HB   ASP  14          2HB       ASP  14 -14.951  -1.755  17.511
  119    H    GLY  15           H        GLY  15 -11.233  -0.018  16.489
  120   1HA   GLY  15          1HA       GLY  15 -10.238  -2.316  18.029
  121   2HA   GLY  15          2HA       GLY  15 -10.057  -2.311  16.280
  122    H    HIS  16           H        HIS  16  -8.336  -1.341  15.415
  123    HA   HIS  16           HA       HIS  16  -6.881   0.673  16.918
  124   1HB   HIS  16          1HB       HIS  16  -4.728  -0.489  16.698
  125   2HB   HIS  16          2HB       HIS  16  -5.854  -1.428  17.670
  126    HD1  HIS  16           HD1      HIS  16  -6.664  -3.682  16.704
  127    HD2  HIS  16           HD2      HIS  16  -3.960  -1.666  14.272
  128    HE1  HIS  16           HE1      HIS  16  -5.980  -5.336  14.937
  129    HE2  HIS  16           HE2      HIS  16  -4.369  -4.091  13.456
  130    H    VAL  17           H        VAL  17  -5.166   1.676  15.575
  131    HA   VAL  17           HA       VAL  17  -6.086   2.056  12.883
  132    HB   VAL  17           HB       VAL  17  -3.547   3.082  14.171
  133   1HG1  VAL  17          1HG1      VAL  17  -3.477   3.166  11.739
  134   2HG1  VAL  17          2HG1      VAL  17  -5.027   4.007  11.708
  135   3HG1  VAL  17          3HG1      VAL  17  -3.612   4.791  12.412
  136   1HG2  VAL  17          1HG2      VAL  17  -4.795   5.166  14.539
  137   2HG2  VAL  17          2HG2      VAL  17  -6.259   4.382  13.944
  138   3HG2  VAL  17          3HG2      VAL  17  -5.494   3.811  15.426
  139    H    MET  18           H        MET  18  -5.726   0.518  11.427
  140    HA   MET  18           HA       MET  18  -3.488  -1.259  11.500
  141   1HB   MET  18          1HB       MET  18  -5.337  -0.642   9.188
  142   2HB   MET  18          2HB       MET  18  -4.279  -2.032   9.318
  143   1HG   MET  18          1HG       MET  18  -6.483  -1.503  11.280
  144   2HG   MET  18          2HG       MET  18  -6.746  -2.386   9.778
  145   1HE   MET  18          1HE       MET  18  -5.760  -4.748   9.243
  146   2HE   MET  18          2HE       MET  18  -4.535  -5.547  10.231
  147   3HE   MET  18          3HE       MET  18  -4.144  -4.054   9.377
  148    H    HIS  19           H        HIS  19  -1.669   0.090  11.571
  149    HA   HIS  19           HA       HIS  19  -1.256   1.864   9.286
  150   1HB   HIS  19          1HB       HIS  19  -0.811   2.623  11.681
  151   2HB   HIS  19          2HB       HIS  19   0.588   1.552  11.656
  152    HD1  HIS  19           HD1      HIS  19   2.680   2.764  11.078
  153    HD2  HIS  19           HD2      HIS  19  -0.649   4.447   9.245
  154    HE1  HIS  19           HE1      HIS  19   3.543   4.740   9.785
  155    HE2  HIS  19           HE2      HIS  19   1.546   5.588   8.495
  156    H    PHE  20           H        PHE  20  -0.323   1.062   7.590
  157    HA   PHE  20           HA       PHE  20   2.030  -0.610   7.849
  158   1HB   PHE  20          1HB       PHE  20   1.128  -2.257   6.183
  159   2HB   PHE  20          2HB       PHE  20   0.330  -2.313   7.750
  160    HD1  PHE  20           HD1      PHE  20  -0.043  -1.566   4.207
  161    HD2  PHE  20           HD2      PHE  20  -1.956  -1.515   8.007
  162    HE1  PHE  20           HE1      PHE  20  -2.223  -1.299   3.103
  163    HE2  PHE  20           HE2      PHE  20  -4.139  -1.247   6.908
  164    HZ   PHE  20           HZ       PHE  20  -4.275  -1.139   4.452
  165    H    ASP  21           H        ASP  21   3.305  -0.633   5.944
  166    HA   ASP  21           HA       ASP  21   2.755   1.694   4.254
  167   1HB   ASP  21          1HB       ASP  21   5.275   0.065   4.629
  168   2HB   ASP  21          2HB       ASP  21   5.125   1.412   3.504
  169    H    VAL  22           H        VAL  22   1.868   1.436   2.353
  170    HA   VAL  22           HA       VAL  22   1.896  -1.179   1.066
  171    HB   VAL  22           HB       VAL  22   0.490   1.362   0.213
  172   1HG1  VAL  22          1HG1      VAL  22  -0.833  -0.093  -1.237
  173   2HG1  VAL  22          2HG1      VAL  22   0.881  -0.170  -1.649
  174   3HG1  VAL  22          3HG1      VAL  22   0.134  -1.480  -0.735
  175   1HG2  VAL  22          1HG2      VAL  22  -0.561  -1.043   1.695
  176   2HG2  VAL  22          2HG2      VAL  22  -0.351   0.581   2.348
  177   3HG2  VAL  22          3HG2      VAL  22  -1.541   0.289   1.082
  178    H    PHE  23           H        PHE  23   3.671  -1.603  -0.062
  179    HA   PHE  23           HA       PHE  23   5.043   0.530  -1.501
  180   1HB   PHE  23          1HB       PHE  23   5.746  -2.405  -1.257
  181   2HB   PHE  23          2HB       PHE  23   6.763  -1.155  -1.960
  182    HD1  PHE  23           HD1      PHE  23   7.098  -3.159   0.482
  183    HD2  PHE  23           HD2      PHE  23   6.292   1.000   0.094
  184    HE1  PHE  23           HE1      PHE  23   8.111  -2.763   2.687
  185    HE2  PHE  23           HE2      PHE  23   7.307   1.404   2.299
  186    HZ   PHE  23           HZ       PHE  23   8.219  -0.478   3.598
  187    H    THR  24           H        THR  24   4.438   1.008  -3.497
  188    HA   THR  24           HA       THR  24   3.570  -1.183  -5.259
  189    HB   THR  24           HB       THR  24   1.986   0.489  -6.325
  190    HG1  THR  24           HG1      THR  24   2.317   1.845  -3.839
  191   1HG2  THR  24          1HG2      THR  24   1.176  -1.328  -4.898
  192   2HG2  THR  24          2HG2      THR  24   1.421  -0.323  -3.470
  193   3HG2  THR  24          3HG2      THR  24   0.213   0.133  -4.673
  194    H    ASP  25           H        ASP  25   3.780  -0.663  -7.569
  195    HA   ASP  25           HA       ASP  25   5.997   1.207  -8.066
  196   1HB   ASP  25          1HB       ASP  25   6.553  -0.100  -9.990
  197   2HB   ASP  25          2HB       ASP  25   6.268  -1.242  -8.680
  198    H    VAL  26           H        VAL  26   2.747   1.052  -8.199
  199    HA   VAL  26           HA       VAL  26   2.245   2.064 -10.840
  200    HB   VAL  26           HB       VAL  26   0.372   1.907  -8.469
  201   1HG1  VAL  26          1HG1      VAL  26  -1.411   1.938 -10.149
  202   2HG1  VAL  26          2HG1      VAL  26  -0.439   3.410 -10.203
  203   3HG1  VAL  26          3HG1      VAL  26  -0.205   2.153 -11.418
  204   1HG2  VAL  26          1HG2      VAL  26  -0.413  -0.191  -9.461
  205   2HG2  VAL  26          2HG2      VAL  26   0.843  -0.073 -10.693
  206   3HG2  VAL  26          3HG2      VAL  26   1.287  -0.282  -9.000
  207    H    ARG  27           H        ARG  27   1.555   4.127 -11.403
  208    HA   ARG  27           HA       ARG  27   2.390   6.232  -9.547
  209   1HB   ARG  27          1HB       ARG  27   1.900   6.240 -12.522
  210   2HB   ARG  27          2HB       ARG  27   2.250   7.694 -11.600
  211   1HG   ARG  27          1HG       ARG  27   4.416   6.767 -10.960
  212   2HG   ARG  27          2HG       ARG  27   4.058   5.306 -11.886
  213   1HD   ARG  27          1HD       ARG  27   4.027   6.504 -13.931
  214   2HD   ARG  27          2HD       ARG  27   4.053   8.058 -13.099
  215    HE   ARG  27           HE       ARG  27   6.333   6.196 -12.916
  216   1HH1  ARG  27          1HH1      ARG  27   4.966   9.304 -13.782
  217   2HH1  ARG  27          2HH1      ARG  27   6.512  10.072 -14.007
  218   1HH2  ARG  27          1HH2      ARG  27   8.381   7.198 -13.231
  219   2HH2  ARG  27          2HH2      ARG  27   8.457   8.868 -13.713
  220    H    ASP  28           H        ASP  28  -0.207   4.795  -9.454
  221    HA   ASP  28           HA       ASP  28  -1.987   7.107  -9.847
  222   1HB   ASP  28          1HB       ASP  28  -2.428   5.310 -11.497
  223   2HB   ASP  28          2HB       ASP  28  -2.739   4.197 -10.173
  224    H    ASP  29           H        ASP  29  -2.889   7.826  -8.081
  225    HA   ASP  29           HA       ASP  29  -2.345   6.758  -5.552
  226   1HB   ASP  29          1HB       ASP  29  -4.366   8.816  -6.442
  227   2HB   ASP  29          2HB       ASP  29  -4.077   8.417  -4.753
  228    H    LYS  30           H        LYS  30  -5.325   6.651  -7.496
  229    HA   LYS  30           HA       LYS  30  -6.861   5.438  -5.445
  230   1HB   LYS  30          1HB       LYS  30  -7.923   6.677  -7.276
  231   2HB   LYS  30          2HB       LYS  30  -7.368   5.464  -8.425
  232   1HG   LYS  30          1HG       LYS  30  -8.757   3.792  -7.437
  233   2HG   LYS  30          2HG       LYS  30  -9.188   4.864  -6.106
  234   1HD   LYS  30          1HD       LYS  30 -10.299   6.368  -7.698
  235   2HD   LYS  30          2HD       LYS  30  -9.895   5.261  -9.011
  236   1HE   LYS  30          1HE       LYS  30 -12.224   5.025  -8.147
  237   2HE   LYS  30          2HE       LYS  30 -11.270   3.544  -8.083
  238   1HZ   LYS  30          1HZ       LYS  30 -12.643   4.127  -6.045
  239   2HZ   LYS  30          2HZ       LYS  30 -11.021   3.723  -5.779
  240   3HZ   LYS  30          3HZ       LYS  30 -11.505   5.348  -5.745
  241    H    LYS  31           H        LYS  31  -4.974   4.173  -8.141
  242    HA   LYS  31           HA       LYS  31  -5.671   1.477  -7.938
  243   1HB   LYS  31          1HB       LYS  31  -3.599   3.018  -9.173
  244   2HB   LYS  31          2HB       LYS  31  -2.882   1.602  -8.424
  245   1HG   LYS  31          1HG       LYS  31  -3.471   1.204 -10.758
  246   2HG   LYS  31          2HG       LYS  31  -4.381   0.158  -9.667
  247   1HD   LYS  31          1HD       LYS  31  -6.323   1.588  -9.863
  248   2HD   LYS  31          2HD       LYS  31  -5.416   2.727 -10.860
  249   1HE   LYS  31          1HE       LYS  31  -5.968  -0.146 -11.591
  250   2HE   LYS  31          2HE       LYS  31  -6.903   1.234 -12.166
  251   1HZ   LYS  31          1HZ       LYS  31  -4.020   0.717 -12.684
  252   2HZ   LYS  31          2HZ       LYS  31  -5.286   0.614 -13.809
  253   3HZ   LYS  31          3HZ       LYS  31  -4.850   2.117 -13.157
  254    H    ALA  32           H        ALA  32  -3.120   3.281  -6.242
  255    HA   ALA  32           HA       ALA  32  -2.168   1.165  -4.663
  256   1HB   ALA  32          1HB       ALA  32  -0.965   3.275  -4.924
  257   2HB   ALA  32          2HB       ALA  32  -2.224   4.109  -4.014
  258   3HB   ALA  32          3HB       ALA  32  -1.223   2.893  -3.222
  259    H    ILE  33           H        ILE  33  -4.704   3.563  -4.074
  260    HA   ILE  33           HA       ILE  33  -5.489   2.762  -1.515
  261    HB   ILE  33           HB       ILE  33  -7.207   3.840  -3.765
  262   1HG1  ILE  33          1HG1      ILE  33  -5.891   5.254  -1.435
  263   2HG1  ILE  33          2HG1      ILE  33  -5.329   5.305  -3.103
  264   1HG2  ILE  33          1HG2      ILE  33  -8.782   4.506  -2.018
  265   2HG2  ILE  33          2HG2      ILE  33  -8.573   2.755  -2.066
  266   3HG2  ILE  33          3HG2      ILE  33  -7.781   3.704  -0.808
  267   1HD1  ILE  33          1HD1      ILE  33  -7.962   6.357  -2.092
  268   2HD1  ILE  33          2HD1      ILE  33  -6.549   7.317  -2.532
  269   3HD1  ILE  33          3HD1      ILE  33  -7.410   6.398  -3.766
  270    H    GLU  34           H        GLU  34  -6.665   1.681  -4.696
  271    HA   GLU  34           HA       GLU  34  -8.523  -0.193  -3.734
  272   1HB   GLU  34          1HB       GLU  34  -7.061  -0.029  -6.368
  273   2HB   GLU  34          2HB       GLU  34  -8.320  -1.208  -6.035
  274   1HG   GLU  34          1HG       GLU  34  -8.667   1.781  -5.966
  275   2HG   GLU  34          2HG       GLU  34  -9.154   0.721  -7.285
  276    H    PHE  35           H        PHE  35  -5.062  -0.470  -4.386
  277    HA   PHE  35           HA       PHE  35  -4.889  -3.274  -4.198
  278   1HB   PHE  35          1HB       PHE  35  -2.864  -1.125  -3.569
  279   2HB   PHE  35          2HB       PHE  35  -2.490  -2.844  -3.503
  280    HD1  PHE  35           HD1      PHE  35  -1.542  -0.375  -5.329
  281    HD2  PHE  35           HD2      PHE  35  -4.018  -3.792  -5.876
  282    HE1  PHE  35           HE1      PHE  35  -1.048  -0.342  -7.736
  283    HE2  PHE  35           HE2      PHE  35  -3.521  -3.768  -8.286
  284    HZ   PHE  35           HZ       PHE  35  -2.036  -2.041  -9.218
  285    H    ALA  36           H        ALA  36  -4.604  -0.757  -1.706
  286    HA   ALA  36           HA       ALA  36  -4.271  -2.565   0.459
  287   1HB   ALA  36          1HB       ALA  36  -5.342   0.257   0.479
  288   2HB   ALA  36          2HB       ALA  36  -4.792  -0.652   1.886
  289   3HB   ALA  36          3HB       ALA  36  -3.646  -0.206   0.623
  290    H    LYS  37           H        LYS  37  -7.060  -1.054  -1.063
  291    HA   LYS  37           HA       LYS  37  -9.032  -1.940   0.729
  292   1HB   LYS  37          1HB       LYS  37  -9.119  -1.204  -2.190
  293   2HB   LYS  37          2HB       LYS  37 -10.561  -1.675  -1.300
  294   1HG   LYS  37          1HG       LYS  37 -10.304   0.174   0.201
  295   2HG   LYS  37          2HG       LYS  37  -8.757   0.602  -0.523
  296   1HD   LYS  37          1HD       LYS  37 -10.416   2.103  -1.372
  297   2HD   LYS  37          2HD       LYS  37  -9.946   1.013  -2.672
  298   1HE   LYS  37          1HE       LYS  37 -12.362   0.516  -0.955
  299   2HE   LYS  37          2HE       LYS  37 -12.430   1.522  -2.399
  300   1HZ   LYS  37          1HZ       LYS  37 -13.063  -0.598  -3.092
  301   2HZ   LYS  37          2HZ       LYS  37 -11.453  -0.471  -3.597
  302   3HZ   LYS  37          3HZ       LYS  37 -11.844  -1.375  -2.213
  303    H    GLN  38           H        GLN  38  -7.754  -3.421  -2.228
  304    HA   GLN  38           HA       GLN  38  -9.411  -5.692  -2.214
  305   1HB   GLN  38          1HB       GLN  38  -6.655  -5.233  -3.345
  306   2HB   GLN  38          2HB       GLN  38  -7.524  -6.745  -3.558
  307   1HG   GLN  38          1HG       GLN  38  -9.287  -5.632  -4.745
  308   2HG   GLN  38          2HG       GLN  38  -8.562  -4.059  -4.418
  309   1HE2  GLN  38          2HE2      GLN  38  -6.751  -3.424  -5.561
  310   2HE2  GLN  38          1HE2      GLN  38  -6.243  -4.224  -7.011
  311    H    TRP  39           H        TRP  39  -6.384  -4.997  -0.574
  312    HA   TRP  39           HA       TRP  39  -5.972  -7.571   0.516
  313   1HB   TRP  39          1HB       TRP  39  -4.211  -5.863   0.516
  314   2HB   TRP  39          2HB       TRP  39  -5.169  -4.854   1.595
  315    HD1  TRP  39           HD1      TRP  39  -3.546  -8.383   1.654
  316    HE1  TRP  39           HE1      TRP  39  -2.729  -8.839   4.053
  317    HE3  TRP  39           HE3      TRP  39  -5.200  -4.099   3.898
  318    HZ2  TRP  39           HZ2      TRP  39  -2.771  -7.544   6.560
  319    HZ3  TRP  39           HZ3      TRP  39  -4.763  -3.782   6.298
  320    HH2  TRP  39           HH2      TRP  39  -3.575  -5.471   7.601
  321    H    LEU  40           H        LEU  40  -7.706  -4.713   1.668
  322    HA   LEU  40           HA       LEU  40  -8.612  -5.796   4.106
  323   1HB   LEU  40          1HB       LEU  40  -9.850  -3.677   2.347
  324   2HB   LEU  40          2HB       LEU  40 -10.367  -4.037   3.983
  325    HG   LEU  40           HG       LEU  40  -7.634  -3.009   3.212
  326   1HD1  LEU  40          1HD1      LEU  40  -9.964  -1.610   4.518
  327   2HD1  LEU  40          2HD1      LEU  40  -8.361  -0.925   4.256
  328   3HD1  LEU  40          3HD1      LEU  40  -9.380  -1.338   2.877
  329   1HD2  LEU  40          1HD2      LEU  40  -8.889  -3.423   5.924
  330   2HD2  LEU  40          2HD2      LEU  40  -7.614  -4.417   5.218
  331   3HD2  LEU  40          3HD2      LEU  40  -7.301  -2.726   5.607
  332    H    SER  41           H        SER  41  -9.981  -5.823   0.846
  333    HA   SER  41           HA       SER  41 -12.466  -6.954   1.431
  334   1HB   SER  41          1HB       SER  41 -10.782  -7.340  -1.055
  335   2HB   SER  41          2HB       SER  41 -12.513  -7.643  -0.924
  336    HG   SER  41           HG       SER  41 -12.758  -5.403  -0.399
  337    H    SER  42           H        SER  42  -9.358  -8.503   0.740
  338    HA   SER  42           HA       SER  42 -10.481 -11.119   0.675
  339   1HB   SER  42          1HB       SER  42  -7.896 -11.674   0.881
  340   2HB   SER  42          2HB       SER  42  -8.590 -11.051  -0.616
  341    HG   SER  42           HG       SER  42  -7.718  -9.104  -0.245
  342    H    ILE  43           H        ILE  43  -9.141  -9.119   3.212
  343    HA   ILE  43           HA       ILE  43  -9.084 -11.397   5.028
  344    HB   ILE  43           HB       ILE  43  -8.344  -9.762   6.755
  345   1HG1  ILE  43          1HG1      ILE  43  -8.269  -7.844   4.416
  346   2HG1  ILE  43          2HG1      ILE  43  -9.347  -7.734   5.803
  347   1HG2  ILE  43          1HG2      ILE  43  -6.739 -11.085   5.527
  348   2HG2  ILE  43          2HG2      ILE  43  -6.719  -9.897   4.223
  349   3HG2  ILE  43          3HG2      ILE  43  -6.093  -9.469   5.816
  350   1HD1  ILE  43          1HD1      ILE  43  -7.433  -7.384   7.268
  351   2HD1  ILE  43          2HD1      ILE  43  -6.347  -7.509   5.884
  352   3HD1  ILE  43          3HD1      ILE  43  -7.495  -6.174   5.986
  353    H    GLY  44           H        GLY  44 -11.093  -8.612   4.326
  354   1HA   GLY  44          1HA       GLY  44 -13.456  -8.785   4.763
  355   2HA   GLY  44          2HA       GLY  44 -13.080  -9.727   6.198
  356    H    GLU  45           H        GLU  45 -11.043  -7.060   5.757
  357    HA   GLU  45           HA       GLU  45 -12.355  -5.734   8.012
  358   1HB   GLU  45          1HB       GLU  45  -9.545  -5.898   7.033
  359   2HB   GLU  45          2HB       GLU  45 -10.029  -4.463   7.924
  360   1HG   GLU  45          1HG       GLU  45  -8.987  -6.177   9.342
  361   2HG   GLU  45          2HG       GLU  45 -10.631  -5.781   9.836
  362    H    GLU  46           H        GLU  46 -13.272  -5.406   5.216
  363    HA   GLU  46           HA       GLU  46 -12.569  -2.716   4.507
  364   1HB   GLU  46          1HB       GLU  46 -14.591  -4.675   3.502
  365   2HB   GLU  46          2HB       GLU  46 -14.722  -2.981   3.051
  366   1HG   GLU  46          1HG       GLU  46 -12.304  -3.170   2.291
  367   2HG   GLU  46          2HG       GLU  46 -12.525  -4.915   2.430
  368    H    GLY  47           H        GLY  47 -14.931  -1.479   3.925
  369   1HA   GLY  47          1HA       GLY  47 -16.838  -0.528   4.984
  370   2HA   GLY  47          2HA       GLY  47 -16.270  -1.173   6.521
  371    H    ALA  48           H        ALA  48 -13.540  -0.304   6.104
  372    HA   ALA  48           HA       ALA  48 -13.732   2.369   7.078
  373   1HB   ALA  48          1HB       ALA  48 -11.301   0.805   6.205
  374   2HB   ALA  48          2HB       ALA  48 -11.289   2.315   7.118
  375   3HB   ALA  48          3HB       ALA  48 -11.968   0.855   7.838
  376    H    THR  49           H        THR  49 -13.789   4.188   5.948
  377    HA   THR  49           HA       THR  49 -13.761   4.075   3.085
  378    HB   THR  49           HB       THR  49 -13.976   6.505   4.873
  379    HG1  THR  49           HG1      THR  49 -15.920   4.683   3.841
  380   1HG2  THR  49          1HG2      THR  49 -13.445   7.036   2.541
  381   2HG2  THR  49          2HG2      THR  49 -14.802   6.048   2.001
  382   3HG2  THR  49          3HG2      THR  49 -15.096   7.514   2.935
  383    H    VAL  50           H        VAL  50 -11.653   3.503   2.551
  384    HA   VAL  50           HA       VAL  50  -9.430   5.143   3.357
  385    HB   VAL  50           HB       VAL  50  -9.530   3.007   1.218
  386   1HG1  VAL  50          1HG1      VAL  50  -7.630   4.496   0.956
  387   2HG1  VAL  50          2HG1      VAL  50  -7.197   4.274   2.651
  388   3HG1  VAL  50          3HG1      VAL  50  -7.095   2.917   1.529
  389   1HG2  VAL  50          1HG2      VAL  50  -8.582   1.517   2.907
  390   2HG2  VAL  50          2HG2      VAL  50  -8.700   2.800   4.112
  391   3HG2  VAL  50          3HG2      VAL  50 -10.165   2.117   3.404
  392    H    THR  51           H        THR  51  -9.489   7.160   2.613
  393    HA   THR  51           HA       THR  51  -9.856   7.585  -0.279
  394    HB   THR  51           HB       THR  51 -10.345   9.940   0.291
  395    HG1  THR  51           HG1      THR  51 -10.829   9.660   2.925
  396   1HG2  THR  51          1HG2      THR  51 -12.536   9.596   1.338
  397   2HG2  THR  51          2HG2      THR  51 -12.215   8.370   0.111
  398   3HG2  THR  51          3HG2      THR  51 -12.050   7.970   1.821
  399    H    SER  52           H        SER  52  -8.644   9.879  -0.755
  400    HA   SER  52           HA       SER  52  -5.863   9.392  -0.453
  401   1HB   SER  52          1HB       SER  52  -5.761  11.807  -1.416
  402   2HB   SER  52          2HB       SER  52  -6.423  10.518  -2.422
  403    HG   SER  52           HG       SER  52  -8.390  11.331  -2.232
  404    H    GLU  53           H        GLU  53  -8.029  10.451   1.764
  405    HA   GLU  53           HA       GLU  53  -6.193  12.236   3.160
  406   1HB   GLU  53          1HB       GLU  53  -8.657  12.672   3.144
  407   2HB   GLU  53          2HB       GLU  53  -8.891  11.175   4.034
  408   1HG   GLU  53          1HG       GLU  53  -7.503  12.098   5.863
  409   2HG   GLU  53          2HG       GLU  53  -7.414  13.621   4.977
  410    H    GLU  54           H        GLU  54  -7.296   8.953   3.120
  411    HA   GLU  54           HA       GLU  54  -6.167   8.322   5.720
  412   1HB   GLU  54          1HB       GLU  54  -7.424   6.481   3.676
  413   2HB   GLU  54          2HB       GLU  54  -7.053   6.086   5.348
  414   1HG   GLU  54          1HG       GLU  54  -9.019   8.198   4.497
  415   2HG   GLU  54          2HG       GLU  54  -9.449   6.540   4.904
  416    H    CYS  55           H        CYS  55  -5.348   8.085   2.347
  417    HA   CYS  55           HA       CYS  55  -2.991   6.472   3.027
  418   1HB   CYS  55          1HB       CYS  55  -2.779   6.038   0.621
  419   2HB   CYS  55          2HB       CYS  55  -4.370   5.569   1.211
  420    HG   CYS  55           HG       CYS  55  -3.942   8.626  -0.205
  421    H    ARG  56           H        ARG  56  -1.270   7.618   3.501
  422    HA   ARG  56           HA       ARG  56  -0.894  10.261   2.299
  423   1HB   ARG  56          1HB       ARG  56  -0.737  10.112   4.737
  424   2HB   ARG  56          2HB       ARG  56   0.521   8.893   4.598
  425   1HG   ARG  56          1HG       ARG  56   1.977  10.552   3.510
  426   2HG   ARG  56          2HG       ARG  56   0.720  11.770   3.733
  427   1HD   ARG  56          1HD       ARG  56   2.346  11.991   5.489
  428   2HD   ARG  56          2HD       ARG  56   0.837  11.388   6.171
  429    HE   ARG  56           HE       ARG  56   2.118   9.105   5.814
  430   1HH1  ARG  56          1HH1      ARG  56   3.332  12.144   7.020
  431   2HH1  ARG  56          2HH1      ARG  56   4.492  11.423   8.090
  432   1HH2  ARG  56          1HH2      ARG  56   3.665   8.113   7.219
  433   2HH2  ARG  56          2HH2      ARG  56   4.709   9.134   8.175
  434    H    PHE  57           H        PHE  57  -0.023   9.929   0.289
  435    HA   PHE  57           HA       PHE  57   2.038   8.043  -0.232
  436   1HB   PHE  57          1HB       PHE  57   0.637   8.882  -2.048
  437   2HB   PHE  57          2HB       PHE  57   1.226  10.519  -1.777
  438    HD1  PHE  57           HD1      PHE  57   2.863   7.178  -2.165
  439    HD2  PHE  57           HD2      PHE  57   2.594  11.219  -3.471
  440    HE1  PHE  57           HE1      PHE  57   4.691   6.779  -3.763
  441    HE2  PHE  57           HE2      PHE  57   4.420  10.827  -5.071
  442    HZ   PHE  57           HZ       PHE  57   5.471   8.605  -5.219
  443    H    CYS  58           H        CYS  58   3.975   8.144   0.664
  444    HA   CYS  58           HA       CYS  58   5.039  10.598   1.698
  445   1HB   CYS  58          1HB       CYS  58   6.345   7.881   1.434
  446   2HB   CYS  58          2HB       CYS  58   6.935   9.221   2.411
  447    HG   CYS  58           HG       CYS  58   5.441   6.891   3.669
  448    H    HIS  59           H        HIS  59   6.483   8.242  -0.547
  449    HA   HIS  59           HA       HIS  59   6.915   9.929  -2.699
  450   1HB   HIS  59          1HB       HIS  59   9.254  10.552  -2.531
  451   2HB   HIS  59          2HB       HIS  59   8.393  11.202  -1.146
  452    HD1  HIS  59           HD1      HIS  59  11.469   9.719  -1.916
  453    HD2  HIS  59           HD2      HIS  59   8.731   9.173   1.163
  454    HE1  HIS  59           HE1      HIS  59  12.761   8.656  -0.042
  455    HE2  HIS  59           HE2      HIS  59  11.028   8.115   1.704
  456    H    SER  60           H        SER  60   9.313   9.007  -3.715
  457    HA   SER  60           HA       SER  60   9.013   6.085  -3.569
  458   1HB   SER  60          1HB       SER  60   8.600   7.196  -5.802
  459   2HB   SER  60          2HB       SER  60  10.298   7.668  -5.806
  460    HG   SER  60           HG       SER  60   9.693   4.984  -5.330
  461    H    GLU  61           H        GLU  61  10.612   4.993  -2.613
  462    HA   GLU  61           HA       GLU  61  13.281   6.234  -2.544
  463   1HB   GLU  61          1HB       GLU  61  13.554   5.014  -0.304
  464   2HB   GLU  61          2HB       GLU  61  12.584   6.480  -0.325
  465   1HG   GLU  61          1HG       GLU  61  11.055   4.028  -0.770
  466   2HG   GLU  61          2HG       GLU  61  11.850   4.118   0.802
  467    H    LYS  62           H        LYS  62  14.919   4.419  -1.723
  468    HA   LYS  62           HA       LYS  62  14.891   2.529  -3.891
  469   1HB   LYS  62          1HB       LYS  62  16.862   2.884  -1.629
  470   2HB   LYS  62          2HB       LYS  62  17.108   1.874  -3.049
  471   1HG   LYS  62          1HG       LYS  62  17.047   3.821  -4.483
  472   2HG   LYS  62          2HG       LYS  62  16.705   4.851  -3.096
  473   1HD   LYS  62          1HD       LYS  62  18.871   4.187  -2.112
  474   2HD   LYS  62          2HD       LYS  62  19.206   3.227  -3.554
  475   1HE   LYS  62          1HE       LYS  62  18.832   6.216  -3.412
  476   2HE   LYS  62          2HE       LYS  62  20.339   5.354  -3.716
  477   1HZ   LYS  62          1HZ       LYS  62  19.508   6.125  -5.785
  478   2HZ   LYS  62          2HZ       LYS  62  19.263   4.450  -5.757
  479   3HZ   LYS  62          3HZ       LYS  62  17.962   5.504  -5.485
  480    H    ALA  63           H        ALA  63  14.108   0.577  -3.845
  481    HA   ALA  63           HA       ALA  63  13.512  -0.671  -1.247
  482   1HB   ALA  63          1HB       ALA  63  11.890  -2.036  -2.486
  483   2HB   ALA  63          2HB       ALA  63  11.561  -0.311  -2.619
  484   3HB   ALA  63          3HB       ALA  63  12.312  -1.170  -3.962
  485    HA   PRO  64           HA       PRO  64  16.257  -4.061  -2.326
  486   1HB   PRO  64          1HB       PRO  64  14.588  -5.849  -0.745
  487   2HB   PRO  64          2HB       PRO  64  16.219  -5.269  -0.404
  488   1HG   PRO  64          1HG       PRO  64  14.045  -4.514   1.040
  489   2HG   PRO  64          2HG       PRO  64  15.470  -3.484   0.820
  490   1HD   PRO  64          1HD       PRO  64  12.823  -3.386  -0.576
  491   2HD   PRO  64          2HD       PRO  64  13.846  -2.050   0.002
  492    H    ASP  65           H        ASP  65  16.263  -5.772  -3.749
  493    HA   ASP  65           HA       ASP  65  14.187  -5.980  -5.620
  494   1HB   ASP  65          1HB       ASP  65  16.681  -7.520  -5.057
  495   2HB   ASP  65          2HB       ASP  65  15.501  -8.214  -6.161
  496    H    GLU  66           H        GLU  66  14.674  -7.531  -2.610
  497    HA   GLU  66           HA       GLU  66  13.306  -9.924  -2.865
  498   1HB   GLU  66          1HB       GLU  66  13.064  -8.138  -0.451
  499   2HB   GLU  66          2HB       GLU  66  13.034  -9.893  -0.504
  500   1HG   GLU  66          1HG       GLU  66  15.408  -8.117  -1.002
  501   2HG   GLU  66          2HG       GLU  66  15.119  -9.128   0.413
  502    H    VAL  67           H        VAL  67  12.013  -6.692  -2.151
  503    HA   VAL  67           HA       VAL  67   9.315  -7.766  -2.010
  504    HB   VAL  67           HB       VAL  67   8.613  -5.530  -1.342
  505   1HG1  VAL  67          1HG1      VAL  67   9.857  -5.364   0.761
  506   2HG1  VAL  67          2HG1      VAL  67   9.443  -7.034   0.375
  507   3HG1  VAL  67          3HG1      VAL  67  11.087  -6.452   0.114
  508   1HG2  VAL  67          1HG2      VAL  67  11.495  -4.733  -1.753
  509   2HG2  VAL  67          2HG2      VAL  67  10.119  -4.200  -2.720
  510   3HG2  VAL  67          3HG2      VAL  67  10.243  -3.725  -1.025
  511    H    ILE  68           H        ILE  68  11.364  -6.310  -4.306
  512    HA   ILE  68           HA       ILE  68   9.543  -4.890  -5.896
  513    HB   ILE  68           HB       ILE  68  12.041  -6.369  -6.742
  514   1HG1  ILE  68          1HG1      ILE  68  12.522  -4.670  -5.087
  515   2HG1  ILE  68          2HG1      ILE  68  13.071  -4.109  -6.663
  516   1HG2  ILE  68          1HG2      ILE  68  12.029  -4.895  -8.709
  517   2HG2  ILE  68          2HG2      ILE  68  10.624  -5.962  -8.665
  518   3HG2  ILE  68          3HG2      ILE  68  10.459  -4.266  -8.211
  519   1HD1  ILE  68          1HD1      ILE  68  11.080  -2.713  -6.859
  520   2HD1  ILE  68          2HD1      ILE  68  10.528  -3.281  -5.283
  521   3HD1  ILE  68          3HD1      ILE  68  12.006  -2.326  -5.408
  522    H    GLU  69           H        GLU  69  10.638  -8.260  -6.107
  523    HA   GLU  69           HA       GLU  69   9.111  -9.014  -8.319
  524   1HB   GLU  69          1HB       GLU  69  10.174 -10.598  -5.987
  525   2HB   GLU  69          2HB       GLU  69   9.354 -11.347  -7.350
  526   1HG   GLU  69          1HG       GLU  69  11.816  -9.636  -7.594
  527   2HG   GLU  69          2HG       GLU  69  11.833 -11.396  -7.485
  528    H    ALA  70           H        ALA  70   8.263  -8.805  -4.918
  529    HA   ALA  70           HA       ALA  70   5.809 -10.213  -5.087
  530   1HB   ALA  70          1HB       ALA  70   6.978  -9.829  -2.965
  531   2HB   ALA  70          2HB       ALA  70   6.642  -8.103  -3.098
  532   3HB   ALA  70          3HB       ALA  70   5.313  -9.247  -2.911
  533    H    ILE  71           H        ILE  71   6.675  -6.798  -5.372
  534    HA   ILE  71           HA       ILE  71   4.025  -5.818  -5.636
  535    HB   ILE  71           HB       ILE  71   6.583  -4.599  -6.703
  536   1HG1  ILE  71          1HG1      ILE  71   5.175  -4.120  -4.067
  537   2HG1  ILE  71          2HG1      ILE  71   6.633  -5.088  -4.261
  538   1HG2  ILE  71          1HG2      ILE  71   3.906  -3.352  -6.081
  539   2HG2  ILE  71          2HG2      ILE  71   5.355  -2.478  -6.578
  540   3HG2  ILE  71          3HG2      ILE  71   4.586  -3.614  -7.688
  541   1HD1  ILE  71          1HD1      ILE  71   7.843  -3.125  -5.028
  542   2HD1  ILE  71          2HD1      ILE  71   6.379  -2.154  -4.870
  543   3HD1  ILE  71          3HD1      ILE  71   7.129  -2.854  -3.437
  544    H    LYS  72           H        LYS  72   6.376  -7.101  -7.876
  545    HA   LYS  72           HA       LYS  72   4.986  -6.396 -10.258
  546   1HB   LYS  72          1HB       LYS  72   7.077  -8.501  -9.695
  547   2HB   LYS  72          2HB       LYS  72   6.502  -8.082 -11.305
  548   1HG   LYS  72          1HG       LYS  72   7.375  -5.892 -11.133
  549   2HG   LYS  72          2HG       LYS  72   7.736  -6.096  -9.422
  550   1HD   LYS  72          1HD       LYS  72   9.746  -6.273 -10.829
  551   2HD   LYS  72          2HD       LYS  72   9.415  -7.759  -9.939
  552   1HE   LYS  72          1HE       LYS  72   8.373  -8.707 -11.955
  553   2HE   LYS  72          2HE       LYS  72   8.770  -7.231 -12.837
  554   1HZ   LYS  72          1HZ       LYS  72  10.763  -9.019 -11.545
  555   2HZ   LYS  72          2HZ       LYS  72  10.384  -9.026 -13.200
  556   3HZ   LYS  72          3HZ       LYS  72  11.096  -7.656 -12.502
  557    H    GLN  73           H        GLN  73   4.923  -9.126  -8.093
  558    HA   GLN  73           HA       GLN  73   3.303 -10.733  -9.865
  559   1HB   GLN  73          1HB       GLN  73   5.000 -11.707  -8.312
  560   2HB   GLN  73          2HB       GLN  73   3.976 -11.234  -6.965
  561   1HG   GLN  73          1HG       GLN  73   3.708 -13.594  -7.537
  562   2HG   GLN  73          2HG       GLN  73   2.209 -12.687  -7.750
  563   1HE2  GLN  73          2HE2      GLN  73   4.871 -12.482  -9.994
  564   2HE2  GLN  73          1HE2      GLN  73   4.081 -13.296 -11.306
  565    H    ASN  74           H        ASN  74   2.801  -9.290  -6.637
  566    HA   ASN  74           HA       ASN  74  -0.011  -9.965  -6.700
  567   1HB   ASN  74          1HB       ASN  74   1.597  -8.346  -4.711
  568   2HB   ASN  74          2HB       ASN  74  -0.085  -8.810  -4.499
  569   1HD2  ASN  74          2HD2      ASN  74   2.298  -9.411  -2.909
  570   2HD2  ASN  74          1HD2      ASN  74   2.369 -11.137  -2.807
  571    H    GLY  75           H        GLY  75   1.991  -7.177  -7.256
  572   1HA   GLY  75          1HA       GLY  75   1.181  -5.299  -8.525
  573   2HA   GLY  75          2HA       GLY  75  -0.415  -5.577  -7.830
  574    H    TYR  76           H        TYR  76   1.316  -6.137  -5.284
  575    HA   TYR  76           HA       TYR  76   2.137  -3.529  -4.440
  576   1HB   TYR  76          1HB       TYR  76   0.394  -3.284  -2.683
  577   2HB   TYR  76          2HB       TYR  76  -0.279  -3.193  -4.307
  578    HD1  TYR  76           HD1      TYR  76  -0.186  -5.087  -1.194
  579    HD2  TYR  76           HD2      TYR  76  -1.637  -5.054  -5.195
  580    HE1  TYR  76           HE1      TYR  76  -1.773  -6.879  -0.630
  581    HE2  TYR  76           HE2      TYR  76  -3.227  -6.844  -4.638
  582    HH   TYR  76           HH       TYR  76  -3.892  -7.785  -1.437
  583    H    PHE  77           H        PHE  77   2.990  -3.568  -2.266
  584    HA   PHE  77           HA       PHE  77   3.153  -6.247  -1.052
  585   1HB   PHE  77          1HB       PHE  77   5.331  -5.569  -2.071
  586   2HB   PHE  77          2HB       PHE  77   5.345  -4.156  -1.023
  587    HD1  PHE  77           HD1      PHE  77   5.931  -4.333   1.288
  588    HD2  PHE  77           HD2      PHE  77   5.598  -7.816  -1.133
  589    HE1  PHE  77           HE1      PHE  77   7.036  -5.654   3.044
  590    HE2  PHE  77           HE2      PHE  77   6.702  -9.143   0.619
  591    HZ   PHE  77           HZ       PHE  77   7.422  -8.064   2.710
  592    H    ILE  78           H        ILE  78   2.421  -6.327   0.977
  593    HA   ILE  78           HA       ILE  78   1.704  -3.784   2.246
  594    HB   ILE  78           HB       ILE  78   0.794  -6.597   2.888
  595   1HG1  ILE  78          1HG1      ILE  78  -0.089  -5.757   0.758
  596   2HG1  ILE  78          2HG1      ILE  78  -1.363  -5.882   1.965
  597   1HG2  ILE  78          1HG2      ILE  78  -0.842  -5.537   4.373
  598   2HG2  ILE  78          2HG2      ILE  78   0.813  -5.200   4.883
  599   3HG2  ILE  78          3HG2      ILE  78  -0.121  -3.962   4.040
  600   1HD1  ILE  78          1HD1      ILE  78   0.038  -3.353   1.127
  601   2HD1  ILE  78          2HD1      ILE  78  -1.587  -3.853   0.658
  602   3HD1  ILE  78          3HD1      ILE  78  -1.233  -3.471   2.343
  603    H    TYR  79           H        TYR  79   3.439  -3.068   3.353
  604    HA   TYR  79           HA       TYR  79   4.971  -4.873   5.026
  605   1HB   TYR  79          1HB       TYR  79   6.167  -3.078   3.898
  606   2HB   TYR  79          2HB       TYR  79   5.121  -1.874   4.636
  607    HD1  TYR  79           HD1      TYR  79   7.518  -4.583   5.579
  608    HD2  TYR  79           HD2      TYR  79   5.831  -0.803   6.566
  609    HE1  TYR  79           HE1      TYR  79   9.091  -4.375   7.458
  610    HE2  TYR  79           HE2      TYR  79   7.397  -0.588   8.446
  611    HH   TYR  79           HH       TYR  79   8.763  -1.950   9.874
  612    H    LYS  80           H        LYS  80   3.540  -5.618   6.545
  613    HA   LYS  80           HA       LYS  80   1.782  -3.968   8.026
  614   1HB   LYS  80          1HB       LYS  80   2.912  -6.672   8.776
  615   2HB   LYS  80          2HB       LYS  80   1.518  -5.897   9.514
  616   1HG   LYS  80          1HG       LYS  80   0.346  -5.991   7.355
  617   2HG   LYS  80          2HG       LYS  80   1.733  -6.835   6.662
  618   1HD   LYS  80          1HD       LYS  80   1.438  -8.632   8.324
  619   2HD   LYS  80          2HD       LYS  80   0.014  -7.798   8.948
  620   1HE   LYS  80          1HE       LYS  80  -1.023  -7.985   6.709
  621   2HE   LYS  80          2HE       LYS  80   0.376  -8.913   6.169
  622   1HZ   LYS  80          1HZ       LYS  80  -0.138 -10.577   7.864
  623   2HZ   LYS  80          2HZ       LYS  80  -1.499  -9.687   8.344
  624   3HZ   LYS  80          3HZ       LYS  80  -1.434 -10.368   6.792
  625    H    MET  81           H        MET  81   2.730  -2.261   9.007
  626    HA   MET  81           HA       MET  81   5.251  -2.385  10.279
  627   1HB   MET  81          1HB       MET  81   4.421  -0.293   9.382
  628   2HB   MET  81          2HB       MET  81   3.050  -0.330  10.482
  629   1HG   MET  81          1HG       MET  81   4.564  -0.115  12.383
  630   2HG   MET  81          2HG       MET  81   5.942  -0.082  11.285
  631   1HE   MET  81          1HE       MET  81   6.469   1.867   9.619
  632   2HE   MET  81          2HE       MET  81   5.415   3.259   9.362
  633   3HE   MET  81          3HE       MET  81   4.884   1.648   8.876
  634    H    GLU  82           H        GLU  82   2.051  -1.755  11.728
  635    HA   GLU  82           HA       GLU  82   2.688  -3.494  13.966
  636   1HB   GLU  82          1HB       GLU  82   3.658  -1.215  14.481
  637   2HB   GLU  82          2HB       GLU  82   2.019  -0.582  14.446
  638   1HG   GLU  82          1HG       GLU  82   1.395  -1.896  16.338
  639   2HG   GLU  82          2HG       GLU  82   2.925  -2.771  16.299
  640    H    GLY  83           H        GLY  83   0.755  -3.309  11.746
  641   1HA   GLY  83          1HA       GLY  83  -1.766  -2.537  12.951
  642   2HA   GLY  83          2HA       GLY  83  -1.532  -3.156  11.324
  643    H    CYS  84           H        CYS  84   0.015  -5.100  13.595
  644    HA   CYS  84           HA       CYS  84  -2.056  -7.129  13.247
  645   1HB   CYS  84          1HB       CYS  84   0.751  -7.425  14.332
  646   2HB   CYS  84          2HB       CYS  84  -0.345  -8.731  13.895
  647    HG   CYS  84           HG       CYS  84   1.345  -8.817  11.826
  648    H    ASN  85           H        ASN  85  -1.408  -4.828  15.469
  649    HA   ASN  85           HA       ASN  85  -2.377  -6.498  17.694
  650   1HB   ASN  85          1HB       ASN  85  -0.082  -5.881  18.171
  651   2HB   ASN  85          2HB       ASN  85  -0.423  -4.191  17.815
  652   1HD2  ASN  85          2HD2      ASN  85  -1.572  -2.961  19.292
  653   2HD2  ASN  85          1HD2      ASN  85  -1.809  -3.466  20.935
  Start of MODEL   12
    1    H    MET   1           H        MET   1  12.612   0.437 -11.624
    2    HA   MET   1           HA       MET   1   9.673   0.407 -11.307
    3   1HB   MET   1          1HB       MET   1  10.727  -1.814 -11.698
    4   2HB   MET   1          2HB       MET   1  11.785  -1.528 -10.324
    5   1HG   MET   1          1HG       MET   1   9.988  -1.622  -8.799
    6   2HG   MET   1          2HG       MET   1   8.793  -1.540 -10.094
    7   1HE   MET   1          1HE       MET   1   7.471  -3.594  -9.141
    8   2HE   MET   1          2HE       MET   1   8.606  -3.698  -7.794
    9   3HE   MET   1          3HE       MET   1   8.213  -5.140  -8.730
   10    H    GLN   2           H        GLN   2   9.046   1.699  -9.728
   11    HA   GLN   2           HA       GLN   2  10.925   2.345  -7.565
   12   1HB   GLN   2          1HB       GLN   2  10.191   4.756  -7.766
   13   2HB   GLN   2          2HB       GLN   2  11.233   4.175  -9.056
   14   1HG   GLN   2          1HG       GLN   2   8.303   4.017  -9.485
   15   2HG   GLN   2          2HG       GLN   2   9.049   5.613  -9.507
   16   1HE2  GLN   2          2HE2      GLN   2   8.537   5.846 -11.698
   17   2HE2  GLN   2          1HE2      GLN   2   9.432   5.025 -12.928
   18    H    ILE   3           H        ILE   3  10.006   2.409  -5.598
   19    HA   ILE   3           HA       ILE   3   7.153   1.825  -5.512
   20    HB   ILE   3           HB       ILE   3   7.570   1.298  -3.095
   21   1HG1  ILE   3          1HG1      ILE   3  10.481   1.502  -3.905
   22   2HG1  ILE   3          2HG1      ILE   3   9.649   2.656  -2.871
   23   1HG2  ILE   3          1HG2      ILE   3   8.613  -0.856  -3.571
   24   2HG2  ILE   3          2HG2      ILE   3   7.432  -0.420  -4.805
   25   3HG2  ILE   3          3HG2      ILE   3   9.155  -0.248  -5.136
   26   1HD1  ILE   3          1HD1      ILE   3  10.110  -0.253  -2.264
   27   2HD1  ILE   3          2HD1      ILE   3  10.981   1.112  -1.567
   28   3HD1  ILE   3          3HD1      ILE   3   9.264   0.894  -1.224
   29    H    HIS   4           H        HIS   4   5.745   3.337  -5.147
   30    HA   HIS   4           HA       HIS   4   6.456   5.765  -3.714
   31   1HB   HIS   4          1HB       HIS   4   3.928   4.798  -5.054
   32   2HB   HIS   4          2HB       HIS   4   3.952   6.246  -4.054
   33    HD1  HIS   4           HD1      HIS   4   3.752   8.102  -5.691
   34    HD2  HIS   4           HD2      HIS   4   6.553   5.263  -6.879
   35    HE1  HIS   4           HE1      HIS   4   4.846   9.047  -7.743
   36    HE2  HIS   4           HE2      HIS   4   6.692   7.427  -8.299
   37    H    VAL   5           H        VAL   5   6.506   5.732  -1.580
   38    HA   VAL   5           HA       VAL   5   5.222   3.592  -0.112
   39    HB   VAL   5           HB       VAL   5   6.822   5.915   0.978
   40   1HG1  VAL   5          1HG1      VAL   5   7.187   4.438   2.899
   41   2HG1  VAL   5          2HG1      VAL   5   5.476   4.781   2.652
   42   3HG1  VAL   5          3HG1      VAL   5   6.144   3.226   2.158
   43   1HG2  VAL   5          1HG2      VAL   5   8.143   4.673  -0.654
   44   2HG2  VAL   5          2HG2      VAL   5   8.744   4.406   0.983
   45   3HG2  VAL   5          3HG2      VAL   5   7.777   3.165   0.184
   46    H    TYR   6           H        TYR   6   3.130   3.780   0.330
   47    HA   TYR   6           HA       TYR   6   2.067   6.407   1.082
   48   1HB   TYR   6          1HB       TYR   6   0.691   3.867   0.208
   49   2HB   TYR   6          2HB       TYR   6  -0.177   5.261   0.842
   50    HD1  TYR   6           HD1      TYR   6  -0.284   7.349  -0.446
   51    HD2  TYR   6           HD2      TYR   6   1.614   3.877  -2.011
   52    HE1  TYR   6           HE1      TYR   6  -0.368   8.326  -2.701
   53    HE2  TYR   6           HE2      TYR   6   1.537   4.847  -4.267
   54    HH   TYR   6           HH       TYR   6   0.115   6.549  -5.484
   55    H    ASP   7           H        ASP   7   2.012   6.829   3.139
   56    HA   ASP   7           HA       ASP   7   2.082   4.795   5.183
   57   1HB   ASP   7          1HB       ASP   7   3.220   7.075   5.287
   58   2HB   ASP   7          2HB       ASP   7   1.622   7.767   5.526
   59    H    THR   8           H        THR   8   0.198   3.644   5.182
   60    HA   THR   8           HA       THR   8  -2.306   5.098   4.806
   61    HB   THR   8           HB       THR   8  -1.875   2.109   4.829
   62    HG1  THR   8           HG1      THR   8  -0.677   3.332   3.175
   63   1HG2  THR   8          1HG2      THR   8  -4.105   3.823   3.720
   64   2HG2  THR   8          2HG2      THR   8  -3.980   2.072   3.562
   65   3HG2  THR   8          3HG2      THR   8  -4.202   2.799   5.154
   66    H    TYR   9           H        TYR   9  -3.280   5.776   6.574
   67    HA   TYR   9           HA       TYR   9  -3.254   4.074   8.979
   68   1HB   TYR   9          1HB       TYR   9  -3.357   7.025   8.568
   69   2HB   TYR   9          2HB       TYR   9  -4.251   6.365   9.934
   70    HD1  TYR   9           HD1      TYR   9  -0.869   6.058   8.366
   71    HD2  TYR   9           HD2      TYR   9  -3.154   6.230  11.949
   72    HE1  TYR   9           HE1      TYR   9   1.199   5.966   9.686
   73    HE2  TYR   9           HE2      TYR   9  -1.088   6.142  13.278
   74    HH   TYR   9           HH       TYR   9   2.008   6.551  11.883
   75    H    VAL  10           H        VAL  10  -4.975   2.763   8.843
   76    HA   VAL  10           HA       VAL  10  -7.584   3.966   8.178
   77    HB   VAL  10           HB       VAL  10  -6.837   1.033   8.202
   78   1HG1  VAL  10          1HG1      VAL  10  -9.197   1.417   8.658
   79   2HG1  VAL  10          2HG1      VAL  10  -9.324   2.437   7.224
   80   3HG1  VAL  10          3HG1      VAL  10  -8.983   0.715   7.054
   81   1HG2  VAL  10          1HG2      VAL  10  -6.915   1.152   5.763
   82   2HG2  VAL  10          2HG2      VAL  10  -7.212   2.889   5.853
   83   3HG2  VAL  10          3HG2      VAL  10  -5.676   2.226   6.412
   84    H    LYS  11           H        LYS  11  -8.665   4.533   9.953
   85    HA   LYS  11           HA       LYS  11  -8.282   3.100  12.452
   86   1HB   LYS  11          1HB       LYS  11 -10.138   5.393  11.761
   87   2HB   LYS  11          2HB       LYS  11  -9.859   4.759  13.378
   88   1HG   LYS  11          1HG       LYS  11  -7.492   5.413  13.205
   89   2HG   LYS  11          2HG       LYS  11  -7.818   6.097  11.611
   90   1HD   LYS  11          1HD       LYS  11  -9.431   7.649  12.620
   91   2HD   LYS  11          2HD       LYS  11  -9.075   6.973  14.210
   92   1HE   LYS  11          1HE       LYS  11  -7.832   9.013  13.936
   93   2HE   LYS  11          2HE       LYS  11  -6.712   7.653  13.925
   94   1HZ   LYS  11          1HZ       LYS  11  -6.774   7.774  11.456
   95   2HZ   LYS  11          2HZ       LYS  11  -7.680   9.194  11.579
   96   3HZ   LYS  11          3HZ       LYS  11  -6.097   9.145  12.188
   97    H    ALA  12           H        ALA  12  -9.211   1.171  12.543
   98    HA   ALA  12           HA       ALA  12 -11.526   0.547  10.951
   99   1HB   ALA  12          1HB       ALA  12  -9.698  -1.047  11.182
  100   2HB   ALA  12          2HB       ALA  12 -10.000  -1.151  12.915
  101   3HB   ALA  12          3HB       ALA  12 -11.214  -1.725  11.774
  102    H    LYS  13           H        LYS  13 -13.246  -0.866  12.014
  103    HA   LYS  13           HA       LYS  13 -14.768   0.793  13.704
  104   1HB   LYS  13          1HB       LYS  13 -15.708  -0.803  12.065
  105   2HB   LYS  13          2HB       LYS  13 -15.151  -2.138  13.062
  106   1HG   LYS  13          1HG       LYS  13 -17.489  -1.808  13.432
  107   2HG   LYS  13          2HG       LYS  13 -16.613  -1.334  14.886
  108   1HD   LYS  13          1HD       LYS  13 -16.838   0.995  14.325
  109   2HD   LYS  13          2HD       LYS  13 -17.554   0.589  12.764
  110   1HE   LYS  13          1HE       LYS  13 -18.747  -0.040  15.464
  111   2HE   LYS  13          2HE       LYS  13 -19.248   1.275  14.402
  112   1HZ   LYS  13          1HZ       LYS  13 -19.424  -1.632  13.805
  113   2HZ   LYS  13          2HZ       LYS  13 -20.718  -0.596  14.145
  114   3HZ   LYS  13          3HZ       LYS  13 -19.827  -0.397  12.718
  115    H    ASP  14           H        ASP  14 -12.557  -1.790  14.336
  116    HA   ASP  14           HA       ASP  14 -13.344  -2.499  16.947
  117   1HB   ASP  14          1HB       ASP  14 -10.676  -2.636  15.543
  118   2HB   ASP  14          2HB       ASP  14 -10.939  -3.276  17.158
  119    H    GLY  15           H        GLY  15 -12.127   0.438  15.859
  120   1HA   GLY  15          1HA       GLY  15 -11.222   2.255  16.983
  121   2HA   GLY  15          2HA       GLY  15 -11.347   1.334  18.482
  122    H    HIS  16           H        HIS  16  -9.833   0.093  15.650
  123    HA   HIS  16           HA       HIS  16  -7.229   0.128  17.019
  124   1HB   HIS  16          1HB       HIS  16  -8.381  -2.101  16.733
  125   2HB   HIS  16          2HB       HIS  16  -8.222  -1.885  14.999
  126    HD1  HIS  16           HD1      HIS  16  -6.105  -2.366  18.087
  127    HD2  HIS  16           HD2      HIS  16  -5.826  -2.675  13.954
  128    HE1  HIS  16           HE1      HIS  16  -3.917  -3.524  17.644
  129    HE2  HIS  16           HE2      HIS  16  -3.919  -3.935  15.156
  130    H    VAL  17           H        VAL  17  -5.458   0.718  15.846
  131    HA   VAL  17           HA       VAL  17  -6.084   2.226  13.421
  132    HB   VAL  17           HB       VAL  17  -3.544   2.301  15.054
  133   1HG1  VAL  17          1HG1      VAL  17  -4.635   4.197  12.980
  134   2HG1  VAL  17          2HG1      VAL  17  -3.151   4.423  13.905
  135   3HG1  VAL  17          3HG1      VAL  17  -3.283   3.086  12.763
  136   1HG2  VAL  17          1HG2      VAL  17  -5.934   4.139  15.184
  137   2HG2  VAL  17          2HG2      VAL  17  -5.439   2.990  16.427
  138   3HG2  VAL  17          3HG2      VAL  17  -4.408   4.367  16.040
  139    H    MET  18           H        MET  18  -5.953   0.959  11.693
  140    HA   MET  18           HA       MET  18  -3.814  -0.986  11.404
  141   1HB   MET  18          1HB       MET  18  -6.032  -0.184   9.502
  142   2HB   MET  18          2HB       MET  18  -4.916  -1.520   9.260
  143   1HG   MET  18          1HG       MET  18  -6.827  -1.319  11.573
  144   2HG   MET  18          2HG       MET  18  -7.166  -2.182  10.073
  145   1HE   MET  18          1HE       MET  18  -4.511  -5.035  10.125
  146   2HE   MET  18          2HE       MET  18  -4.409  -3.467   9.325
  147   3HE   MET  18          3HE       MET  18  -5.922  -4.372   9.299
  148    H    HIS  19           H        HIS  19  -1.893   0.099  11.115
  149    HA   HIS  19           HA       HIS  19  -1.821   1.860   8.773
  150   1HB   HIS  19          1HB       HIS  19  -0.119   3.277   9.863
  151   2HB   HIS  19          2HB       HIS  19  -1.681   3.338  10.658
  152    HD1  HIS  19           HD1      HIS  19   1.839   2.934  11.327
  153    HD2  HIS  19           HD2      HIS  19  -1.704   1.713  13.127
  154    HE1  HIS  19           HE1      HIS  19   2.443   2.396  13.706
  155    HE2  HIS  19           HE2      HIS  19   0.311   1.537  14.749
  156    H    PHE  20           H        PHE  20  -0.543   1.249   7.280
  157    HA   PHE  20           HA       PHE  20   1.876  -0.253   7.864
  158   1HB   PHE  20          1HB       PHE  20   1.176  -1.945   6.070
  159   2HB   PHE  20          2HB       PHE  20   0.396  -2.087   7.641
  160    HD1  PHE  20           HD1      PHE  20  -1.946  -1.526   7.923
  161    HD2  PHE  20           HD2      PHE  20  -0.065  -1.251   4.114
  162    HE1  PHE  20           HE1      PHE  20  -4.155  -1.410   6.845
  163    HE2  PHE  20           HE2      PHE  20  -2.270  -1.135   3.029
  164    HZ   PHE  20           HZ       PHE  20  -4.320  -1.212   4.395
  165    H    ASP  21           H        ASP  21   3.174  -0.574   5.837
  166    HA   ASP  21           HA       ASP  21   2.992   1.888   4.262
  167   1HB   ASP  21          1HB       ASP  21   5.247  -0.121   4.451
  168   2HB   ASP  21          2HB       ASP  21   5.305   1.412   3.594
  169    H    VAL  22           H        VAL  22   1.959   1.768   2.410
  170    HA   VAL  22           HA       VAL  22   1.831  -0.760   0.961
  171    HB   VAL  22           HB       VAL  22   0.517   1.883   0.294
  172   1HG1  VAL  22          1HG1      VAL  22   0.794   0.414  -1.640
  173   2HG1  VAL  22          2HG1      VAL  22  -0.007  -0.893  -0.769
  174   3HG1  VAL  22          3HG1      VAL  22  -0.904   0.567  -1.191
  175   1HG2  VAL  22          1HG2      VAL  22  -0.318   1.065   2.406
  176   2HG2  VAL  22          2HG2      VAL  22  -1.542   0.834   1.160
  177   3HG2  VAL  22          3HG2      VAL  22  -0.583  -0.536   1.716
  178    H    PHE  23           H        PHE  23   3.630  -1.157  -0.165
  179    HA   PHE  23           HA       PHE  23   5.008   0.998  -1.549
  180   1HB   PHE  23          1HB       PHE  23   5.617  -1.964  -1.396
  181   2HB   PHE  23          2HB       PHE  23   6.626  -0.770  -2.206
  182    HD1  PHE  23           HD1      PHE  23   7.009   1.392  -0.522
  183    HD2  PHE  23           HD2      PHE  23   6.462  -2.677   0.594
  184    HE1  PHE  23           HE1      PHE  23   8.212   1.811   1.581
  185    HE2  PHE  23           HE2      PHE  23   7.662  -2.262   2.701
  186    HZ   PHE  23           HZ       PHE  23   8.539  -0.019   3.195
  187    H    THR  24           H        THR  24   4.266   1.644  -3.444
  188    HA   THR  24           HA       THR  24   3.100  -0.380  -5.240
  189    HB   THR  24           HB       THR  24   1.826   1.586  -6.238
  190    HG1  THR  24           HG1      THR  24   2.575   2.776  -3.751
  191   1HG2  THR  24          1HG2      THR  24   0.743  -0.101  -4.843
  192   2HG2  THR  24          2HG2      THR  24   1.224   0.779  -3.393
  193   3HG2  THR  24          3HG2      THR  24   0.075   1.500  -4.519
  194    H    ASP  25           H        ASP  25   4.290  -0.753  -6.986
  195    HA   ASP  25           HA       ASP  25   6.221   1.153  -7.972
  196   1HB   ASP  25          1HB       ASP  25   6.850  -1.135  -8.197
  197   2HB   ASP  25          2HB       ASP  25   5.307  -1.562  -8.926
  198    H    VAL  26           H        VAL  26   2.984   0.134  -8.669
  199    HA   VAL  26           HA       VAL  26   2.728   1.367 -11.212
  200    HB   VAL  26           HB       VAL  26   0.559   0.734  -9.200
  201   1HG1  VAL  26          1HG1      VAL  26   0.397   1.201 -12.174
  202   2HG1  VAL  26          2HG1      VAL  26  -0.943   0.733 -11.128
  203   3HG1  VAL  26          3HG1      VAL  26  -0.168   2.303 -10.919
  204   1HG2  VAL  26          1HG2      VAL  26   1.647  -0.930 -11.469
  205   2HG2  VAL  26          2HG2      VAL  26   1.832  -1.258  -9.746
  206   3HG2  VAL  26          3HG2      VAL  26   0.235  -1.331 -10.490
  207    H    ARG  27           H        ARG  27   2.872   3.487 -11.561
  208    HA   ARG  27           HA       ARG  27   2.494   5.355  -9.399
  209   1HB   ARG  27          1HB       ARG  27   4.265   5.665 -11.130
  210   2HB   ARG  27          2HB       ARG  27   2.999   5.960 -12.318
  211   1HG   ARG  27          1HG       ARG  27   2.236   7.887 -10.999
  212   2HG   ARG  27          2HG       ARG  27   3.547   7.604  -9.855
  213   1HD   ARG  27          1HD       ARG  27   4.181   9.353 -11.381
  214   2HD   ARG  27          2HD       ARG  27   5.169   7.925 -11.684
  215    HE   ARG  27           HE       ARG  27   3.626   7.482 -13.595
  216   1HH1  ARG  27          1HH1      ARG  27   3.937  10.723 -12.311
  217   2HH1  ARG  27          2HH1      ARG  27   3.586  11.499 -13.830
  218   1HH2  ARG  27          1HH2      ARG  27   3.150   8.479 -15.579
  219   2HH2  ARG  27          2HH2      ARG  27   3.148  10.216 -15.706
  220    H    ASP  28           H        ASP  28   0.355   5.099  -8.874
  221    HA   ASP  28           HA       ASP  28  -1.428   6.829 -10.305
  222   1HB   ASP  28          1HB       ASP  28  -1.712   4.649 -11.517
  223   2HB   ASP  28          2HB       ASP  28  -2.213   3.915  -9.998
  224    H    ASP  29           H        ASP  29  -2.922   7.697  -8.889
  225    HA   ASP  29           HA       ASP  29  -2.283   7.217  -6.122
  226   1HB   ASP  29          1HB       ASP  29  -3.564   9.202  -5.642
  227   2HB   ASP  29          2HB       ASP  29  -2.536   9.508  -7.035
  228    H    LYS  30           H        LYS  30  -4.894   6.367  -8.267
  229    HA   LYS  30           HA       LYS  30  -6.641   5.746  -6.012
  230   1HB   LYS  30          1HB       LYS  30  -8.372   5.296  -7.611
  231   2HB   LYS  30          2HB       LYS  30  -7.586   6.798  -8.071
  232   1HG   LYS  30          1HG       LYS  30  -6.284   5.551  -9.760
  233   2HG   LYS  30          2HG       LYS  30  -7.189   4.096  -9.336
  234   1HD   LYS  30          1HD       LYS  30  -9.267   5.181  -9.996
  235   2HD   LYS  30          2HD       LYS  30  -8.384   6.661 -10.383
  236   1HE   LYS  30          1HE       LYS  30  -7.968   3.983 -11.704
  237   2HE   LYS  30          2HE       LYS  30  -8.906   5.314 -12.379
  238   1HZ   LYS  30          1HZ       LYS  30  -6.005   5.449 -11.726
  239   2HZ   LYS  30          2HZ       LYS  30  -6.639   5.188 -13.275
  240   3HZ   LYS  30          3HZ       LYS  30  -6.927   6.655 -12.479
  241    H    LYS  31           H        LYS  31  -4.631   4.170  -8.390
  242    HA   LYS  31           HA       LYS  31  -5.471   1.518  -7.999
  243   1HB   LYS  31          1HB       LYS  31  -2.826   2.701  -8.821
  244   2HB   LYS  31          2HB       LYS  31  -3.071   0.963  -8.700
  245   1HG   LYS  31          1HG       LYS  31  -4.837   2.708 -10.385
  246   2HG   LYS  31          2HG       LYS  31  -3.330   2.021 -10.994
  247   1HD   LYS  31          1HD       LYS  31  -5.568   0.388  -9.799
  248   2HD   LYS  31          2HD       LYS  31  -5.371   0.678 -11.530
  249   1HE   LYS  31          1HE       LYS  31  -3.181  -0.391 -11.469
  250   2HE   LYS  31          2HE       LYS  31  -3.341  -0.645  -9.732
  251   1HZ   LYS  31          1HZ       LYS  31  -5.188  -2.114 -10.116
  252   2HZ   LYS  31          2HZ       LYS  31  -5.149  -1.805 -11.785
  253   3HZ   LYS  31          3HZ       LYS  31  -3.867  -2.630 -11.044
  254    H    ALA  32           H        ALA  32  -3.060   3.476  -6.308
  255    HA   ALA  32           HA       ALA  32  -2.046   1.503  -4.603
  256   1HB   ALA  32          1HB       ALA  32  -1.001   3.693  -4.892
  257   2HB   ALA  32          2HB       ALA  32  -2.358   4.455  -4.063
  258   3HB   ALA  32          3HB       ALA  32  -1.300   3.347  -3.190
  259    H    ILE  33           H        ILE  33  -4.809   3.669  -4.252
  260    HA   ILE  33           HA       ILE  33  -5.546   2.996  -1.635
  261    HB   ILE  33           HB       ILE  33  -7.269   3.900  -3.951
  262   1HG1  ILE  33          1HG1      ILE  33  -6.108   5.443  -1.624
  263   2HG1  ILE  33          2HG1      ILE  33  -5.447   5.445  -3.254
  264   1HG2  ILE  33          1HG2      ILE  33  -8.923   4.538  -2.268
  265   2HG2  ILE  33          2HG2      ILE  33  -8.623   2.800  -2.249
  266   3HG2  ILE  33          3HG2      ILE  33  -7.915   3.831  -1.007
  267   1HD1  ILE  33          1HD1      ILE  33  -7.499   6.464  -4.083
  268   2HD1  ILE  33          2HD1      ILE  33  -8.175   6.435  -2.454
  269   3HD1  ILE  33          3HD1      ILE  33  -6.767   7.436  -2.807
  270    H    GLU  34           H        GLU  34  -6.610   1.679  -4.751
  271    HA   GLU  34           HA       GLU  34  -8.423  -0.186  -3.667
  272   1HB   GLU  34          1HB       GLU  34  -6.975  -0.315  -6.318
  273   2HB   GLU  34          2HB       GLU  34  -8.425  -1.210  -5.884
  274   1HG   GLU  34          1HG       GLU  34  -8.145   1.756  -6.272
  275   2HG   GLU  34          2HG       GLU  34  -9.082   0.623  -7.244
  276    H    PHE  35           H        PHE  35  -4.985  -0.394  -4.471
  277    HA   PHE  35           HA       PHE  35  -4.624  -3.145  -4.140
  278   1HB   PHE  35          1HB       PHE  35  -2.773  -0.816  -3.665
  279   2HB   PHE  35          2HB       PHE  35  -2.256  -2.479  -3.419
  280    HD1  PHE  35           HD1      PHE  35  -1.342  -0.228  -5.432
  281    HD2  PHE  35           HD2      PHE  35  -3.787  -3.699  -5.743
  282    HE1  PHE  35           HE1      PHE  35  -0.774  -0.409  -7.818
  283    HE2  PHE  35           HE2      PHE  35  -3.223  -3.885  -8.131
  284    HZ   PHE  35           HZ       PHE  35  -1.715  -2.239  -9.170
  285    H    ALA  36           H        ALA  36  -4.548  -0.540  -1.731
  286    HA   ALA  36           HA       ALA  36  -3.893  -2.188   0.478
  287   1HB   ALA  36          1HB       ALA  36  -4.626  -0.308   1.858
  288   2HB   ALA  36          2HB       ALA  36  -3.610   0.240   0.525
  289   3HB   ALA  36          3HB       ALA  36  -5.359   0.451   0.444
  290    H    LYS  37           H        LYS  37  -6.934  -1.166  -0.961
  291    HA   LYS  37           HA       LYS  37  -8.654  -2.235   1.004
  292   1HB   LYS  37          1HB       LYS  37  -9.047  -1.565  -1.903
  293   2HB   LYS  37          2HB       LYS  37 -10.353  -2.163  -0.884
  294   1HG   LYS  37          1HG       LYS  37 -10.132  -0.279   0.578
  295   2HG   LYS  37          2HG       LYS  37  -8.731   0.303  -0.313
  296   1HD   LYS  37          1HD       LYS  37 -10.787   1.529  -0.893
  297   2HD   LYS  37          2HD       LYS  37 -10.092   0.686  -2.276
  298   1HE   LYS  37          1HE       LYS  37 -12.476   0.398  -2.296
  299   2HE   LYS  37          2HE       LYS  37 -11.711  -1.145  -1.923
  300   1HZ   LYS  37          1HZ       LYS  37 -12.731   0.655   0.196
  301   2HZ   LYS  37          2HZ       LYS  37 -13.713  -0.505  -0.558
  302   3HZ   LYS  37          3HZ       LYS  37 -12.345  -0.994   0.313
  303    H    GLN  38           H        GLN  38  -7.161  -3.603  -1.847
  304    HA   GLN  38           HA       GLN  38  -8.555  -6.016  -2.001
  305   1HB   GLN  38          1HB       GLN  38  -5.668  -5.407  -2.639
  306   2HB   GLN  38          2HB       GLN  38  -6.454  -6.927  -3.042
  307   1HG   GLN  38          1HG       GLN  38  -8.029  -5.771  -4.468
  308   2HG   GLN  38          2HG       GLN  38  -7.328  -4.218  -4.015
  309   1HE2  GLN  38          2HE2      GLN  38  -5.395  -7.067  -4.564
  310   2HE2  GLN  38          1HE2      GLN  38  -4.663  -6.533  -6.041
  311    H    TRP  39           H        TRP  39  -5.900  -5.063   0.104
  312    HA   TRP  39           HA       TRP  39  -5.550  -7.672   1.223
  313   1HB   TRP  39          1HB       TRP  39  -3.755  -5.965   1.243
  314   2HB   TRP  39          2HB       TRP  39  -4.718  -4.986   2.345
  315    HD1  TRP  39           HD1      TRP  39  -3.401  -8.650   2.345
  316    HE1  TRP  39           HE1      TRP  39  -2.547  -9.182   4.713
  317    HE3  TRP  39           HE3      TRP  39  -4.448  -4.183   4.606
  318    HZ2  TRP  39           HZ2      TRP  39  -2.340  -7.879   7.205
  319    HZ3  TRP  39           HZ3      TRP  39  -3.886  -3.909   6.982
  320    HH2  TRP  39           HH2      TRP  39  -2.854  -5.720   8.256
  321    H    LEU  40           H        LEU  40  -7.375  -4.787   2.092
  322    HA   LEU  40           HA       LEU  40  -8.348  -5.757   4.572
  323   1HB   LEU  40          1HB       LEU  40  -9.554  -3.731   2.687
  324   2HB   LEU  40          2HB       LEU  40 -10.065  -3.998   4.342
  325    HG   LEU  40           HG       LEU  40  -7.344  -2.999   3.496
  326   1HD1  LEU  40          1HD1      LEU  40  -8.069  -0.879   4.477
  327   2HD1  LEU  40          2HD1      LEU  40  -9.090  -1.349   3.118
  328   3HD1  LEU  40          3HD1      LEU  40  -9.668  -1.563   4.771
  329   1HD2  LEU  40          1HD2      LEU  40  -7.232  -4.298   5.548
  330   2HD2  LEU  40          2HD2      LEU  40  -7.012  -2.582   5.893
  331   3HD2  LEU  40          3HD2      LEU  40  -8.558  -3.359   6.235
  332    H    SER  41           H        SER  41  -9.507  -5.973   1.263
  333    HA   SER  41           HA       SER  41 -12.015  -7.127   1.853
  334   1HB   SER  41          1HB       SER  41 -11.491  -6.033  -0.298
  335   2HB   SER  41          2HB       SER  41 -10.363  -7.332  -0.676
  336    HG   SER  41           HG       SER  41 -11.975  -8.651  -1.107
  337    H    SER  42           H        SER  42  -8.829  -8.534   1.201
  338    HA   SER  42           HA       SER  42  -9.789 -11.201   1.045
  339   1HB   SER  42          1HB       SER  42  -7.297 -11.743   1.441
  340   2HB   SER  42          2HB       SER  42  -7.737 -10.861  -0.021
  341    HG   SER  42           HG       SER  42  -6.849  -9.071   0.755
  342    H    ILE  43           H        ILE  43  -8.433  -9.272   3.710
  343    HA   ILE  43           HA       ILE  43  -8.627 -11.448   5.567
  344    HB   ILE  43           HB       ILE  43  -8.202  -9.791   7.334
  345   1HG1  ILE  43          1HG1      ILE  43  -8.257  -7.778   5.077
  346   2HG1  ILE  43          2HG1      ILE  43  -9.418  -7.886   6.394
  347   1HG2  ILE  43          1HG2      ILE  43  -6.386  -9.537   4.943
  348   2HG2  ILE  43          2HG2      ILE  43  -5.958  -9.136   6.606
  349   3HG2  ILE  43          3HG2      ILE  43  -6.331 -10.803   6.170
  350   1HD1  ILE  43          1HD1      ILE  43  -7.664  -7.323   7.991
  351   2HD1  ILE  43          2HD1      ILE  43  -6.495  -7.232   6.674
  352   3HD1  ILE  43          3HD1      ILE  43  -7.830  -6.083   6.748
  353    H    GLY  44           H        GLY  44 -10.789  -9.030   4.373
  354   1HA   GLY  44          1HA       GLY  44 -13.134  -9.536   4.422
  355   2HA   GLY  44          2HA       GLY  44 -12.901 -10.294   5.987
  356    H    GLU  45           H        GLU  45 -11.150  -7.501   6.057
  357    HA   GLU  45           HA       GLU  45 -13.177  -6.262   7.730
  358   1HB   GLU  45          1HB       GLU  45 -10.298  -5.485   7.245
  359   2HB   GLU  45          2HB       GLU  45 -11.366  -4.753   8.434
  360   1HG   GLU  45          1HG       GLU  45 -10.480  -7.631   8.405
  361   2HG   GLU  45          2HG       GLU  45  -9.836  -6.363   9.444
  362    H    GLU  46           H        GLU  46 -12.873  -6.256   4.610
  363    HA   GLU  46           HA       GLU  46 -12.665  -3.594   3.765
  364   1HB   GLU  46          1HB       GLU  46 -12.612  -5.465   2.204
  365   2HB   GLU  46          2HB       GLU  46 -14.275  -5.872   2.594
  366   1HG   GLU  46          1HG       GLU  46 -14.161  -4.738   0.471
  367   2HG   GLU  46          2HG       GLU  46 -15.010  -3.738   1.648
  368    H    GLY  47           H        GLY  47 -14.248  -2.045   3.281
  369   1HA   GLY  47          1HA       GLY  47 -16.712  -1.540   3.393
  370   2HA   GLY  47          2HA       GLY  47 -16.665  -2.306   4.978
  371    H    ALA  48           H        ALA  48 -13.902  -1.121   5.300
  372    HA   ALA  48           HA       ALA  48 -14.699   1.320   6.569
  373   1HB   ALA  48          1HB       ALA  48 -12.943  -0.088   7.526
  374   2HB   ALA  48          2HB       ALA  48 -11.936   0.192   6.106
  375   3HB   ALA  48          3HB       ALA  48 -12.341   1.533   7.178
  376    H    THR  49           H        THR  49 -14.084   3.427   5.993
  377    HA   THR  49           HA       THR  49 -13.983   3.854   3.159
  378    HB   THR  49           HB       THR  49 -13.694   6.015   5.232
  379    HG1  THR  49           HG1      THR  49 -15.714   5.744   5.831
  380   1HG2  THR  49          1HG2      THR  49 -15.042   5.920   2.532
  381   2HG2  THR  49          2HG2      THR  49 -14.902   7.335   3.573
  382   3HG2  THR  49          3HG2      THR  49 -13.457   6.620   2.860
  383    H    VAL  50           H        VAL  50 -12.069   3.431   2.215
  384    HA   VAL  50           HA       VAL  50  -9.660   4.638   3.391
  385    HB   VAL  50           HB       VAL  50  -9.922   2.441   1.326
  386   1HG1  VAL  50          1HG1      VAL  50  -7.405   3.647   2.476
  387   2HG1  VAL  50          2HG1      VAL  50  -7.499   2.288   1.354
  388   3HG1  VAL  50          3HG1      VAL  50  -8.002   3.897   0.836
  389   1HG2  VAL  50          1HG2      VAL  50  -8.828   2.423   4.135
  390   2HG2  VAL  50          2HG2      VAL  50 -10.370   1.734   3.620
  391   3HG2  VAL  50          3HG2      VAL  50  -8.855   1.052   3.026
  392    H    THR  51           H        THR  51  -9.734   6.703   2.683
  393    HA   THR  51           HA       THR  51  -9.716   7.076  -0.246
  394    HB   THR  51           HB       THR  51 -10.326   9.434   0.170
  395    HG1  THR  51           HG1      THR  51 -10.293   8.555   2.881
  396   1HG2  THR  51          1HG2      THR  51 -12.096   7.800  -0.276
  397   2HG2  THR  51          2HG2      THR  51 -12.230   7.467   1.451
  398   3HG2  THR  51          3HG2      THR  51 -12.655   9.060   0.825
  399    H    SER  52           H        SER  52  -8.509   9.449  -0.526
  400    HA   SER  52           HA       SER  52  -5.776   8.898  -0.080
  401   1HB   SER  52          1HB       SER  52  -6.984  11.589  -0.739
  402   2HB   SER  52          2HB       SER  52  -5.361  11.015  -1.123
  403    HG   SER  52           HG       SER  52  -6.235  10.409  -2.939
  404    H    GLU  53           H        GLU  53  -8.154  10.218   1.940
  405    HA   GLU  53           HA       GLU  53  -6.500  11.842   3.597
  406   1HB   GLU  53          1HB       GLU  53  -9.155  10.502   4.129
  407   2HB   GLU  53          2HB       GLU  53  -8.413  11.718   5.152
  408   1HG   GLU  53          1HG       GLU  53  -9.269  12.138   2.301
  409   2HG   GLU  53          2HG       GLU  53 -10.168  12.649   3.730
  410    H    GLU  54           H        GLU  54  -7.205   8.480   3.340
  411    HA   GLU  54           HA       GLU  54  -6.061   7.864   5.953
  412   1HB   GLU  54          1HB       GLU  54  -7.435   6.186   3.851
  413   2HB   GLU  54          2HB       GLU  54  -6.630   5.473   5.241
  414   1HG   GLU  54          1HG       GLU  54  -9.000   5.630   5.639
  415   2HG   GLU  54          2HG       GLU  54  -8.134   6.702   6.734
  416    H    CYS  55           H        CYS  55  -5.492   7.330   2.515
  417    HA   CYS  55           HA       CYS  55  -2.873   6.172   3.116
  418   1HB   CYS  55          1HB       CYS  55  -2.858   5.616   0.665
  419   2HB   CYS  55          2HB       CYS  55  -4.169   4.863   1.569
  420    HG   CYS  55           HG       CYS  55  -6.141   6.575   0.654
  421    H    ARG  56           H        ARG  56  -1.577   7.872   3.608
  422    HA   ARG  56           HA       ARG  56  -1.517  10.156   1.766
  423   1HB   ARG  56          1HB       ARG  56  -0.197  11.280   3.547
  424   2HB   ARG  56          2HB       ARG  56  -1.791  10.772   4.089
  425   1HG   ARG  56          1HG       ARG  56  -0.745   8.765   5.105
  426   2HG   ARG  56          2HG       ARG  56   0.833   9.418   4.663
  427   1HD   ARG  56          1HD       ARG  56   0.390  11.400   6.022
  428   2HD   ARG  56          2HD       ARG  56  -1.189  10.750   6.461
  429    HE   ARG  56           HE       ARG  56   0.803   8.870   7.125
  430   1HH1  ARG  56          1HH1      ARG  56  -0.457  11.976   8.165
  431   2HH1  ARG  56          2HH1      ARG  56   0.130  11.805   9.795
  432   1HH2  ARG  56          1HH2      ARG  56   1.540   8.627   9.236
  433   2HH2  ARG  56          2HH2      ARG  56   1.261   9.883  10.413
  434    H    PHE  57           H        PHE  57   0.396  10.847   0.791
  435    HA   PHE  57           HA       PHE  57   2.237   8.684   0.240
  436   1HB   PHE  57          1HB       PHE  57   1.405  10.065  -1.597
  437   2HB   PHE  57          2HB       PHE  57   2.085  11.505  -0.847
  438    HD1  PHE  57           HD1      PHE  57   3.011   8.223  -2.306
  439    HD2  PHE  57           HD2      PHE  57   4.266  12.170  -1.325
  440    HE1  PHE  57           HE1      PHE  57   5.108   7.860  -3.537
  441    HE2  PHE  57           HE2      PHE  57   6.364  11.810  -2.556
  442    HZ   PHE  57           HZ       PHE  57   6.787   9.655  -3.662
  443    H    CYS  58           H        CYS  58   4.251   8.455   0.999
  444    HA   CYS  58           HA       CYS  58   5.352  10.583   2.690
  445   1HB   CYS  58          1HB       CYS  58   6.123   7.676   2.401
  446   2HB   CYS  58          2HB       CYS  58   6.972   8.825   3.427
  447    HG   CYS  58           HG       CYS  58   4.995   6.909   4.639
  448    H    HIS  59           H        HIS  59   6.803   8.159   0.495
  449    HA   HIS  59           HA       HIS  59   8.032  10.155  -1.138
  450   1HB   HIS  59          1HB       HIS  59  10.373   9.651  -0.573
  451   2HB   HIS  59          2HB       HIS  59   9.523  10.354   0.789
  452    HD1  HIS  59           HD1      HIS  59   9.373   8.970   2.925
  453    HD2  HIS  59           HD2      HIS  59  11.016   6.890  -0.284
  454    HE1  HIS  59           HE1      HIS  59  10.270   6.822   3.888
  455    HE2  HIS  59           HE2      HIS  59  11.143   5.521   1.905
  456    H    SER  60           H        SER  60   9.822   9.052  -2.508
  457    HA   SER  60           HA       SER  60   9.036   6.269  -3.098
  458   1HB   SER  60          1HB       SER  60   9.866   8.388  -5.102
  459   2HB   SER  60          2HB       SER  60   9.442   6.718  -5.476
  460    HG   SER  60           HG       SER  60   7.822   8.786  -5.328
  461    H    GLU  61           H        GLU  61  10.712   4.833  -3.209
  462    HA   GLU  61           HA       GLU  61  13.432   5.911  -3.243
  463   1HB   GLU  61          1HB       GLU  61  14.069   4.572  -1.284
  464   2HB   GLU  61          2HB       GLU  61  12.850   5.771  -0.880
  465   1HG   GLU  61          1HG       GLU  61  11.125   4.032  -0.949
  466   2HG   GLU  61          2HG       GLU  61  12.358   2.834  -1.345
  467    H    LYS  62           H        LYS  62  15.052   4.017  -3.198
  468    HA   LYS  62           HA       LYS  62  14.478   2.249  -5.351
  469   1HB   LYS  62          1HB       LYS  62  16.749   2.974  -5.006
  470   2HB   LYS  62          2HB       LYS  62  16.751   2.361  -3.358
  471   1HG   LYS  62          1HG       LYS  62  16.566   0.073  -4.221
  472   2HG   LYS  62          2HG       LYS  62  16.599   0.703  -5.867
  473   1HD   LYS  62          1HD       LYS  62  18.829   1.534  -5.568
  474   2HD   LYS  62          2HD       LYS  62  18.794   1.139  -3.848
  475   1HE   LYS  62          1HE       LYS  62  18.648  -1.229  -4.371
  476   2HE   LYS  62          2HE       LYS  62  18.597  -0.865  -6.093
  477   1HZ   LYS  62          1HZ       LYS  62  20.871  -0.214  -4.296
  478   2HZ   LYS  62          2HZ       LYS  62  20.802  -1.565  -5.321
  479   3HZ   LYS  62          3HZ       LYS  62  20.819  -0.000  -5.980
  480    H    ALA  63           H        ALA  63  13.471   0.363  -5.283
  481    HA   ALA  63           HA       ALA  63  12.653  -0.692  -2.711
  482   1HB   ALA  63          1HB       ALA  63  11.205  -2.167  -4.045
  483   2HB   ALA  63          2HB       ALA  63  10.978  -0.464  -4.443
  484   3HB   ALA  63          3HB       ALA  63  11.913  -1.502  -5.517
  485    HA   PRO  64           HA       PRO  64  15.850  -3.837  -2.540
  486   1HB   PRO  64          1HB       PRO  64  13.738  -5.154  -0.901
  487   2HB   PRO  64          2HB       PRO  64  15.441  -4.872  -0.523
  488   1HG   PRO  64          1HG       PRO  64  13.538  -3.396   0.613
  489   2HG   PRO  64          2HG       PRO  64  15.073  -2.669   0.107
  490   1HD   PRO  64          1HD       PRO  64  12.390  -2.531  -1.196
  491   2HD   PRO  64          2HD       PRO  64  13.648  -1.285  -1.067
  492    H    ASP  65           H        ASP  65  16.157  -5.774  -3.603
  493    HA   ASP  65           HA       ASP  65  14.457  -6.305  -5.753
  494   1HB   ASP  65          1HB       ASP  65  16.559  -8.142  -4.595
  495   2HB   ASP  65          2HB       ASP  65  15.917  -8.175  -6.228
  496    H    GLU  66           H        GLU  66  14.435  -7.506  -2.523
  497    HA   GLU  66           HA       GLU  66  12.962  -9.874  -2.904
  498   1HB   GLU  66          1HB       GLU  66  14.107  -9.347  -0.809
  499   2HB   GLU  66          2HB       GLU  66  13.023  -7.990  -0.542
  500   1HG   GLU  66          1HG       GLU  66  11.155  -9.460  -0.259
  501   2HG   GLU  66          2HG       GLU  66  12.135 -10.857  -0.709
  502    H    VAL  67           H        VAL  67  11.862  -6.564  -2.105
  503    HA   VAL  67           HA       VAL  67   9.107  -7.306  -2.209
  504    HB   VAL  67           HB       VAL  67   8.563  -4.975  -1.979
  505   1HG1  VAL  67          1HG1      VAL  67   9.299  -6.101   0.031
  506   2HG1  VAL  67          2HG1      VAL  67  10.977  -5.685  -0.322
  507   3HG1  VAL  67          3HG1      VAL  67   9.813  -4.413   0.055
  508   1HG2  VAL  67          1HG2      VAL  67  10.136  -4.031  -3.582
  509   2HG2  VAL  67          2HG2      VAL  67  10.246  -3.206  -2.026
  510   3HG2  VAL  67          3HG2      VAL  67  11.475  -4.384  -2.490
  511    H    ILE  68           H        ILE  68  11.450  -6.386  -4.544
  512    HA   ILE  68           HA       ILE  68   9.836  -5.434  -6.620
  513    HB   ILE  68           HB       ILE  68  12.337  -7.129  -6.784
  514   1HG1  ILE  68          1HG1      ILE  68  12.732  -5.031  -5.634
  515   2HG1  ILE  68          2HG1      ILE  68  13.456  -4.960  -7.236
  516   1HG2  ILE  68          1HG2      ILE  68  12.559  -6.281  -9.078
  517   2HG2  ILE  68          2HG2      ILE  68  11.110  -7.265  -8.870
  518   3HG2  ILE  68          3HG2      ILE  68  10.980  -5.507  -8.932
  519   1HD1  ILE  68          1HD1      ILE  68  10.864  -3.701  -6.382
  520   2HD1  ILE  68          2HD1      ILE  68  12.385  -2.874  -6.718
  521   3HD1  ILE  68          3HD1      ILE  68  11.512  -3.677  -8.023
  522    H    GLU  69           H        GLU  69  10.714  -8.729  -5.689
  523    HA   GLU  69           HA       GLU  69   9.317  -9.988  -7.826
  524   1HB   GLU  69          1HB       GLU  69  11.212 -11.017  -6.588
  525   2HB   GLU  69          2HB       GLU  69  10.177 -11.155  -5.174
  526   1HG   GLU  69          1HG       GLU  69   8.690 -12.645  -6.396
  527   2HG   GLU  69          2HG       GLU  69   9.706 -12.495  -7.829
  528    H    ALA  70           H        ALA  70   8.484  -9.053  -4.554
  529    HA   ALA  70           HA       ALA  70   6.021 -10.446  -4.396
  530   1HB   ALA  70          1HB       ALA  70   6.878  -7.933  -2.964
  531   2HB   ALA  70          2HB       ALA  70   5.514  -8.962  -2.526
  532   3HB   ALA  70          3HB       ALA  70   7.160  -9.586  -2.414
  533    H    ILE  71           H        ILE  71   6.843  -7.123  -5.357
  534    HA   ILE  71           HA       ILE  71   4.174  -6.373  -6.000
  535    HB   ILE  71           HB       ILE  71   6.791  -5.186  -6.942
  536   1HG1  ILE  71          1HG1      ILE  71   4.914  -4.344  -4.721
  537   2HG1  ILE  71          2HG1      ILE  71   6.464  -5.148  -4.493
  538   1HG2  ILE  71          1HG2      ILE  71   3.992  -4.064  -7.073
  539   2HG2  ILE  71          2HG2      ILE  71   5.467  -3.179  -7.467
  540   3HG2  ILE  71          3HG2      ILE  71   4.984  -4.567  -8.442
  541   1HD1  ILE  71          1HD1      ILE  71   7.601  -3.226  -5.471
  542   2HD1  ILE  71          2HD1      ILE  71   6.047  -2.426  -5.703
  543   3HD1  ILE  71          3HD1      ILE  71   6.627  -2.767  -4.073
  544    H    LYS  72           H        LYS  72   6.831  -7.812  -7.796
  545    HA   LYS  72           HA       LYS  72   5.931  -7.745 -10.393
  546   1HB   LYS  72          1HB       LYS  72   8.041  -8.733  -9.941
  547   2HB   LYS  72          2HB       LYS  72   7.344  -9.894  -8.822
  548   1HG   LYS  72          1HG       LYS  72   6.114 -10.838 -10.860
  549   2HG   LYS  72          2HG       LYS  72   7.255  -9.891 -11.818
  550   1HD   LYS  72          1HD       LYS  72   8.125 -11.828  -9.685
  551   2HD   LYS  72          2HD       LYS  72   7.899 -12.301 -11.369
  552   1HE   LYS  72          1HE       LYS  72   9.681 -10.014 -10.583
  553   2HE   LYS  72          2HE       LYS  72  10.263 -11.677 -10.610
  554   1HZ   LYS  72          1HZ       LYS  72   9.091 -10.222 -12.921
  555   2HZ   LYS  72          2HZ       LYS  72  10.741 -10.540 -12.684
  556   3HZ   LYS  72          3HZ       LYS  72   9.655 -11.819 -12.941
  557    H    GLN  73           H        GLN  73   4.848  -9.804  -7.766
  558    HA   GLN  73           HA       GLN  73   3.144 -11.368  -9.512
  559   1HB   GLN  73          1HB       GLN  73   3.659 -11.473  -6.542
  560   2HB   GLN  73          2HB       GLN  73   2.596 -12.582  -7.399
  561   1HG   GLN  73          1HG       GLN  73   4.380 -13.531  -8.599
  562   2HG   GLN  73          2HG       GLN  73   5.477 -12.227  -8.150
  563   1HE2  GLN  73          2HE2      GLN  73   6.415 -12.221  -6.133
  564   2HE2  GLN  73          1HE2      GLN  73   6.401 -13.605  -5.089
  565    H    ASN  74           H        ASN  74   2.727  -9.078  -6.815
  566    HA   ASN  74           HA       ASN  74  -0.171  -9.397  -7.054
  567   1HB   ASN  74          1HB       ASN  74   1.519  -8.070  -4.934
  568   2HB   ASN  74          2HB       ASN  74  -0.240  -8.104  -4.913
  569   1HD2  ASN  74          2HD2      ASN  74   2.667  -9.919  -4.460
  570   2HD2  ASN  74          1HD2      ASN  74   1.922 -11.334  -3.798
  571    H    GLY  75           H        GLY  75   2.311  -7.042  -7.653
  572   1HA   GLY  75          1HA       GLY  75   1.983  -5.084  -8.949
  573   2HA   GLY  75          2HA       GLY  75   0.271  -5.133  -8.546
  574    H    TYR  76           H        TYR  76   1.650  -5.784  -5.738
  575    HA   TYR  76           HA       TYR  76   2.521  -3.182  -4.892
  576   1HB   TYR  76          1HB       TYR  76   0.702  -2.784  -3.307
  577   2HB   TYR  76          2HB       TYR  76   0.058  -2.875  -4.943
  578    HD1  TYR  76           HD1      TYR  76  -0.108  -4.205  -1.613
  579    HD2  TYR  76           HD2      TYR  76  -1.040  -5.054  -5.679
  580    HE1  TYR  76           HE1      TYR  76  -1.693  -5.937  -0.884
  581    HE2  TYR  76           HE2      TYR  76  -2.629  -6.787  -4.959
  582    HH   TYR  76           HH       TYR  76  -2.980  -8.246  -2.975
  583    H    PHE  77           H        PHE  77   3.012  -3.203  -2.525
  584    HA   PHE  77           HA       PHE  77   3.130  -5.890  -1.361
  585   1HB   PHE  77          1HB       PHE  77   5.367  -5.412  -2.285
  586   2HB   PHE  77          2HB       PHE  77   5.434  -3.925  -1.344
  587    HD1  PHE  77           HD1      PHE  77   6.298  -3.944   0.813
  588    HD2  PHE  77           HD2      PHE  77   5.111  -7.609  -0.990
  589    HE1  PHE  77           HE1      PHE  77   7.261  -5.182   2.706
  590    HE2  PHE  77           HE2      PHE  77   6.075  -8.853   0.901
  591    HZ   PHE  77           HZ       PHE  77   7.151  -7.641   2.751
  592    H    ILE  78           H        ILE  78   2.325  -5.929   0.618
  593    HA   ILE  78           HA       ILE  78   1.813  -3.383   1.965
  594    HB   ILE  78           HB       ILE  78   0.660  -6.130   2.484
  595   1HG1  ILE  78          1HG1      ILE  78  -0.158  -5.124   0.411
  596   2HG1  ILE  78          2HG1      ILE  78  -1.432  -5.163   1.625
  597   1HG2  ILE  78          1HG2      ILE  78   0.795  -4.864   4.552
  598   2HG2  ILE  78          2HG2      ILE  78  -0.004  -3.492   3.786
  599   3HG2  ILE  78          3HG2      ILE  78  -0.881  -5.003   4.027
  600   1HD1  ILE  78          1HD1      ILE  78  -1.040  -2.796   2.094
  601   2HD1  ILE  78          2HD1      ILE  78   0.215  -2.765   0.855
  602   3HD1  ILE  78          3HD1      ILE  78  -1.462  -3.077   0.406
  603    H    TYR  79           H        TYR  79   3.613  -2.859   3.101
  604    HA   TYR  79           HA       TYR  79   4.979  -4.861   4.698
  605   1HB   TYR  79          1HB       TYR  79   6.122  -2.887   3.535
  606   2HB   TYR  79          2HB       TYR  79   5.417  -1.877   4.791
  607    HD1  TYR  79           HD1      TYR  79   6.355  -1.809   6.992
  608    HD2  TYR  79           HD2      TYR  79   7.780  -4.630   4.143
  609    HE1  TYR  79           HE1      TYR  79   8.260  -2.325   8.462
  610    HE2  TYR  79           HE2      TYR  79   9.685  -5.152   5.604
  611    HH   TYR  79           HH       TYR  79   9.845  -4.198   8.849
  612    H    LYS  80           H        LYS  80   4.089  -5.488   6.534
  613    HA   LYS  80           HA       LYS  80   1.943  -3.995   7.703
  614   1HB   LYS  80          1HB       LYS  80   3.255  -6.504   8.755
  615   2HB   LYS  80          2HB       LYS  80   1.648  -5.899   9.143
  616   1HG   LYS  80          1HG       LYS  80   0.892  -6.321   6.897
  617   2HG   LYS  80          2HG       LYS  80   2.518  -6.788   6.401
  618   1HD   LYS  80          1HD       LYS  80   2.388  -8.628   8.117
  619   2HD   LYS  80          2HD       LYS  80   0.678  -8.227   8.299
  620   1HE   LYS  80          1HE       LYS  80   1.008 -10.088   6.738
  621   2HE   LYS  80          2HE       LYS  80   0.300  -8.683   5.940
  622   1HZ   LYS  80          1HZ       LYS  80   2.093  -9.743   4.638
  623   2HZ   LYS  80          2HZ       LYS  80   2.430  -8.130   5.018
  624   3HZ   LYS  80          3HZ       LYS  80   3.193  -9.375   5.878
  625    H    MET  81           H        MET  81   2.914  -2.097   8.442
  626    HA   MET  81           HA       MET  81   5.068  -1.997  10.260
  627   1HB   MET  81          1HB       MET  81   4.309  -0.039   8.974
  628   2HB   MET  81          2HB       MET  81   2.795  -0.034   9.868
  629   1HG   MET  81          1HG       MET  81   4.149   0.305  11.956
  630   2HG   MET  81          2HG       MET  81   5.551   0.549  10.917
  631   1HE   MET  81          1HE       MET  81   4.126   2.044   8.432
  632   2HE   MET  81          2HE       MET  81   5.691   2.515   9.093
  633   3HE   MET  81          3HE       MET  81   4.429   3.725   8.869
  634    H    GLU  82           H        GLU  82   1.585  -1.533  10.835
  635    HA   GLU  82           HA       GLU  82   1.596  -3.169  13.178
  636   1HB   GLU  82          1HB       GLU  82   2.616  -1.134  14.106
  637   2HB   GLU  82          2HB       GLU  82   1.259  -0.182  13.522
  638   1HG   GLU  82          1HG       GLU  82  -0.238  -1.477  14.992
  639   2HG   GLU  82          2HG       GLU  82   1.170  -2.335  15.621
  640    H    GLY  83           H        GLY  83  -0.336  -4.082  13.266
  641   1HA   GLY  83          1HA       GLY  83  -2.802  -2.795  13.073
  642   2HA   GLY  83          2HA       GLY  83  -2.400  -3.370  11.462
  643    H    CYS  84           H        CYS  84  -1.312  -5.749  11.766
  644    HA   CYS  84           HA       CYS  84  -3.476  -7.447  12.277
  645   1HB   CYS  84          1HB       CYS  84  -0.538  -8.164  12.182
  646   2HB   CYS  84          2HB       CYS  84  -1.887  -9.274  11.962
  647    HG   CYS  84           HG       CYS  84  -2.645  -8.436   9.523
  648    H    ASN  85           H        ASN  85  -0.777  -6.460  14.283
  649    HA   ASN  85           HA       ASN  85  -1.948  -7.945  16.536
  650   1HB   ASN  85          1HB       ASN  85   0.887  -6.981  16.085
  651   2HB   ASN  85          2HB       ASN  85   0.310  -7.611  17.623
  652   1HD2  ASN  85          2HD2      ASN  85   1.744  -9.313  17.620
  653   2HD2  ASN  85          1HD2      ASN  85   1.588 -10.667  16.547
  Start of MODEL   13
    1    H    MET   1           H        MET   1  14.525   1.041 -10.459
    2    HA   MET   1           HA       MET   1  12.268   1.461 -10.823
    3   1HB   MET   1          1HB       MET   1  10.545  -0.262 -10.321
    4   2HB   MET   1          2HB       MET   1  11.552  -0.646 -11.709
    5   1HG   MET   1          1HG       MET   1  12.902  -2.123 -10.224
    6   2HG   MET   1          2HG       MET   1  11.715  -1.833  -8.953
    7   1HE   MET   1          1HE       MET   1   9.149  -2.544  -9.141
    8   2HE   MET   1          2HE       MET   1   8.463  -3.364 -10.543
    9   3HE   MET   1          3HE       MET   1   9.005  -1.690 -10.678
   10    H    GLN   2           H        GLN   2  11.139   2.450  -9.219
   11    HA   GLN   2           HA       GLN   2  12.318   2.071  -6.554
   12   1HB   GLN   2          1HB       GLN   2  10.772   4.435  -7.626
   13   2HB   GLN   2          2HB       GLN   2  11.545   4.335  -6.053
   14   1HG   GLN   2          1HG       GLN   2  13.714   3.971  -7.365
   15   2HG   GLN   2          2HG       GLN   2  12.804   4.569  -8.753
   16   1HE2  GLN   2          2HE2      GLN   2  11.958   6.707  -8.671
   17   2HE2  GLN   2          1HE2      GLN   2  12.672   7.897  -7.634
   18    H    ILE   3           H        ILE   3  11.007   2.168  -4.694
   19    HA   ILE   3           HA       ILE   3   8.257   1.274  -5.127
   20    HB   ILE   3           HB       ILE   3   8.305   0.995  -2.574
   21   1HG1  ILE   3          1HG1      ILE   3  11.282   1.136  -3.094
   22   2HG1  ILE   3          2HG1      ILE   3  10.351   2.324  -2.190
   23   1HG2  ILE   3          1HG2      ILE   3   8.262  -0.879  -4.050
   24   2HG2  ILE   3          2HG2      ILE   3   9.985  -0.717  -4.379
   25   3HG2  ILE   3          3HG2      ILE   3   9.438  -1.195  -2.774
   26   1HD1  ILE   3          1HD1      ILE   3   9.810   0.625  -0.522
   27   2HD1  ILE   3          2HD1      ILE   3  10.752  -0.560  -1.429
   28   3HD1  ILE   3          3HD1      ILE   3  11.553   0.835  -0.704
   29    H    HIS   4           H        HIS   4   6.646   2.625  -4.969
   30    HA   HIS   4           HA       HIS   4   7.064   5.238  -3.755
   31   1HB   HIS   4          1HB       HIS   4   4.601   4.139  -5.142
   32   2HB   HIS   4          2HB       HIS   4   4.883   5.818  -4.692
   33    HD1  HIS   4           HD1      HIS   4   6.907   7.033  -6.029
   34    HD2  HIS   4           HD2      HIS   4   5.545   3.431  -7.606
   35    HE1  HIS   4           HE1      HIS   4   7.777   6.950  -8.387
   36    HE2  HIS   4           HE2      HIS   4   6.996   4.739  -9.309
   37    H    VAL   5           H        VAL   5   6.477   5.667  -1.744
   38    HA   VAL   5           HA       VAL   5   5.316   3.467  -0.213
   39    HB   VAL   5           HB       VAL   5   6.645   5.985   0.802
   40   1HG1  VAL   5          1HG1      VAL   5   6.850   4.749   2.908
   41   2HG1  VAL   5          2HG1      VAL   5   5.164   4.946   2.432
   42   3HG1  VAL   5          3HG1      VAL   5   5.971   3.396   2.197
   43   1HG2  VAL   5          1HG2      VAL   5   8.618   4.580   1.198
   44   2HG2  VAL   5          2HG2      VAL   5   7.807   3.228   0.404
   45   3HG2  VAL   5          3HG2      VAL   5   8.215   4.677  -0.517
   46    H    TYR   6           H        TYR   6   3.185   3.530  -0.061
   47    HA   TYR   6           HA       TYR   6   1.909   6.104   0.563
   48   1HB   TYR   6          1HB       TYR   6   0.742   3.549  -0.563
   49   2HB   TYR   6          2HB       TYR   6  -0.232   4.918  -0.044
   50    HD1  TYR   6           HD1      TYR   6  -0.513   6.820  -1.436
   51    HD2  TYR   6           HD2      TYR   6   2.280   3.802  -2.522
   52    HE1  TYR   6           HE1      TYR   6  -0.308   7.823  -3.672
   53    HE2  TYR   6           HE2      TYR   6   2.494   4.796  -4.760
   54    HH   TYR   6           HH       TYR   6   1.187   7.893  -5.535
   55    H    ASP   7           H        ASP   7   2.173   6.229   2.747
   56    HA   ASP   7           HA       ASP   7   1.795   4.138   4.586
   57   1HB   ASP   7          1HB       ASP   7   1.499   7.133   4.916
   58   2HB   ASP   7          2HB       ASP   7   1.507   5.984   6.240
   59    H    THR   8           H        THR   8  -0.064   3.011   4.613
   60    HA   THR   8           HA       THR   8  -2.564   4.451   4.152
   61    HB   THR   8           HB       THR   8  -2.149   1.465   4.344
   62    HG1  THR   8           HG1      THR   8  -1.015   2.697   2.580
   63   1HG2  THR   8          1HG2      THR   8  -4.292   1.349   3.174
   64   2HG2  THR   8          2HG2      THR   8  -4.464   2.232   4.690
   65   3HG2  THR   8          3HG2      THR   8  -4.395   3.110   3.162
   66    H    TYR   9           H        TYR   9  -3.622   5.173   5.838
   67    HA   TYR   9           HA       TYR   9  -3.422   3.764   8.397
   68   1HB   TYR   9          1HB       TYR   9  -4.457   6.524   7.711
   69   2HB   TYR   9          2HB       TYR   9  -4.520   5.820   9.322
   70    HD1  TYR   9           HD1      TYR   9  -2.224   7.008   6.669
   71    HD2  TYR   9           HD2      TYR   9  -2.626   5.838  10.740
   72    HE1  TYR   9           HE1      TYR   9   0.029   7.876   7.136
   73    HE2  TYR   9           HE2      TYR   9  -0.375   6.699  11.216
   74    HH   TYR   9           HH       TYR   9   1.382   8.616   8.942
   75    H    VAL  10           H        VAL  10  -4.917   2.253   8.666
   76    HA   VAL  10           HA       VAL  10  -7.608   2.736   7.577
   77    HB   VAL  10           HB       VAL  10  -6.298   0.114   8.331
   78   1HG1  VAL  10          1HG1      VAL  10  -8.681   0.051   8.834
   79   2HG1  VAL  10          2HG1      VAL  10  -9.051   0.637   7.212
   80   3HG1  VAL  10          3HG1      VAL  10  -8.315  -0.951   7.429
   81   1HG2  VAL  10          1HG2      VAL  10  -5.457   1.030   6.243
   82   2HG2  VAL  10          2HG2      VAL  10  -6.472  -0.378   5.929
   83   3HG2  VAL  10          3HG2      VAL  10  -7.105   1.245   5.655
   84    H    LYS  11           H        LYS  11  -9.010   3.416   8.987
   85    HA   LYS  11           HA       LYS  11  -8.557   3.262  11.806
   86   1HB   LYS  11          1HB       LYS  11 -10.960   4.231  10.247
   87   2HB   LYS  11          2HB       LYS  11 -10.704   4.472  11.968
   88   1HG   LYS  11          1HG       LYS  11  -8.957   5.979  11.621
   89   2HG   LYS  11          2HG       LYS  11  -8.720   5.457   9.951
   90   1HD   LYS  11          1HD       LYS  11 -10.904   6.412   9.355
   91   2HD   LYS  11          2HD       LYS  11 -11.111   6.958  11.020
   92   1HE   LYS  11          1HE       LYS  11  -9.413   8.549  10.837
   93   2HE   LYS  11          2HE       LYS  11  -8.709   7.767   9.422
   94   1HZ   LYS  11          1HZ       LYS  11 -10.023   9.889   9.038
   95   2HZ   LYS  11          2HZ       LYS  11 -10.392   8.563   8.048
   96   3HZ   LYS  11          3HZ       LYS  11 -11.411   8.964   9.345
   97    H    ALA  12           H        ALA  12  -8.518   0.946  12.092
   98    HA   ALA  12           HA       ALA  12 -10.969  -0.529  11.763
   99   1HB   ALA  12          1HB       ALA  12  -8.827  -1.689  11.617
  100   2HB   ALA  12          2HB       ALA  12  -8.465  -1.249  13.286
  101   3HB   ALA  12          3HB       ALA  12  -9.807  -2.337  12.933
  102    H    LYS  13           H        LYS  13 -12.549   0.392  12.886
  103    HA   LYS  13           HA       LYS  13 -12.422   1.754  15.249
  104   1HB   LYS  13          1HB       LYS  13 -14.795   1.656  15.362
  105   2HB   LYS  13          2HB       LYS  13 -14.327   1.766  13.674
  106   1HG   LYS  13          1HG       LYS  13 -15.064  -0.803  15.049
  107   2HG   LYS  13          2HG       LYS  13 -16.198   0.198  14.142
  108   1HD   LYS  13          1HD       LYS  13 -14.942  -0.133  12.116
  109   2HD   LYS  13          2HD       LYS  13 -13.672  -0.982  13.001
  110   1HE   LYS  13          1HE       LYS  13 -15.272  -2.707  13.626
  111   2HE   LYS  13          2HE       LYS  13 -16.517  -1.884  12.688
  112   1HZ   LYS  13          1HZ       LYS  13 -13.986  -2.995  11.593
  113   2HZ   LYS  13          2HZ       LYS  13 -15.514  -3.712  11.449
  114   3HZ   LYS  13          3HZ       LYS  13 -15.203  -2.226  10.692
  115    H    ASP  14           H        ASP  14 -12.729  -1.738  14.897
  116    HA   ASP  14           HA       ASP  14 -13.168  -1.935  17.795
  117   1HB   ASP  14          1HB       ASP  14 -13.991  -4.157  17.429
  118   2HB   ASP  14          2HB       ASP  14 -14.764  -3.097  16.253
  119    H    GLY  15           H        GLY  15 -10.655  -1.925  15.710
  120   1HA   GLY  15          1HA       GLY  15  -9.157  -3.922  17.288
  121   2HA   GLY  15          2HA       GLY  15  -8.842  -3.602  15.588
  122    H    HIS  16           H        HIS  16  -7.771  -1.739  14.984
  123    HA   HIS  16           HA       HIS  16  -6.931   0.238  16.862
  124   1HB   HIS  16          1HB       HIS  16  -5.451  -1.820  17.335
  125   2HB   HIS  16          2HB       HIS  16  -4.729  -1.511  15.761
  126    HD1  HIS  16           HD1      HIS  16  -4.791  -0.318  19.267
  127    HD2  HIS  16           HD2      HIS  16  -3.127   0.840  15.633
  128    HE1  HIS  16           HE1      HIS  16  -3.071   1.427  19.833
  129    HE2  HIS  16           HE2      HIS  16  -1.978   2.009  17.640
  130    H    VAL  17           H        VAL  17  -6.043   2.026  15.798
  131    HA   VAL  17           HA       VAL  17  -6.543   2.361  13.064
  132    HB   VAL  17           HB       VAL  17  -4.541   3.884  14.751
  133   1HG1  VAL  17          1HG1      VAL  17  -4.857   5.690  13.130
  134   2HG1  VAL  17          2HG1      VAL  17  -4.221   4.240  12.355
  135   3HG1  VAL  17          3HG1      VAL  17  -5.925   4.656  12.182
  136   1HG2  VAL  17          1HG2      VAL  17  -7.458   4.442  14.211
  137   2HG2  VAL  17          2HG2      VAL  17  -6.765   3.919  15.746
  138   3HG2  VAL  17          3HG2      VAL  17  -6.354   5.503  15.087
  139    H    MET  18           H        MET  18  -5.634   1.214  11.500
  140    HA   MET  18           HA       MET  18  -3.095  -0.082  11.903
  141   1HB   MET  18          1HB       MET  18  -5.039  -0.047   9.602
  142   2HB   MET  18          2HB       MET  18  -3.507  -0.903   9.539
  143   1HG   MET  18          1HG       MET  18  -4.202  -2.270  11.443
  144   2HG   MET  18          2HG       MET  18  -5.752  -1.423  11.471
  145   1HE   MET  18          1HE       MET  18  -5.175  -4.660  11.159
  146   2HE   MET  18          2HE       MET  18  -6.458  -5.077  10.024
  147   3HE   MET  18          3HE       MET  18  -6.789  -3.978  11.362
  148    H    HIS  19           H        HIS  19  -1.196   0.713  11.366
  149    HA   HIS  19           HA       HIS  19  -1.065   2.482   9.020
  150   1HB   HIS  19          1HB       HIS  19  -0.330   3.644  11.087
  151   2HB   HIS  19          2HB       HIS  19   0.871   2.387  11.355
  152    HD1  HIS  19           HD1      HIS  19   2.242   4.887  11.279
  153    HD2  HIS  19           HD2      HIS  19   1.101   3.080   7.704
  154    HE1  HIS  19           HE1      HIS  19   3.708   5.893   9.502
  155    HE2  HIS  19           HE2      HIS  19   3.121   4.666   7.380
  156    H    PHE  20           H        PHE  20  -0.490   1.251   7.367
  157    HA   PHE  20           HA       PHE  20   1.917  -0.374   7.678
  158   1HB   PHE  20          1HB       PHE  20   0.947  -2.144   6.226
  159   2HB   PHE  20          2HB       PHE  20   0.129  -2.002   7.774
  160    HD1  PHE  20           HD1      PHE  20  -2.143  -1.092   7.899
  161    HD2  PHE  20           HD2      PHE  20  -0.174  -1.663   4.169
  162    HE1  PHE  20           HE1      PHE  20  -4.302  -0.915   6.735
  163    HE2  PHE  20           HE2      PHE  20  -2.329  -1.483   2.999
  164    HZ   PHE  20           HZ       PHE  20  -4.397  -1.109   4.282
  165    H    ASP  21           H        ASP  21   3.194  -0.503   5.817
  166    HA   ASP  21           HA       ASP  21   2.685   1.773   4.043
  167   1HB   ASP  21          1HB       ASP  21   5.210   0.178   4.524
  168   2HB   ASP  21          2HB       ASP  21   5.081   1.539   3.416
  169    H    VAL  22           H        VAL  22   1.879   1.446   2.109
  170    HA   VAL  22           HA       VAL  22   2.091  -1.186   0.868
  171    HB   VAL  22           HB       VAL  22   0.599   1.267  -0.092
  172   1HG1  VAL  22          1HG1      VAL  22   0.491  -1.602  -1.023
  173   2HG1  VAL  22          2HG1      VAL  22  -0.567  -0.304  -1.579
  174   3HG1  VAL  22          3HG1      VAL  22   1.162  -0.237  -1.915
  175   1HG2  VAL  22          1HG2      VAL  22  -0.308   0.459   2.013
  176   2HG2  VAL  22          2HG2      VAL  22  -1.415   0.096   0.689
  177   3HG2  VAL  22          3HG2      VAL  22  -0.400  -1.179   1.365
  178    H    PHE  23           H        PHE  23   3.962  -1.519  -0.138
  179    HA   PHE  23           HA       PHE  23   5.261   0.659  -1.581
  180   1HB   PHE  23          1HB       PHE  23   6.139  -2.204  -1.139
  181   2HB   PHE  23          2HB       PHE  23   7.093  -0.966  -1.943
  182    HD1  PHE  23           HD1      PHE  23   6.818   1.354  -0.253
  183    HD2  PHE  23           HD2      PHE  23   7.179  -2.746   0.822
  184    HE1  PHE  23           HE1      PHE  23   7.804   2.010   1.903
  185    HE2  PHE  23           HE2      PHE  23   8.163  -2.098   2.980
  186    HZ   PHE  23           HZ       PHE  23   8.476   0.284   3.526
  187    H    THR  24           H        THR  24   4.874   0.997  -3.677
  188    HA   THR  24           HA       THR  24   4.655  -1.312  -5.437
  189    HB   THR  24           HB       THR  24   2.315  -0.914  -4.856
  190    HG1  THR  24           HG1      THR  24   1.954  -1.421  -6.867
  191   1HG2  THR  24          1HG2      THR  24   1.194   1.179  -5.456
  192   2HG2  THR  24          2HG2      THR  24   2.460   1.454  -4.258
  193   3HG2  THR  24          3HG2      THR  24   2.740   1.870  -5.950
  194    H    ASP  25           H        ASP  25   4.994  -0.776  -7.691
  195    HA   ASP  25           HA       ASP  25   6.605   1.635  -7.989
  196   1HB   ASP  25          1HB       ASP  25   7.697   0.591  -9.694
  197   2HB   ASP  25          2HB       ASP  25   7.059  -0.852  -8.920
  198    H    VAL  26           H        VAL  26   3.461   0.611  -8.480
  199    HA   VAL  26           HA       VAL  26   2.889   2.444 -10.658
  200    HB   VAL  26           HB       VAL  26   0.974   0.821  -8.966
  201   1HG1  VAL  26          1HG1      VAL  26  -0.109   2.688 -10.075
  202   2HG1  VAL  26          2HG1      VAL  26   0.591   2.202 -11.619
  203   3HG1  VAL  26          3HG1      VAL  26  -0.593   1.165 -10.822
  204   1HG2  VAL  26          1HG2      VAL  26   0.925  -0.755 -10.849
  205   2HG2  VAL  26          2HG2      VAL  26   2.190   0.178 -11.650
  206   3HG2  VAL  26          3HG2      VAL  26   2.531  -0.642 -10.126
  207    H    ARG  27           H        ARG  27   3.083   4.535 -10.021
  208    HA   ARG  27           HA       ARG  27   2.238   5.303  -7.354
  209   1HB   ARG  27          1HB       ARG  27   3.102   7.565  -8.004
  210   2HB   ARG  27          2HB       ARG  27   4.297   6.277  -8.021
  211   1HG   ARG  27          1HG       ARG  27   4.248   6.175 -10.411
  212   2HG   ARG  27          2HG       ARG  27   2.883   7.295 -10.477
  213   1HD   ARG  27          1HD       ARG  27   4.279   9.043  -9.478
  214   2HD   ARG  27          2HD       ARG  27   5.640   7.924  -9.430
  215    HE   ARG  27           HE       ARG  27   5.875   8.116 -11.742
  216   1HH1  ARG  27          1HH1      ARG  27   3.077   9.893 -10.597
  217   2HH1  ARG  27          2HH1      ARG  27   2.953  10.881 -12.019
  218   1HH2  ARG  27          1HH2      ARG  27   5.750   9.457 -13.602
  219   2HH2  ARG  27          2HH2      ARG  27   4.498  10.657 -13.715
  220    H    ASP  28           H        ASP  28   0.046   4.554  -8.180
  221    HA   ASP  28           HA       ASP  28  -1.409   6.884  -9.238
  222   1HB   ASP  28          1HB       ASP  28  -2.006   3.930  -9.373
  223   2HB   ASP  28          2HB       ASP  28  -3.264   5.135  -9.615
  224    H    ASP  29           H        ASP  29  -2.593   7.948  -7.811
  225    HA   ASP  29           HA       ASP  29  -2.674   7.251  -5.097
  226   1HB   ASP  29          1HB       ASP  29  -4.437   9.198  -6.604
  227   2HB   ASP  29          2HB       ASP  29  -4.280   9.117  -4.853
  228    H    LYS  30           H        LYS  30  -4.991   6.799  -7.706
  229    HA   LYS  30           HA       LYS  30  -7.097   5.761  -6.126
  230   1HB   LYS  30          1HB       LYS  30  -7.633   6.476  -8.323
  231   2HB   LYS  30          2HB       LYS  30  -6.381   5.471  -9.039
  232   1HG   LYS  30          1HG       LYS  30  -7.625   3.478  -8.567
  233   2HG   LYS  30          2HG       LYS  30  -8.820   4.390  -7.644
  234   1HD   LYS  30          1HD       LYS  30  -9.637   5.466  -9.585
  235   2HD   LYS  30          2HD       LYS  30  -8.261   4.931 -10.549
  236   1HE   LYS  30          1HE       LYS  30 -10.376   3.686 -10.988
  237   2HE   LYS  30          2HE       LYS  30  -9.017   2.672 -10.514
  238   1HZ   LYS  30          1HZ       LYS  30 -11.023   3.612  -8.551
  239   2HZ   LYS  30          2HZ       LYS  30 -11.240   2.191  -9.451
  240   3HZ   LYS  30          3HZ       LYS  30  -9.919   2.335  -8.404
  241    H    LYS  31           H        LYS  31  -4.337   4.244  -7.736
  242    HA   LYS  31           HA       LYS  31  -5.185   1.582  -7.293
  243   1HB   LYS  31          1HB       LYS  31  -2.553   2.821  -8.014
  244   2HB   LYS  31          2HB       LYS  31  -2.648   1.111  -7.610
  245   1HG   LYS  31          1HG       LYS  31  -4.222   2.476  -9.784
  246   2HG   LYS  31          2HG       LYS  31  -2.768   1.503 -10.024
  247   1HD   LYS  31          1HD       LYS  31  -3.906  -0.448  -9.106
  248   2HD   LYS  31          2HD       LYS  31  -5.351   0.518  -8.807
  249   1HE   LYS  31          1HE       LYS  31  -5.584   0.919 -11.204
  250   2HE   LYS  31          2HE       LYS  31  -4.127  -0.028 -11.509
  251   1HZ   LYS  31          1HZ       LYS  31  -5.212  -1.981 -10.675
  252   2HZ   LYS  31          2HZ       LYS  31  -6.588  -1.092 -10.221
  253   3HZ   LYS  31          3HZ       LYS  31  -6.200  -1.282 -11.864
  254    H    ALA  32           H        ALA  32  -3.159   3.792  -5.427
  255    HA   ALA  32           HA       ALA  32  -2.261   2.031  -3.465
  256   1HB   ALA  32          1HB       ALA  32  -2.067   3.995  -2.016
  257   2HB   ALA  32          2HB       ALA  32  -1.480   4.333  -3.644
  258   3HB   ALA  32          3HB       ALA  32  -3.063   4.920  -3.140
  259    H    ILE  33           H        ILE  33  -5.205   3.999  -3.514
  260    HA   ILE  33           HA       ILE  33  -6.338   2.989  -1.139
  261    HB   ILE  33           HB       ILE  33  -7.630   4.227  -3.573
  262   1HG1  ILE  33          1HG1      ILE  33  -6.957   5.391  -0.864
  263   2HG1  ILE  33          2HG1      ILE  33  -6.024   5.645  -2.334
  264   1HG2  ILE  33          1HG2      ILE  33  -9.606   4.589  -2.208
  265   2HG2  ILE  33          2HG2      ILE  33  -9.247   2.867  -2.337
  266   3HG2  ILE  33          3HG2      ILE  33  -8.848   3.742  -0.858
  267   1HD1  ILE  33          1HD1      ILE  33  -7.932   6.765  -3.353
  268   2HD1  ILE  33          2HD1      ILE  33  -8.868   6.506  -1.880
  269   3HD1  ILE  33          3HD1      ILE  33  -7.443   7.544  -1.847
  270    H    GLU  34           H        GLU  34  -6.655   2.058  -4.520
  271    HA   GLU  34           HA       GLU  34  -8.706   0.176  -4.248
  272   1HB   GLU  34          1HB       GLU  34  -7.776   1.209  -6.370
  273   2HB   GLU  34          2HB       GLU  34  -6.461   0.052  -6.259
  274   1HG   GLU  34          1HG       GLU  34  -7.943  -1.782  -6.557
  275   2HG   GLU  34          2HG       GLU  34  -9.357  -0.738  -6.394
  276    H    PHE  35           H        PHE  35  -5.169  -0.255  -4.199
  277    HA   PHE  35           HA       PHE  35  -5.204  -3.056  -3.869
  278   1HB   PHE  35          1HB       PHE  35  -3.107  -1.023  -3.088
  279   2HB   PHE  35          2HB       PHE  35  -2.865  -2.763  -2.993
  280    HD1  PHE  35           HD1      PHE  35  -1.504  -0.429  -4.681
  281    HD2  PHE  35           HD2      PHE  35  -4.271  -3.549  -5.535
  282    HE1  PHE  35           HE1      PHE  35  -0.759  -0.444  -7.025
  283    HE2  PHE  35           HE2      PHE  35  -3.532  -3.565  -7.881
  284    HZ   PHE  35           HZ       PHE  35  -1.774  -2.013  -8.629
  285    H    ALA  36           H        ALA  36  -5.225  -0.405  -1.540
  286    HA   ALA  36           HA       ALA  36  -4.932  -1.938   0.793
  287   1HB   ALA  36          1HB       ALA  36  -5.930  -0.030   1.964
  288   2HB   ALA  36          2HB       ALA  36  -4.716   0.488   0.793
  289   3HB   ALA  36          3HB       ALA  36  -6.433   0.654   0.417
  290    H    LYS  37           H        LYS  37  -7.814  -0.989  -1.037
  291    HA   LYS  37           HA       LYS  37  -9.651  -2.224   0.755
  292   1HB   LYS  37          1HB       LYS  37  -9.958  -1.354  -2.121
  293   2HB   LYS  37          2HB       LYS  37 -11.282  -1.955  -1.129
  294   1HG   LYS  37          1HG       LYS  37 -10.793  -0.110   0.484
  295   2HG   LYS  37          2HG       LYS  37  -9.659   0.539  -0.699
  296   1HD   LYS  37          1HD       LYS  37 -12.584   0.037  -1.244
  297   2HD   LYS  37          2HD       LYS  37 -11.916   1.597  -0.765
  298   1HE   LYS  37          1HE       LYS  37 -10.495   1.592  -2.762
  299   2HE   LYS  37          2HE       LYS  37 -11.180   0.040  -3.241
  300   1HZ   LYS  37          1HZ       LYS  37 -12.789   2.507  -2.860
  301   2HZ   LYS  37          2HZ       LYS  37 -12.191   1.991  -4.363
  302   3HZ   LYS  37          3HZ       LYS  37 -13.311   1.036  -3.521
  303    H    GLN  38           H        GLN  38  -7.847  -3.324  -2.024
  304    HA   GLN  38           HA       GLN  38  -9.181  -5.787  -2.399
  305   1HB   GLN  38          1HB       GLN  38  -6.300  -5.032  -2.923
  306   2HB   GLN  38          2HB       GLN  38  -7.039  -6.535  -3.452
  307   1HG   GLN  38          1HG       GLN  38  -7.872  -3.767  -4.292
  308   2HG   GLN  38          2HG       GLN  38  -6.932  -4.908  -5.254
  309   1HE2  GLN  38          2HE2      GLN  38  -7.943  -6.682  -6.159
  310   2HE2  GLN  38          1HE2      GLN  38  -9.666  -6.802  -6.280
  311    H    TRP  39           H        TRP  39  -6.383  -4.873  -0.428
  312    HA   TRP  39           HA       TRP  39  -5.919  -7.429   0.673
  313   1HB   TRP  39          1HB       TRP  39  -4.260  -5.599   0.708
  314   2HB   TRP  39          2HB       TRP  39  -5.271  -4.712   1.841
  315    HD1  TRP  39           HD1      TRP  39  -3.438  -8.133   1.701
  316    HE1  TRP  39           HE1      TRP  39  -2.570  -8.669   4.065
  317    HE3  TRP  39           HE3      TRP  39  -5.347  -4.094   4.186
  318    HZ2  TRP  39           HZ2      TRP  39  -2.678  -7.513   6.648
  319    HZ3  TRP  39           HZ3      TRP  39  -4.917  -3.883   6.598
  320    HH2  TRP  39           HH2      TRP  39  -3.611  -5.558   7.801
  321    H    LEU  40           H        LEU  40  -7.771  -4.632   1.859
  322    HA   LEU  40           HA       LEU  40  -8.658  -5.733   4.270
  323   1HB   LEU  40          1HB       LEU  40  -9.979  -3.757   2.416
  324   2HB   LEU  40          2HB       LEU  40 -10.627  -4.174   3.990
  325    HG   LEU  40           HG       LEU  40  -7.925  -2.916   3.510
  326   1HD1  LEU  40          1HD1      LEU  40  -8.947  -0.913   4.503
  327   2HD1  LEU  40          2HD1      LEU  40  -9.711  -1.369   2.979
  328   3HD1  LEU  40          3HD1      LEU  40 -10.509  -1.732   4.511
  329   1HD2  LEU  40          1HD2      LEU  40  -7.932  -4.282   5.506
  330   2HD2  LEU  40          2HD2      LEU  40  -7.950  -2.576   5.953
  331   3HD2  LEU  40          3HD2      LEU  40  -9.431  -3.530   6.051
  332    H    SER  41           H        SER  41  -9.935  -6.059   1.003
  333    HA   SER  41           HA       SER  41 -12.318  -7.397   1.653
  334   1HB   SER  41          1HB       SER  41 -11.614  -6.401  -0.601
  335   2HB   SER  41          2HB       SER  41 -10.701  -7.888  -0.852
  336    HG   SER  41           HG       SER  41 -12.756  -9.004  -0.466
  337    H    SER  42           H        SER  42  -9.059  -8.593   0.937
  338    HA   SER  42           HA       SER  42  -9.686 -11.338   1.015
  339   1HB   SER  42          1HB       SER  42  -7.037  -9.969   1.543
  340   2HB   SER  42          2HB       SER  42  -7.258 -11.675   1.154
  341    HG   SER  42           HG       SER  42  -8.129 -11.034  -0.863
  342    H    ILE  43           H        ILE  43  -8.427  -9.138   3.524
  343    HA   ILE  43           HA       ILE  43  -8.196 -11.233   5.462
  344    HB   ILE  43           HB       ILE  43  -7.734  -9.491   7.100
  345   1HG1  ILE  43          1HG1      ILE  43  -8.324  -7.512   4.886
  346   2HG1  ILE  43          2HG1      ILE  43  -9.388  -7.834   6.252
  347   1HG2  ILE  43          1HG2      ILE  43  -6.351  -9.025   4.462
  348   2HG2  ILE  43          2HG2      ILE  43  -5.743  -8.522   6.039
  349   3HG2  ILE  43          3HG2      ILE  43  -5.923 -10.238   5.669
  350   1HD1  ILE  43          1HD1      ILE  43  -7.688  -7.021   7.784
  351   2HD1  ILE  43          2HD1      ILE  43  -6.595  -6.731   6.431
  352   3HD1  ILE  43          3HD1      ILE  43  -8.087  -5.803   6.572
  353    H    GLY  44           H        GLY  44 -10.826  -9.553   4.244
  354   1HA   GLY  44          1HA       GLY  44 -13.055 -10.020   4.742
  355   2HA   GLY  44          2HA       GLY  44 -12.534 -10.797   6.228
  356    H    GLU  45           H        GLU  45 -11.617  -7.543   5.268
  357    HA   GLU  45           HA       GLU  45 -13.472  -6.477   7.280
  358   1HB   GLU  45          1HB       GLU  45 -10.540  -5.810   7.015
  359   2HB   GLU  45          2HB       GLU  45 -11.676  -4.855   7.958
  360   1HG   GLU  45          1HG       GLU  45 -12.200  -7.067   9.157
  361   2HG   GLU  45          2HG       GLU  45 -10.688  -7.632   8.450
  362    H    GLU  46           H        GLU  46 -13.561  -6.578   4.344
  363    HA   GLU  46           HA       GLU  46 -13.059  -3.987   3.305
  364   1HB   GLU  46          1HB       GLU  46 -13.660  -6.277   2.108
  365   2HB   GLU  46          2HB       GLU  46 -15.303  -5.674   2.260
  366   1HG   GLU  46          1HG       GLU  46 -13.035  -4.264   0.868
  367   2HG   GLU  46          2HG       GLU  46 -14.330  -5.159   0.083
  368    H    GLY  47           H        GLY  47 -14.099  -2.168   3.703
  369   1HA   GLY  47          1HA       GLY  47 -16.679  -1.517   4.000
  370   2HA   GLY  47          2HA       GLY  47 -16.314  -2.222   5.571
  371    H    ALA  48           H        ALA  48 -13.521  -1.305   5.420
  372    HA   ALA  48           HA       ALA  48 -13.791   1.238   6.622
  373   1HB   ALA  48          1HB       ALA  48 -11.946  -0.291   7.148
  374   2HB   ALA  48          2HB       ALA  48 -11.306  -0.073   5.519
  375   3HB   ALA  48          3HB       ALA  48 -11.356   1.290   6.637
  376    H    THR  49           H        THR  49 -13.683   3.237   5.800
  377    HA   THR  49           HA       THR  49 -13.889   3.482   2.916
  378    HB   THR  49           HB       THR  49 -14.078   5.682   4.980
  379    HG1  THR  49           HG1      THR  49 -15.672   3.563   4.666
  380   1HG2  THR  49          1HG2      THR  49 -13.855   6.420   2.649
  381   2HG2  THR  49          2HG2      THR  49 -15.233   5.414   2.200
  382   3HG2  THR  49          3HG2      THR  49 -15.459   6.784   3.286
  383    H    VAL  50           H        VAL  50 -11.793   3.169   2.164
  384    HA   VAL  50           HA       VAL  50  -9.612   4.736   3.226
  385    HB   VAL  50           HB       VAL  50  -9.620   3.033   0.727
  386   1HG1  VAL  50          1HG1      VAL  50  -7.752   4.589   0.875
  387   2HG1  VAL  50          2HG1      VAL  50  -7.368   3.995   2.491
  388   3HG1  VAL  50          3HG1      VAL  50  -7.201   2.929   1.096
  389   1HG2  VAL  50          1HG2      VAL  50  -8.668   1.253   2.131
  390   2HG2  VAL  50          2HG2      VAL  50  -8.932   2.253   3.560
  391   3HG2  VAL  50          3HG2      VAL  50 -10.310   1.675   2.622
  392    H    THR  51           H        THR  51  -9.212   6.739   2.641
  393    HA   THR  51           HA       THR  51  -9.983   7.682  -0.031
  394    HB   THR  51           HB       THR  51 -10.760   9.805   0.948
  395    HG1  THR  51           HG1      THR  51 -11.023   8.825   3.513
  396   1HG2  THR  51          1HG2      THR  51 -12.415   8.061   0.510
  397   2HG2  THR  51          2HG2      THR  51 -12.154   7.397   2.123
  398   3HG2  THR  51          3HG2      THR  51 -12.855   9.005   1.934
  399    H    SER  52           H        SER  52  -9.132  10.239   0.073
  400    HA   SER  52           HA       SER  52  -6.304  10.057   0.050
  401   1HB   SER  52          1HB       SER  52  -8.008  12.559   0.089
  402   2HB   SER  52          2HB       SER  52  -6.346  12.421  -0.486
  403    HG   SER  52           HG       SER  52  -8.019  12.370  -2.151
  404    H    GLU  53           H        GLU  53  -8.524  10.535   2.565
  405    HA   GLU  53           HA       GLU  53  -6.770  12.049   4.288
  406   1HB   GLU  53          1HB       GLU  53  -9.223  12.253   4.479
  407   2HB   GLU  53          2HB       GLU  53  -9.329  10.552   4.912
  408   1HG   GLU  53          1HG       GLU  53  -7.980  11.005   6.920
  409   2HG   GLU  53          2HG       GLU  53  -7.959  12.714   6.494
  410    H    GLU  54           H        GLU  54  -7.591   8.725   3.682
  411    HA   GLU  54           HA       GLU  54  -6.415   7.746   6.128
  412   1HB   GLU  54          1HB       GLU  54  -7.251   6.071   3.771
  413   2HB   GLU  54          2HB       GLU  54  -7.176   5.608   5.464
  414   1HG   GLU  54          1HG       GLU  54  -9.130   7.570   4.287
  415   2HG   GLU  54          2HG       GLU  54  -9.471   5.878   4.633
  416    H    CYS  55           H        CYS  55  -5.681   7.530   2.645
  417    HA   CYS  55           HA       CYS  55  -3.107   6.289   3.262
  418   1HB   CYS  55          1HB       CYS  55  -2.932   5.945   0.827
  419   2HB   CYS  55          2HB       CYS  55  -4.440   5.295   1.461
  420    HG   CYS  55           HG       CYS  55  -4.590   8.447   0.304
  421    H    ARG  56           H        ARG  56  -1.226   7.375   3.249
  422    HA   ARG  56           HA       ARG  56  -1.234  10.096   2.100
  423   1HB   ARG  56          1HB       ARG  56  -1.106   9.947   4.625
  424   2HB   ARG  56          2HB       ARG  56   0.460   9.173   4.421
  425   1HG   ARG  56          1HG       ARG  56   1.192  11.200   3.144
  426   2HG   ARG  56          2HG       ARG  56  -0.322  11.965   3.631
  427   1HD   ARG  56          1HD       ARG  56   0.348  11.444   6.020
  428   2HD   ARG  56          2HD       ARG  56   1.942  11.037   5.383
  429    HE   ARG  56           HE       ARG  56   0.803  13.666   5.700
  430   1HH1  ARG  56          1HH1      ARG  56   3.234  11.758   4.042
  431   2HH1  ARG  56          2HH1      ARG  56   4.190  13.136   3.589
  432   1HH2  ARG  56          1HH2      ARG  56   2.093  15.468   5.149
  433   2HH2  ARG  56          2HH2      ARG  56   3.559  15.237   4.252
  434    H    PHE  57           H        PHE  57   0.056  10.273   0.384
  435    HA   PHE  57           HA       PHE  57   2.198   8.373  -0.061
  436   1HB   PHE  57          1HB       PHE  57   0.844   9.047  -1.974
  437   2HB   PHE  57          2HB       PHE  57   1.258  10.736  -1.703
  438    HD1  PHE  57           HD1      PHE  57   2.810  11.619  -3.130
  439    HD2  PHE  57           HD2      PHE  57   3.065   7.491  -2.128
  440    HE1  PHE  57           HE1      PHE  57   4.761  11.384  -4.608
  441    HE2  PHE  57           HE2      PHE  57   5.020   7.250  -3.603
  442    HZ   PHE  57           HZ       PHE  57   5.869   9.199  -4.846
  443    H    CYS  58           H        CYS  58   3.996   8.681   1.083
  444    HA   CYS  58           HA       CYS  58   4.761  11.381   1.842
  445   1HB   CYS  58          1HB       CYS  58   5.896   8.699   2.633
  446   2HB   CYS  58          2HB       CYS  58   6.436  10.250   3.274
  447    HG   CYS  58           HG       CYS  58   3.986   8.335   4.280
  448    H    HIS  59           H        HIS  59   6.425   8.572   0.340
  449    HA   HIS  59           HA       HIS  59   7.858  10.338  -1.415
  450   1HB   HIS  59          1HB       HIS  59  10.101   9.856  -0.627
  451   2HB   HIS  59          2HB       HIS  59   9.170  10.606   0.657
  452    HD1  HIS  59           HD1      HIS  59   9.188   9.422   2.862
  453    HD2  HIS  59           HD2      HIS  59  10.388   6.957  -0.268
  454    HE1  HIS  59           HE1      HIS  59   9.929   7.266   3.934
  455    HE2  HIS  59           HE2      HIS  59  10.807   5.855   2.031
  456    H    SER  60           H        SER  60   9.714   9.047  -2.478
  457    HA   SER  60           HA       SER  60   9.003   6.215  -2.823
  458   1HB   SER  60          1HB       SER  60   9.880   8.033  -5.080
  459   2HB   SER  60          2HB       SER  60   9.267   6.383  -5.204
  460    HG   SER  60           HG       SER  60   7.842   8.721  -4.441
  461    H    GLU  61           H        GLU  61  10.832   4.853  -3.231
  462    HA   GLU  61           HA       GLU  61  13.458   6.114  -3.235
  463   1HB   GLU  61          1HB       GLU  61  14.203   4.789  -1.263
  464   2HB   GLU  61          2HB       GLU  61  13.014   6.022  -0.872
  465   1HG   GLU  61          1HG       GLU  61  11.260   4.287  -0.882
  466   2HG   GLU  61          2HG       GLU  61  12.502   3.071  -1.175
  467    H    LYS  62           H        LYS  62  15.217   4.423  -3.393
  468    HA   LYS  62           HA       LYS  62  14.633   2.639  -5.477
  469   1HB   LYS  62          1HB       LYS  62  16.903   1.801  -5.210
  470   2HB   LYS  62          2HB       LYS  62  16.882   3.554  -5.125
  471   1HG   LYS  62          1HG       LYS  62  18.273   3.142  -3.400
  472   2HG   LYS  62          2HG       LYS  62  16.748   3.037  -2.522
  473   1HD   LYS  62          1HD       LYS  62  16.772   0.636  -2.659
  474   2HD   LYS  62          2HD       LYS  62  18.185   0.668  -3.717
  475   1HE   LYS  62          1HE       LYS  62  19.455   1.751  -1.864
  476   2HE   LYS  62          2HE       LYS  62  18.054   1.502  -0.823
  477   1HZ   LYS  62          1HZ       LYS  62  19.397  -0.726  -2.243
  478   2HZ   LYS  62          2HZ       LYS  62  19.858  -0.223  -0.694
  479   3HZ   LYS  62          3HZ       LYS  62  18.297  -0.820  -0.957
  480    H    ALA  63           H        ALA  63  14.665   0.326  -5.477
  481    HA   ALA  63           HA       ALA  63  13.377  -0.637  -3.010
  482   1HB   ALA  63          1HB       ALA  63  11.792  -0.170  -4.813
  483   2HB   ALA  63          2HB       ALA  63  12.648  -1.313  -5.847
  484   3HB   ALA  63          3HB       ALA  63  11.834  -1.882  -4.390
  485    HA   PRO  64           HA       PRO  64  16.255  -4.081  -3.175
  486   1HB   PRO  64          1HB       PRO  64  14.272  -5.268  -1.331
  487   2HB   PRO  64          2HB       PRO  64  16.002  -5.001  -1.095
  488   1HG   PRO  64          1HG       PRO  64  14.169  -3.515   0.180
  489   2HG   PRO  64          2HG       PRO  64  15.704  -2.825  -0.379
  490   1HD   PRO  64          1HD       PRO  64  12.975  -2.605  -1.584
  491   2HD   PRO  64          2HD       PRO  64  14.247  -1.374  -1.440
  492    H    ASP  65           H        ASP  65  16.216  -5.942  -4.363
  493    HA   ASP  65           HA       ASP  65  14.115  -6.302  -6.204
  494   1HB   ASP  65          1HB       ASP  65  16.480  -6.947  -6.609
  495   2HB   ASP  65          2HB       ASP  65  16.298  -8.269  -5.461
  496    H    GLU  66           H        GLU  66  14.721  -7.675  -3.082
  497    HA   GLU  66           HA       GLU  66  13.114  -9.940  -3.147
  498   1HB   GLU  66          1HB       GLU  66  14.638  -9.402  -1.307
  499   2HB   GLU  66          2HB       GLU  66  13.605  -8.059  -0.836
  500   1HG   GLU  66          1HG       GLU  66  11.867  -9.517  -0.160
  501   2HG   GLU  66          2HG       GLU  66  12.657 -10.908  -0.902
  502    H    VAL  67           H        VAL  67  12.193  -6.574  -2.355
  503    HA   VAL  67           HA       VAL  67   9.454  -7.344  -1.921
  504    HB   VAL  67           HB       VAL  67   8.934  -5.009  -1.629
  505   1HG1  VAL  67          1HG1      VAL  67  10.484  -4.436   0.189
  506   2HG1  VAL  67          2HG1      VAL  67   9.957  -6.118   0.251
  507   3HG1  VAL  67          3HG1      VAL  67  11.566  -5.720  -0.352
  508   1HG2  VAL  67          1HG2      VAL  67  11.734  -4.411  -2.579
  509   2HG2  VAL  67          2HG2      VAL  67  10.239  -4.048  -3.444
  510   3HG2  VAL  67          3HG2      VAL  67  10.595  -3.237  -1.918
  511    H    ILE  68           H        ILE  68  11.380  -6.217  -4.574
  512    HA   ILE  68           HA       ILE  68   9.347  -5.424  -6.346
  513    HB   ILE  68           HB       ILE  68  12.035  -6.679  -6.939
  514   1HG1  ILE  68          1HG1      ILE  68  12.204  -4.566  -5.729
  515   2HG1  ILE  68          2HG1      ILE  68  12.746  -4.365  -7.392
  516   1HG2  ILE  68          1HG2      ILE  68  10.165  -5.224  -8.802
  517   2HG2  ILE  68          2HG2      ILE  68  11.800  -5.759  -9.191
  518   3HG2  ILE  68          3HG2      ILE  68  10.544  -6.946  -8.838
  519   1HD1  ILE  68          1HD1      ILE  68  10.565  -3.379  -7.953
  520   2HD1  ILE  68          2HD1      ILE  68  10.091  -3.521  -6.259
  521   3HD1  ILE  68          3HD1      ILE  68  11.431  -2.470  -6.718
  522    H    GLU  69           H        GLU  69  10.723  -8.552  -5.551
  523    HA   GLU  69           HA       GLU  69   9.669 -10.155  -7.539
  524   1HB   GLU  69          1HB       GLU  69  11.234 -10.709  -5.540
  525   2HB   GLU  69          2HB       GLU  69   9.744 -11.068  -4.680
  526   1HG   GLU  69          1HG       GLU  69  10.611 -13.104  -5.550
  527   2HG   GLU  69          2HG       GLU  69   9.172 -12.685  -6.481
  528    H    ALA  70           H        ALA  70   8.129  -8.935  -4.616
  529    HA   ALA  70           HA       ALA  70   5.723 -10.471  -5.045
  530   1HB   ALA  70          1HB       ALA  70   6.506  -9.982  -2.777
  531   2HB   ALA  70          2HB       ALA  70   6.276  -8.258  -3.073
  532   3HB   ALA  70          3HB       ALA  70   4.886  -9.344  -3.059
  533    H    ILE  71           H        ILE  71   6.783  -7.127  -5.468
  534    HA   ILE  71           HA       ILE  71   4.269  -5.983  -5.967
  535    HB   ILE  71           HB       ILE  71   6.980  -5.111  -6.984
  536   1HG1  ILE  71          1HG1      ILE  71   5.347  -4.172  -4.615
  537   2HG1  ILE  71          2HG1      ILE  71   6.757  -5.223  -4.520
  538   1HG2  ILE  71          1HG2      ILE  71   5.944  -2.902  -7.294
  539   2HG2  ILE  71          2HG2      ILE  71   5.214  -4.125  -8.334
  540   3HG2  ILE  71          3HG2      ILE  71   4.374  -3.590  -6.878
  541   1HD1  ILE  71          1HD1      ILE  71   8.141  -3.429  -5.439
  542   2HD1  ILE  71          2HD1      ILE  71   6.724  -2.380  -5.507
  543   3HD1  ILE  71          3HD1      ILE  71   7.332  -2.942  -3.948
  544    H    LYS  72           H        LYS  72   6.594  -7.508  -8.158
  545    HA   LYS  72           HA       LYS  72   5.396  -6.772 -10.581
  546   1HB   LYS  72          1HB       LYS  72   6.954  -9.264  -9.900
  547   2HB   LYS  72          2HB       LYS  72   6.546  -8.759 -11.533
  548   1HG   LYS  72          1HG       LYS  72   7.876  -6.771 -11.295
  549   2HG   LYS  72          2HG       LYS  72   8.211  -7.154  -9.608
  550   1HD   LYS  72          1HD       LYS  72   9.056  -8.774 -12.010
  551   2HD   LYS  72          2HD       LYS  72  10.105  -7.778 -10.998
  552   1HE   LYS  72          1HE       LYS  72   9.584  -9.195  -9.073
  553   2HE   LYS  72          2HE       LYS  72   8.542 -10.189 -10.088
  554   1HZ   LYS  72          1HZ       LYS  72  11.478  -9.856 -10.348
  555   2HZ   LYS  72          2HZ       LYS  72  10.650 -11.245  -9.839
  556   3HZ   LYS  72          3HZ       LYS  72  10.507 -10.716 -11.446
  557    H    GLN  73           H        GLN  73   4.725  -9.451  -8.421
  558    HA   GLN  73           HA       GLN  73   2.843 -10.619 -10.307
  559   1HB   GLN  73          1HB       GLN  73   4.362 -12.103  -9.095
  560   2HB   GLN  73          2HB       GLN  73   3.715 -11.536  -7.563
  561   1HG   GLN  73          1HG       GLN  73   2.792 -13.691  -8.105
  562   2HG   GLN  73          2HG       GLN  73   1.527 -12.467  -8.154
  563   1HE2  GLN  73          2HE2      GLN  73   0.624 -11.889 -10.130
  564   2HE2  GLN  73          1HE2      GLN  73   0.823 -12.860 -11.549
  565    H    ASN  74           H        ASN  74   2.797  -9.256  -7.018
  566    HA   ASN  74           HA       ASN  74  -0.056  -9.647  -6.788
  567   1HB   ASN  74          1HB       ASN  74   1.905  -8.221  -4.977
  568   2HB   ASN  74          2HB       ASN  74   0.211  -8.498  -4.594
  569   1HD2  ASN  74          2HD2      ASN  74   2.653  -9.377  -3.255
  570   2HD2  ASN  74          1HD2      ASN  74   2.558 -11.104  -3.161
  571    H    GLY  75           H        GLY  75   2.115  -7.038  -7.578
  572   1HA   GLY  75          1HA       GLY  75   1.480  -5.040  -8.664
  573   2HA   GLY  75          2HA       GLY  75  -0.172  -5.287  -8.109
  574    H    TYR  76           H        TYR  76   1.377  -5.981  -5.453
  575    HA   TYR  76           HA       TYR  76   2.139  -3.365  -4.524
  576   1HB   TYR  76          1HB       TYR  76   0.402  -3.211  -2.795
  577   2HB   TYR  76          2HB       TYR  76  -0.319  -3.214  -4.402
  578    HD1  TYR  76           HD1      TYR  76   0.073  -5.072  -1.272
  579    HD2  TYR  76           HD2      TYR  76  -1.643  -5.128  -5.166
  580    HE1  TYR  76           HE1      TYR  76  -1.368  -6.946  -0.603
  581    HE2  TYR  76           HE2      TYR  76  -3.088  -7.006  -4.505
  582    HH   TYR  76           HH       TYR  76  -3.165  -8.783  -2.857
  583    H    PHE  77           H        PHE  77   2.989  -3.433  -2.355
  584    HA   PHE  77           HA       PHE  77   3.315  -6.130  -1.229
  585   1HB   PHE  77          1HB       PHE  77   5.437  -5.370  -2.272
  586   2HB   PHE  77          2HB       PHE  77   5.411  -3.938  -1.248
  587    HD1  PHE  77           HD1      PHE  77   6.171  -4.016   0.991
  588    HD2  PHE  77           HD2      PHE  77   5.739  -7.611  -1.245
  589    HE1  PHE  77           HE1      PHE  77   7.386  -5.246   2.740
  590    HE2  PHE  77           HE2      PHE  77   6.955  -8.847   0.501
  591    HZ   PHE  77           HZ       PHE  77   7.780  -7.665   2.497
  592    H    ILE  78           H        ILE  78   2.097  -6.145   0.541
  593    HA   ILE  78           HA       ILE  78   1.587  -3.719   2.031
  594    HB   ILE  78           HB       ILE  78   0.706  -6.560   2.576
  595   1HG1  ILE  78          1HG1      ILE  78  -0.248  -5.632   0.519
  596   2HG1  ILE  78          2HG1      ILE  78  -1.483  -5.805   1.762
  597   1HG2  ILE  78          1HG2      ILE  78   0.777  -5.261   4.633
  598   2HG2  ILE  78          2HG2      ILE  78  -0.185  -3.989   3.878
  599   3HG2  ILE  78          3HG2      ILE  78  -0.891  -5.582   4.155
  600   1HD1  ILE  78          1HD1      ILE  78  -1.356  -3.420   2.230
  601   2HD1  ILE  78          2HD1      ILE  78  -0.097  -3.242   1.008
  602   3HD1  ILE  78          3HD1      ILE  78  -1.726  -3.720   0.532
  603    H    TYR  79           H        TYR  79   3.464  -3.082   2.991
  604    HA   TYR  79           HA       TYR  79   4.969  -4.874   4.669
  605   1HB   TYR  79          1HB       TYR  79   6.181  -3.076   3.628
  606   2HB   TYR  79          2HB       TYR  79   5.057  -1.879   4.259
  607    HD1  TYR  79           HD1      TYR  79   5.791  -0.619   6.034
  608    HD2  TYR  79           HD2      TYR  79   7.300  -4.571   5.584
  609    HE1  TYR  79           HE1      TYR  79   7.232  -0.283   7.996
  610    HE2  TYR  79           HE2      TYR  79   8.749  -4.247   7.544
  611    HH   TYR  79           HH       TYR  79   8.452  -1.450   9.609
  612    H    LYS  80           H        LYS  80   3.743  -5.676   6.277
  613    HA   LYS  80           HA       LYS  80   1.804  -4.193   7.704
  614   1HB   LYS  80          1HB       LYS  80   3.238  -6.745   8.442
  615   2HB   LYS  80          2HB       LYS  80   1.876  -6.081   9.328
  616   1HG   LYS  80          1HG       LYS  80   0.481  -6.318   7.315
  617   2HG   LYS  80          2HG       LYS  80   1.853  -7.050   6.478
  618   1HD   LYS  80          1HD       LYS  80   1.913  -8.842   8.140
  619   2HD   LYS  80          2HD       LYS  80   0.556  -8.107   8.992
  620   1HE   LYS  80          1HE       LYS  80  -0.854  -8.437   7.019
  621   2HE   LYS  80          2HE       LYS  80   0.505  -9.175   6.171
  622   1HZ   LYS  80          1HZ       LYS  80  -0.977 -10.843   7.107
  623   2HZ   LYS  80          2HZ       LYS  80   0.555 -10.927   7.834
  624   3HZ   LYS  80          3HZ       LYS  80  -0.743 -10.212   8.663
  625    H    MET  81           H        MET  81   2.621  -2.332   8.529
  626    HA   MET  81           HA       MET  81   4.953  -2.337  10.209
  627   1HB   MET  81          1HB       MET  81   4.496  -0.365   8.871
  628   2HB   MET  81          2HB       MET  81   2.911  -0.189   9.611
  629   1HG   MET  81          1HG       MET  81   4.008   0.213  11.781
  630   2HG   MET  81          2HG       MET  81   5.574   0.125  10.977
  631   1HE   MET  81          1HE       MET  81   4.871   1.575   8.194
  632   2HE   MET  81          2HE       MET  81   6.358   1.834   9.109
  633   3HE   MET  81          3HE       MET  81   5.398   3.215   8.575
  634    H    GLU  82           H        GLU  82   4.914  -1.769  12.470
  635    HA   GLU  82           HA       GLU  82   3.073  -3.146  14.039
  636   1HB   GLU  82          1HB       GLU  82   3.950  -1.552  15.896
  637   2HB   GLU  82          2HB       GLU  82   5.058  -2.687  15.143
  638   1HG   GLU  82          1HG       GLU  82   4.837   0.072  14.045
  639   2HG   GLU  82          2HG       GLU  82   5.740  -0.196  15.535
  640    H    GLY  83           H        GLY  83   1.224  -2.614  15.087
  641   1HA   GLY  83          1HA       GLY  83  -0.271  -0.708  15.789
  642   2HA   GLY  83          2HA       GLY  83  -0.051  -0.122  14.143
  643    H    CYS  84           H        CYS  84  -0.032  -2.868  13.088
  644    HA   CYS  84           HA       CYS  84  -2.917  -3.399  13.202
  645   1HB   CYS  84          1HB       CYS  84  -2.522  -4.718  11.125
  646   2HB   CYS  84          2HB       CYS  84  -2.074  -3.025  10.961
  647    HG   CYS  84           HG       CYS  84   0.653  -3.441  11.069
  648    H    ASN  85           H        ASN  85  -0.685  -4.193  15.099
  649    HA   ASN  85           HA       ASN  85  -1.176  -7.095  15.084
  650   1HB   ASN  85          1HB       ASN  85   1.161  -6.641  14.528
  651   2HB   ASN  85          2HB       ASN  85   1.323  -5.620  15.953
  652   1HD2  ASN  85          2HD2      ASN  85   2.975  -6.834  16.794
  653   2HD2  ASN  85          1HD2      ASN  85   2.740  -8.414  17.458
  Start of MODEL   14
    1    H    MET   1           H        MET   1  14.701   0.415  -9.118
    2    HA   MET   1           HA       MET   1  12.088   1.342 -10.143
    3   1HB   MET   1          1HB       MET   1  12.518  -1.061 -10.402
    4   2HB   MET   1          2HB       MET   1  12.941  -1.179  -8.701
    5   1HG   MET   1          1HG       MET   1  10.685  -0.690  -8.048
    6   2HG   MET   1          2HG       MET   1  10.229  -0.369  -9.723
    7   1HE   MET   1          1HE       MET   1   8.159  -2.096  -9.356
    8   2HE   MET   1          2HE       MET   1   8.714  -2.404  -7.711
    9   3HE   MET   1          3HE       MET   1   8.383  -3.753  -8.796
   10    H    GLN   2           H        GLN   2  11.599   3.041  -8.905
   11    HA   GLN   2           HA       GLN   2  12.127   2.897  -6.033
   12   1HB   GLN   2          1HB       GLN   2  11.690   5.313  -5.980
   13   2HB   GLN   2          2HB       GLN   2  12.974   4.912  -7.104
   14   1HG   GLN   2          1HG       GLN   2  10.128   5.478  -7.909
   15   2HG   GLN   2          2HG       GLN   2  11.419   6.674  -7.897
   16   1HE2  GLN   2          2HE2      GLN   2   9.794   5.723 -10.101
   17   2HE2  GLN   2          1HE2      GLN   2  10.882   5.064 -11.276
   18    H    ILE   3           H        ILE   3  10.570   2.389  -4.706
   19    HA   ILE   3           HA       ILE   3   7.964   1.863  -5.780
   20    HB   ILE   3           HB       ILE   3   7.464   1.033  -3.459
   21   1HG1  ILE   3          1HG1      ILE   3  10.406   1.646  -3.076
   22   2HG1  ILE   3          2HG1      ILE   3   9.066   2.383  -2.207
   23   1HG2  ILE   3          1HG2      ILE   3   8.880  -0.964  -3.722
   24   2HG2  ILE   3          2HG2      ILE   3   8.128  -0.452  -5.234
   25   3HG2  ILE   3          3HG2      ILE   3   9.829  -0.102  -4.933
   26   1HD1  ILE   3          1HD1      ILE   3   8.533   0.229  -1.197
   27   2HD1  ILE   3          2HD1      ILE   3   9.881  -0.507  -2.064
   28   3HD1  ILE   3          3HD1      ILE   3  10.188   0.728  -0.844
   29    H    HIS   4           H        HIS   4   6.226   3.028  -5.649
   30    HA   HIS   4           HA       HIS   4   6.175   5.503  -4.150
   31   1HB   HIS   4          1HB       HIS   4   3.925   4.164  -5.684
   32   2HB   HIS   4          2HB       HIS   4   3.996   5.846  -5.169
   33    HD1  HIS   4           HD1      HIS   4   3.828   4.523  -8.179
   34    HD2  HIS   4           HD2      HIS   4   7.022   6.486  -6.379
   35    HE1  HIS   4           HE1      HIS   4   5.259   5.369 -10.068
   36    HE2  HIS   4           HE2      HIS   4   7.227   6.492  -8.957
   37    H    VAL   5           H        VAL   5   5.867   5.359  -2.024
   38    HA   VAL   5           HA       VAL   5   4.446   3.024  -0.993
   39    HB   VAL   5           HB       VAL   5   6.003   5.026   0.625
   40   1HG1  VAL   5          1HG1      VAL   5   6.117   3.173   2.228
   41   2HG1  VAL   5          2HG1      VAL   5   4.456   3.648   1.872
   42   3HG1  VAL   5          3HG1      VAL   5   5.130   2.191   1.145
   43   1HG2  VAL   5          1HG2      VAL   5   7.888   3.465   0.543
   44   2HG2  VAL   5          2HG2      VAL   5   7.005   2.459  -0.606
   45   3HG2  VAL   5          3HG2      VAL   5   7.496   4.092  -1.057
   46    H    TYR   6           H        TYR   6   2.372   3.296  -0.692
   47    HA   TYR   6           HA       TYR   6   1.394   5.838   0.394
   48   1HB   TYR   6          1HB       TYR   6  -0.100   3.498  -0.815
   49   2HB   TYR   6          2HB       TYR   6  -0.864   4.946  -0.169
   50    HD1  TYR   6           HD1      TYR   6   1.351   3.674  -2.849
   51    HD2  TYR   6           HD2      TYR   6  -0.999   6.940  -1.459
   52    HE1  TYR   6           HE1      TYR   6   1.570   4.760  -5.043
   53    HE2  TYR   6           HE2      TYR   6  -0.782   8.035  -3.651
   54    HH   TYR   6           HH       TYR   6   0.667   8.013  -5.589
   55    H    ASP   7           H        ASP   7   2.096   5.559   2.524
   56    HA   ASP   7           HA       ASP   7   1.448   3.229   4.048
   57   1HB   ASP   7          1HB       ASP   7   3.365   4.583   4.691
   58   2HB   ASP   7          2HB       ASP   7   2.336   5.990   4.919
   59    H    THR   8           H        THR   8  -0.615   2.755   4.223
   60    HA   THR   8           HA       THR   8  -2.606   4.863   4.344
   61    HB   THR   8           HB       THR   8  -3.055   1.875   4.253
   62    HG1  THR   8           HG1      THR   8  -1.788   3.088   2.461
   63   1HG2  THR   8          1HG2      THR   8  -5.226   2.502   3.301
   64   2HG2  THR   8          2HG2      THR   8  -5.012   3.206   4.903
   65   3HG2  THR   8          3HG2      THR   8  -4.811   4.207   3.464
   66    H    TYR   9           H        TYR   9  -3.201   5.644   6.233
   67    HA   TYR   9           HA       TYR   9  -2.769   4.142   8.674
   68   1HB   TYR   9          1HB       TYR   9  -3.980   6.894   8.316
   69   2HB   TYR   9          2HB       TYR   9  -3.396   6.193   9.821
   70    HD1  TYR   9           HD1      TYR   9  -0.938   5.745  10.079
   71    HD2  TYR   9           HD2      TYR   9  -2.507   8.005   6.838
   72    HE1  TYR   9           HE1      TYR   9   1.298   6.666   9.647
   73    HE2  TYR   9           HE2      TYR   9  -0.273   8.934   6.394
   74    HH   TYR   9           HH       TYR   9   2.531   7.633   7.660
   75    H    VAL  10           H        VAL  10  -4.255   2.461   8.495
   76    HA   VAL  10           HA       VAL  10  -7.074   3.102   8.147
   77    HB   VAL  10           HB       VAL  10  -5.727   0.420   8.525
   78   1HG1  VAL  10          1HG1      VAL  10  -7.823  -0.528   7.701
   79   2HG1  VAL  10          2HG1      VAL  10  -8.067   0.379   9.195
   80   3HG1  VAL  10          3HG1      VAL  10  -8.534   1.086   7.648
   81   1HG2  VAL  10          1HG2      VAL  10  -6.675   1.785   6.013
   82   2HG2  VAL  10          2HG2      VAL  10  -4.999   1.494   6.477
   83   3HG2  VAL  10          3HG2      VAL  10  -6.063   0.134   6.117
   84    H    LYS  11           H        LYS  11  -8.006   3.882   9.960
   85    HA   LYS  11           HA       LYS  11  -7.297   2.952  12.571
   86   1HB   LYS  11          1HB       LYS  11  -9.735   4.512  11.683
   87   2HB   LYS  11          2HB       LYS  11  -9.194   4.304  13.346
   88   1HG   LYS  11          1HG       LYS  11  -7.141   5.510  12.845
   89   2HG   LYS  11          2HG       LYS  11  -7.645   5.689  11.165
   90   1HD   LYS  11          1HD       LYS  11  -9.615   6.970  11.933
   91   2HD   LYS  11          2HD       LYS  11  -9.016   6.850  13.590
   92   1HE   LYS  11          1HE       LYS  11  -6.952   8.005  12.900
   93   2HE   LYS  11          2HE       LYS  11  -7.604   8.165  11.270
   94   1HZ   LYS  11          1HZ       LYS  11  -9.429   9.480  12.186
   95   2HZ   LYS  11          2HZ       LYS  11  -8.756   9.353  13.739
   96   3HZ   LYS  11          3HZ       LYS  11  -7.928  10.191  12.518
   97    H    ALA  12           H        ALA  12  -7.630   0.881  13.005
   98    HA   ALA  12           HA       ALA  12  -9.555  -0.726  11.687
   99   1HB   ALA  12          1HB       ALA  12  -8.797  -2.511  13.160
  100   2HB   ALA  12          2HB       ALA  12  -7.425  -1.609  12.516
  101   3HB   ALA  12          3HB       ALA  12  -7.959  -1.336  14.174
  102    H    LYS  13           H        LYS  13 -11.086  -2.156  12.926
  103    HA   LYS  13           HA       LYS  13 -13.150  -0.610  13.973
  104   1HB   LYS  13          1HB       LYS  13 -14.190  -2.757  14.631
  105   2HB   LYS  13          2HB       LYS  13 -13.568  -2.781  12.987
  106   1HG   LYS  13          1HG       LYS  13 -11.670  -4.078  13.653
  107   2HG   LYS  13          2HG       LYS  13 -12.098  -3.916  15.358
  108   1HD   LYS  13          1HD       LYS  13 -12.758  -6.098  14.591
  109   2HD   LYS  13          2HD       LYS  13 -14.207  -5.137  14.889
  110   1HE   LYS  13          1HE       LYS  13 -14.568  -6.276  12.848
  111   2HE   LYS  13          2HE       LYS  13 -14.214  -4.602  12.427
  112   1HZ   LYS  13          1HZ       LYS  13 -11.944  -5.244  11.900
  113   2HZ   LYS  13          2HZ       LYS  13 -12.273  -6.846  12.337
  114   3HZ   LYS  13          3HZ       LYS  13 -13.045  -6.167  10.994
  115    H    ASP  14           H        ASP  14 -10.544  -2.279  15.596
  116    HA   ASP  14           HA       ASP  14 -11.561  -2.148  18.229
  117   1HB   ASP  14          1HB       ASP  14  -8.674  -2.220  17.332
  118   2HB   ASP  14          2HB       ASP  14  -9.275  -2.635  18.933
  119    H    GLY  15           H        GLY  15 -10.115   0.209  16.177
  120   1HA   GLY  15          1HA       GLY  15 -10.278   2.532  16.725
  121   2HA   GLY  15          2HA       GLY  15 -10.110   2.110  18.422
  122    H    HIS  16           H        HIS  16  -7.889   0.217  17.003
  123    HA   HIS  16           HA       HIS  16  -5.793   2.163  17.554
  124   1HB   HIS  16          1HB       HIS  16  -4.233   0.333  17.652
  125   2HB   HIS  16          2HB       HIS  16  -5.638  -0.074  18.619
  126    HD1  HIS  16           HD1      HIS  16  -6.627  -2.313  18.210
  127    HD2  HIS  16           HD2      HIS  16  -4.193  -1.076  15.072
  128    HE1  HIS  16           HE1      HIS  16  -6.445  -4.292  16.668
  129    HE2  HIS  16           HE2      HIS  16  -4.722  -3.608  14.966
  130    H    VAL  17           H        VAL  17  -4.018   2.496  16.107
  131    HA   VAL  17           HA       VAL  17  -5.040   2.857  13.429
  132    HB   VAL  17           HB       VAL  17  -2.351   3.655  14.555
  133   1HG1  VAL  17          1HG1      VAL  17  -2.365   3.582  12.129
  134   2HG1  VAL  17          2HG1      VAL  17  -3.824   4.574  12.088
  135   3HG1  VAL  17          3HG1      VAL  17  -2.311   5.253  12.689
  136   1HG2  VAL  17          1HG2      VAL  17  -3.332   5.885  14.835
  137   2HG2  VAL  17          2HG2      VAL  17  -4.901   5.253  14.337
  138   3HG2  VAL  17          3HG2      VAL  17  -4.154   4.682  15.829
  139    H    MET  18           H        MET  18  -4.961   1.171  12.124
  140    HA   MET  18           HA       MET  18  -2.572  -0.514  12.044
  141   1HB   MET  18          1HB       MET  18  -5.348  -0.772  10.919
  142   2HB   MET  18          2HB       MET  18  -4.030  -1.727  10.256
  143   1HG   MET  18          1HG       MET  18  -4.964  -1.736  13.112
  144   2HG   MET  18          2HG       MET  18  -5.284  -2.980  11.905
  145   1HE   MET  18          1HE       MET  18  -3.223  -4.278  10.638
  146   2HE   MET  18          2HE       MET  18  -1.545  -4.130  11.158
  147   3HE   MET  18          3HE       MET  18  -2.363  -2.756  10.412
  148    H    HIS  19           H        HIS  19  -1.104   0.889  11.063
  149    HA   HIS  19           HA       HIS  19  -1.828   1.650   8.321
  150   1HB   HIS  19          1HB       HIS  19  -0.352   3.486   8.398
  151   2HB   HIS  19          2HB       HIS  19  -1.219   3.521   9.925
  152    HD1  HIS  19           HD1      HIS  19   2.095   3.626   8.507
  153    HD2  HIS  19           HD2      HIS  19   0.422   2.446  12.133
  154    HE1  HIS  19           HE1      HIS  19   3.997   3.609  10.164
  155    HE2  HIS  19           HE2      HIS  19   2.925   3.071  12.389
  156    H    PHE  20           H        PHE  20  -0.224   1.427   6.697
  157    HA   PHE  20           HA       PHE  20   1.922  -0.425   7.133
  158   1HB   PHE  20          1HB       PHE  20   0.928  -2.144   5.571
  159   2HB   PHE  20          2HB       PHE  20   0.154  -2.043   7.148
  160    HD1  PHE  20           HD1      PHE  20  -0.215  -1.368   3.566
  161    HD2  PHE  20           HD2      PHE  20  -2.108  -1.262   7.373
  162    HE1  PHE  20           HE1      PHE  20  -2.395  -1.059   2.469
  163    HE2  PHE  20           HE2      PHE  20  -4.290  -0.951   6.283
  164    HZ   PHE  20           HZ       PHE  20  -4.436  -0.849   3.828
  165    H    ASP  21           H        ASP  21   3.080  -0.866   5.114
  166    HA   ASP  21           HA       ASP  21   2.979   1.550   3.474
  167   1HB   ASP  21          1HB       ASP  21   5.122  -0.545   3.871
  168   2HB   ASP  21          2HB       ASP  21   5.262   0.779   2.722
  169    H    VAL  22           H        VAL  22   1.673   1.323   1.782
  170    HA   VAL  22           HA       VAL  22   1.506  -1.137   0.280
  171    HB   VAL  22           HB       VAL  22   0.430   1.605  -0.428
  172   1HG1  VAL  22          1HG1      VAL  22  -1.078   0.382  -1.933
  173   2HG1  VAL  22          2HG1      VAL  22   0.615   0.150  -2.372
  174   3HG1  VAL  22          3HG1      VAL  22  -0.259  -1.123  -1.520
  175   1HG2  VAL  22          1HG2      VAL  22  -1.728   0.744   0.389
  176   2HG2  VAL  22          2HG2      VAL  22  -0.912  -0.715   0.951
  177   3HG2  VAL  22          3HG2      VAL  22  -0.515   0.847   1.666
  178    H    PHE  23           H        PHE  23   3.315  -1.677  -0.776
  179    HA   PHE  23           HA       PHE  23   4.910   0.378  -2.091
  180   1HB   PHE  23          1HB       PHE  23   5.367  -2.600  -1.818
  181   2HB   PHE  23          2HB       PHE  23   6.492  -1.467  -2.552
  182    HD1  PHE  23           HD1      PHE  23   6.292   0.780  -0.605
  183    HD2  PHE  23           HD2      PHE  23   6.564  -3.422  -0.018
  184    HE1  PHE  23           HE1      PHE  23   7.370   1.157   1.571
  185    HE2  PHE  23           HE2      PHE  23   7.641  -3.054   2.160
  186    HZ   PHE  23           HZ       PHE  23   8.047  -0.762   2.958
  187    H    THR  24           H        THR  24   4.376   0.960  -4.112
  188    HA   THR  24           HA       THR  24   4.212  -1.200  -6.056
  189    HB   THR  24           HB       THR  24   1.849  -0.710  -5.565
  190    HG1  THR  24           HG1      THR  24   1.871  -1.299  -7.614
  191   1HG2  THR  24          1HG2      THR  24   2.481   2.071  -6.566
  192   2HG2  THR  24          2HG2      THR  24   0.872   1.446  -6.202
  193   3HG2  THR  24          3HG2      THR  24   2.057   1.641  -4.910
  194    H    ASP  25           H        ASP  25   5.067  -0.678  -8.034
  195    HA   ASP  25           HA       ASP  25   6.580   1.806  -8.140
  196   1HB   ASP  25          1HB       ASP  25   7.668  -0.334  -8.742
  197   2HB   ASP  25          2HB       ASP  25   6.517  -0.541 -10.057
  198    H    VAL  26           H        VAL  26   3.651   0.537  -9.242
  199    HA   VAL  26           HA       VAL  26   3.332   1.931 -11.682
  200    HB   VAL  26           HB       VAL  26   1.198   1.001  -9.743
  201   1HG1  VAL  26          1HG1      VAL  26   1.011   1.634 -12.685
  202   2HG1  VAL  26          2HG1      VAL  26  -0.288   0.994 -11.680
  203   3HG1  VAL  26          3HG1      VAL  26   0.350   2.610 -11.374
  204   1HG2  VAL  26          1HG2      VAL  26   1.061  -1.002 -11.147
  205   2HG2  VAL  26          2HG2      VAL  26   2.415  -0.415 -12.112
  206   3HG2  VAL  26          3HG2      VAL  26   2.655  -0.830 -10.414
  207    H    ARG  27           H        ARG  27   2.524   3.956 -12.113
  208    HA   ARG  27           HA       ARG  27   2.291   5.737  -9.799
  209   1HB   ARG  27          1HB       ARG  27   3.855   6.451 -11.526
  210   2HB   ARG  27          2HB       ARG  27   2.588   6.366 -12.741
  211   1HG   ARG  27          1HG       ARG  27   1.364   8.140 -11.536
  212   2HG   ARG  27          2HG       ARG  27   2.715   8.264 -10.409
  213   1HD   ARG  27          1HD       ARG  27   4.183   9.003 -12.124
  214   2HD   ARG  27          2HD       ARG  27   3.013   8.606 -13.383
  215    HE   ARG  27           HE       ARG  27   2.368  10.668 -11.394
  216   1HH1  ARG  27          1HH1      ARG  27   3.103   9.768 -14.695
  217   2HH1  ARG  27          2HH1      ARG  27   2.450  11.232 -15.372
  218   1HH2  ARG  27          1HH2      ARG  27   1.550  12.606 -12.258
  219   2HH2  ARG  27          2HH2      ARG  27   1.567  12.854 -13.984
  220    H    ASP  28           H        ASP  28   0.233   5.112  -9.140
  221    HA   ASP  28           HA       ASP  28  -1.845   6.645 -10.365
  222   1HB   ASP  28          1HB       ASP  28  -1.798   4.403 -11.642
  223   2HB   ASP  28          2HB       ASP  28  -2.422   3.694 -10.155
  224    H    ASP  29           H        ASP  29  -2.441   7.635  -8.578
  225    HA   ASP  29           HA       ASP  29  -2.125   6.587  -5.981
  226   1HB   ASP  29          1HB       ASP  29  -3.277   8.600  -5.223
  227   2HB   ASP  29          2HB       ASP  29  -2.111   9.005  -6.476
  228    H    LYS  30           H        LYS  30  -4.894   6.798  -8.136
  229    HA   LYS  30           HA       LYS  30  -6.824   6.009  -6.200
  230   1HB   LYS  30          1HB       LYS  30  -7.302   7.281  -8.312
  231   2HB   LYS  30          2HB       LYS  30  -7.016   5.798  -9.209
  232   1HG   LYS  30          1HG       LYS  30  -8.888   4.731  -8.097
  233   2HG   LYS  30          2HG       LYS  30  -9.154   6.177  -7.120
  234   1HD   LYS  30          1HD       LYS  30  -9.570   7.461  -9.185
  235   2HD   LYS  30          2HD       LYS  30  -9.369   5.982 -10.124
  236   1HE   LYS  30          1HE       LYS  30 -11.468   6.445  -8.008
  237   2HE   LYS  30          2HE       LYS  30 -11.732   6.537  -9.749
  238   1HZ   LYS  30          1HZ       LYS  30 -12.445   4.416  -8.978
  239   2HZ   LYS  30          2HZ       LYS  30 -11.029   4.182  -9.881
  240   3HZ   LYS  30          3HZ       LYS  30 -10.973   4.126  -8.187
  241    H    LYS  31           H        LYS  31  -4.786   4.321  -8.496
  242    HA   LYS  31           HA       LYS  31  -6.048   1.787  -8.294
  243   1HB   LYS  31          1HB       LYS  31  -4.293   2.729 -10.007
  244   2HB   LYS  31          2HB       LYS  31  -3.126   2.077  -8.868
  245   1HG   LYS  31          1HG       LYS  31  -4.012  -0.136  -9.137
  246   2HG   LYS  31          2HG       LYS  31  -5.331   0.473 -10.140
  247   1HD   LYS  31          1HD       LYS  31  -3.527   1.359 -11.700
  248   2HD   LYS  31          2HD       LYS  31  -2.397   0.361 -10.785
  249   1HE   LYS  31          1HE       LYS  31  -3.612  -1.634 -11.360
  250   2HE   LYS  31          2HE       LYS  31  -4.880  -0.685 -12.133
  251   1HZ   LYS  31          1HZ       LYS  31  -3.482  -1.535 -13.826
  252   2HZ   LYS  31          2HZ       LYS  31  -3.142   0.124 -13.704
  253   3HZ   LYS  31          3HZ       LYS  31  -2.075  -1.019 -13.040
  254    H    ALA  32           H        ALA  32  -3.367   3.320  -6.563
  255    HA   ALA  32           HA       ALA  32  -2.655   1.125  -4.948
  256   1HB   ALA  32          1HB       ALA  32  -1.633   2.783  -3.464
  257   2HB   ALA  32          2HB       ALA  32  -1.253   3.117  -5.154
  258   3HB   ALA  32          3HB       ALA  32  -2.478   4.072  -4.320
  259    H    ILE  33           H        ILE  33  -4.933   3.784  -4.453
  260    HA   ILE  33           HA       ILE  33  -5.963   3.044  -1.965
  261    HB   ILE  33           HB       ILE  33  -7.287   4.424  -4.304
  262   1HG1  ILE  33          1HG1      ILE  33  -6.159   5.515  -1.717
  263   2HG1  ILE  33          2HG1      ILE  33  -5.343   5.568  -3.276
  264   1HG2  ILE  33          1HG2      ILE  33  -8.289   4.206  -1.470
  265   2HG2  ILE  33          2HG2      ILE  33  -9.010   5.177  -2.753
  266   3HG2  ILE  33          3HG2      ILE  33  -8.996   3.417  -2.880
  267   1HD1  ILE  33          1HD1      ILE  33  -7.125   6.981  -4.158
  268   2HD1  ILE  33          2HD1      ILE  33  -7.943   6.923  -2.596
  269   3HD1  ILE  33          3HD1      ILE  33  -6.366   7.700  -2.738
  270    H    GLU  34           H        GLU  34  -6.897   2.083  -5.233
  271    HA   GLU  34           HA       GLU  34  -9.085   0.470  -4.672
  272   1HB   GLU  34          1HB       GLU  34  -8.269   1.136  -6.943
  273   2HB   GLU  34          2HB       GLU  34  -6.971  -0.037  -6.778
  274   1HG   GLU  34          1HG       GLU  34  -8.712  -0.976  -8.119
  275   2HG   GLU  34          2HG       GLU  34  -8.659  -1.824  -6.573
  276    H    PHE  35           H        PHE  35  -5.640  -0.413  -4.828
  277    HA   PHE  35           HA       PHE  35  -5.983  -3.146  -4.250
  278   1HB   PHE  35          1HB       PHE  35  -3.595  -1.361  -3.749
  279   2HB   PHE  35          2HB       PHE  35  -3.569  -3.117  -3.651
  280    HD1  PHE  35           HD1      PHE  35  -2.153  -0.901  -5.506
  281    HD2  PHE  35           HD2      PHE  35  -5.222  -3.802  -6.021
  282    HE1  PHE  35           HE1      PHE  35  -1.637  -1.015  -7.908
  283    HE2  PHE  35           HE2      PHE  35  -4.712  -3.923  -8.423
  284    HZ   PHE  35           HZ       PHE  35  -2.916  -2.529  -9.370
  285    H    ALA  36           H        ALA  36  -5.329  -0.381  -2.131
  286    HA   ALA  36           HA       ALA  36  -4.907  -1.768   0.247
  287   1HB   ALA  36          1HB       ALA  36  -4.436   0.613  -0.034
  288   2HB   ALA  36          2HB       ALA  36  -6.167   0.948  -0.094
  289   3HB   ALA  36          3HB       ALA  36  -5.441   0.316   1.384
  290    H    LYS  37           H        LYS  37  -7.946  -0.631  -1.188
  291    HA   LYS  37           HA       LYS  37  -9.609  -1.354   0.978
  292   1HB   LYS  37          1HB       LYS  37 -10.299  -1.152  -1.959
  293   2HB   LYS  37          2HB       LYS  37 -11.462  -1.226  -0.643
  294   1HG   LYS  37          1HG       LYS  37 -10.536   0.879   0.245
  295   2HG   LYS  37          2HG       LYS  37  -9.464   0.962  -1.150
  296   1HD   LYS  37          1HD       LYS  37 -12.474   0.875  -1.331
  297   2HD   LYS  37          2HD       LYS  37 -11.528   2.362  -1.340
  298   1HE   LYS  37          1HE       LYS  37 -11.962   1.888  -3.601
  299   2HE   LYS  37          2HE       LYS  37 -10.294   1.387  -3.334
  300   1HZ   LYS  37          1HZ       LYS  37 -11.470  -0.262  -4.618
  301   2HZ   LYS  37          2HZ       LYS  37 -11.084  -0.900  -3.103
  302   3HZ   LYS  37          3HZ       LYS  37 -12.670  -0.401  -3.423
  303    H    GLN  38           H        GLN  38  -8.324  -3.157  -1.724
  304    HA   GLN  38           HA       GLN  38 -10.080  -5.388  -1.447
  305   1HB   GLN  38          1HB       GLN  38  -7.391  -5.199  -2.818
  306   2HB   GLN  38          2HB       GLN  38  -8.533  -6.527  -2.990
  307   1HG   GLN  38          1HG       GLN  38 -10.179  -4.948  -3.927
  308   2HG   GLN  38          2HG       GLN  38  -8.974  -3.668  -3.823
  309   1HE2  GLN  38          2HE2      GLN  38  -7.228  -3.680  -5.236
  310   2HE2  GLN  38          1HE2      GLN  38  -7.209  -4.645  -6.667
  311    H    TRP  39           H        TRP  39  -7.013  -4.467  -0.050
  312    HA   TRP  39           HA       TRP  39  -6.481  -7.053   1.072
  313   1HB   TRP  39          1HB       TRP  39  -4.699  -5.363   0.593
  314   2HB   TRP  39          2HB       TRP  39  -5.335  -4.380   1.908
  315    HD1  TRP  39           HD1      TRP  39  -3.847  -7.926   1.401
  316    HE1  TRP  39           HE1      TRP  39  -2.557  -8.562   3.534
  317    HE3  TRP  39           HE3      TRP  39  -4.906  -3.814   4.247
  318    HZ2  TRP  39           HZ2      TRP  39  -2.045  -7.460   6.086
  319    HZ3  TRP  39           HZ3      TRP  39  -3.976  -3.681   6.520
  320    HH2  TRP  39           HH2      TRP  39  -2.576  -5.467   7.420
  321    H    LEU  40           H        LEU  40  -7.852  -4.012   2.259
  322    HA   LEU  40           HA       LEU  40  -8.119  -4.776   4.953
  323   1HB   LEU  40          1HB       LEU  40  -9.682  -2.769   3.337
  324   2HB   LEU  40          2HB       LEU  40  -9.792  -2.930   5.079
  325    HG   LEU  40           HG       LEU  40  -7.321  -2.150   3.530
  326   1HD1  LEU  40          1HD1      LEU  40  -9.026  -0.408   3.599
  327   2HD1  LEU  40          2HD1      LEU  40  -9.114  -0.559   5.354
  328   3HD1  LEU  40          3HD1      LEU  40  -7.633   0.020   4.591
  329   1HD2  LEU  40          1HD2      LEU  40  -7.770  -2.361   6.507
  330   2HD2  LEU  40          2HD2      LEU  40  -6.781  -3.452   5.534
  331   3HD2  LEU  40          3HD2      LEU  40  -6.312  -1.761   5.715
  332    H    SER  41           H        SER  41 -10.218  -5.261   2.182
  333    HA   SER  41           HA       SER  41 -12.431  -6.212   3.716
  334   1HB   SER  41          1HB       SER  41 -13.145  -7.121   1.408
  335   2HB   SER  41          2HB       SER  41 -13.007  -5.372   1.599
  336    HG   SER  41           HG       SER  41 -11.407  -5.346   0.232
  337    H    SER  42           H        SER  42  -9.575  -7.638   2.341
  338    HA   SER  42           HA       SER  42 -10.471 -10.343   2.524
  339   1HB   SER  42          1HB       SER  42  -7.679  -9.207   2.231
  340   2HB   SER  42          2HB       SER  42  -8.109 -10.908   2.043
  341    HG   SER  42           HG       SER  42  -8.612  -8.732   0.359
  342    H    ILE  43           H        ILE  43  -8.628  -8.176   4.630
  343    HA   ILE  43           HA       ILE  43  -8.034 -10.290   6.502
  344    HB   ILE  43           HB       ILE  43  -7.125  -8.533   7.955
  345   1HG1  ILE  43          1HG1      ILE  43  -7.999  -6.631   5.770
  346   2HG1  ILE  43          2HG1      ILE  43  -8.713  -6.740   7.376
  347   1HG2  ILE  43          1HG2      ILE  43  -5.700  -9.537   6.277
  348   2HG2  ILE  43          2HG2      ILE  43  -6.238  -8.357   5.082
  349   3HG2  ILE  43          3HG2      ILE  43  -5.295  -7.832   6.477
  350   1HD1  ILE  43          1HD1      ILE  43  -6.610  -6.037   8.370
  351   2HD1  ILE  43          2HD1      ILE  43  -5.875  -5.953   6.768
  352   3HD1  ILE  43          3HD1      ILE  43  -7.187  -4.855   7.194
  353    H    GLY  44           H        GLY  44 -10.654  -8.169   5.949
  354   1HA   GLY  44          1HA       GLY  44 -12.778  -8.620   6.882
  355   2HA   GLY  44          2HA       GLY  44 -11.987  -9.345   8.271
  356    H    GLU  45           H        GLU  45 -11.125  -6.177   6.987
  357    HA   GLU  45           HA       GLU  45 -12.141  -5.010   9.477
  358   1HB   GLU  45          1HB       GLU  45 -10.119  -3.990   7.488
  359   2HB   GLU  45          2HB       GLU  45 -10.772  -2.994   8.783
  360   1HG   GLU  45          1HG       GLU  45  -9.070  -5.452   9.004
  361   2HG   GLU  45          2HG       GLU  45  -8.719  -3.818   9.570
  362    H    GLU  46           H        GLU  46 -11.676  -3.487   6.332
  363    HA   GLU  46           HA       GLU  46 -13.053  -2.369   4.915
  364   1HB   GLU  46          1HB       GLU  46 -15.256  -3.913   6.285
  365   2HB   GLU  46          2HB       GLU  46 -15.411  -3.028   4.774
  366   1HG   GLU  46          1HG       GLU  46 -13.937  -4.530   3.659
  367   2HG   GLU  46          2HG       GLU  46 -13.518  -5.327   5.177
  368    H    GLY  47           H        GLY  47 -12.974  -1.803   8.123
  369   1HA   GLY  47          1HA       GLY  47 -15.161   0.128   8.210
  370   2HA   GLY  47          2HA       GLY  47 -14.162  -0.372   9.566
  371    H    ALA  48           H        ALA  48 -13.329   0.904   6.384
  372    HA   ALA  48           HA       ALA  48 -12.313   3.359   7.532
  373   1HB   ALA  48          1HB       ALA  48 -10.459   1.416   6.151
  374   2HB   ALA  48          2HB       ALA  48 -10.046   3.053   6.665
  375   3HB   ALA  48          3HB       ALA  48 -10.440   1.824   7.867
  376    H    THR  49           H        THR  49 -12.700   4.969   6.139
  377    HA   THR  49           HA       THR  49 -13.535   4.360   3.446
  378    HB   THR  49           HB       THR  49 -13.061   7.090   4.667
  379    HG1  THR  49           HG1      THR  49 -15.296   5.330   4.787
  380   1HG2  THR  49          1HG2      THR  49 -14.809   6.184   2.372
  381   2HG2  THR  49          2HG2      THR  49 -14.690   7.832   2.988
  382   3HG2  THR  49          3HG2      THR  49 -13.293   7.070   2.226
  383    H    VAL  50           H        VAL  50 -11.720   3.502   2.476
  384    HA   VAL  50           HA       VAL  50  -9.143   4.662   2.721
  385    HB   VAL  50           HB       VAL  50 -10.017   2.762   0.549
  386   1HG1  VAL  50          1HG1      VAL  50  -7.339   3.246   1.858
  387   2HG1  VAL  50          2HG1      VAL  50  -7.671   2.063   0.592
  388   3HG1  VAL  50          3HG1      VAL  50  -7.818   3.788   0.248
  389   1HG2  VAL  50          1HG2      VAL  50 -10.703   1.851   2.696
  390   2HG2  VAL  50          2HG2      VAL  50  -9.334   0.946   2.050
  391   3HG2  VAL  50          3HG2      VAL  50  -9.083   2.117   3.344
  392    H    THR  51           H        THR  51  -9.028   6.693   2.074
  393    HA   THR  51           HA       THR  51  -9.234   7.190  -0.800
  394    HB   THR  51           HB       THR  51 -10.092   9.524  -0.219
  395    HG1  THR  51           HG1      THR  51 -10.815   8.202   2.212
  396   1HG2  THR  51          1HG2      THR  51 -11.525   7.824  -1.264
  397   2HG2  THR  51          2HG2      THR  51 -11.941   7.197   0.331
  398   3HG2  THR  51          3HG2      THR  51 -12.436   8.825  -0.133
  399    H    SER  52           H        SER  52  -8.392   9.790  -0.836
  400    HA   SER  52           HA       SER  52  -5.629   9.584  -0.270
  401   1HB   SER  52          1HB       SER  52  -7.187  12.111  -0.853
  402   2HB   SER  52          2HB       SER  52  -5.471  11.822  -1.145
  403    HG   SER  52           HG       SER  52  -5.970  10.939  -2.981
  404    H    GLU  53           H        GLU  53  -8.083  10.015   1.863
  405    HA   GLU  53           HA       GLU  53  -6.852  11.938   3.605
  406   1HB   GLU  53          1HB       GLU  53  -9.135  10.012   4.074
  407   2HB   GLU  53          2HB       GLU  53  -8.676  11.333   5.129
  408   1HG   GLU  53          1HG       GLU  53  -9.728  11.570   2.328
  409   2HG   GLU  53          2HG       GLU  53 -10.590  11.958   3.817
  410    H    GLU  54           H        GLU  54  -7.436   8.431   3.658
  411    HA   GLU  54           HA       GLU  54  -5.629   8.146   5.930
  412   1HB   GLU  54          1HB       GLU  54  -7.259   6.017   4.533
  413   2HB   GLU  54          2HB       GLU  54  -6.441   5.869   6.081
  414   1HG   GLU  54          1HG       GLU  54  -7.941   7.678   6.945
  415   2HG   GLU  54          2HG       GLU  54  -8.835   7.561   5.429
  416    H    CYS  55           H        CYS  55  -5.863   7.427   2.524
  417    HA   CYS  55           HA       CYS  55  -3.277   6.039   2.613
  418   1HB   CYS  55          1HB       CYS  55  -5.276   4.929   1.518
  419   2HB   CYS  55          2HB       CYS  55  -5.209   6.192   0.293
  420    HG   CYS  55           HG       CYS  55  -3.067   3.612   0.815
  421    H    ARG  56           H        ARG  56  -1.658   7.449   2.401
  422    HA   ARG  56           HA       ARG  56  -1.848   9.488   0.287
  423   1HB   ARG  56          1HB       ARG  56  -0.788   9.833   3.095
  424   2HB   ARG  56          2HB       ARG  56  -0.473  10.975   1.796
  425   1HG   ARG  56          1HG       ARG  56  -2.838  11.445   1.595
  426   2HG   ARG  56          2HG       ARG  56  -3.202  10.236   2.829
  427   1HD   ARG  56          1HD       ARG  56  -2.047  11.503   4.499
  428   2HD   ARG  56          2HD       ARG  56  -1.443  12.636   3.293
  429    HE   ARG  56           HE       ARG  56  -4.087  12.920   3.012
  430   1HH1  ARG  56          1HH1      ARG  56  -2.112  12.778   5.886
  431   2HH1  ARG  56          2HH1      ARG  56  -3.083  13.904   6.784
  432   1HH2  ARG  56          1HH2      ARG  56  -5.367  14.426   4.154
  433   2HH2  ARG  56          2HH2      ARG  56  -4.921  14.882   5.781
  434    H    PHE  57           H        PHE  57   0.292  10.297  -0.414
  435    HA   PHE  57           HA       PHE  57   2.222   8.134  -0.553
  436   1HB   PHE  57          1HB       PHE  57   1.689   9.498  -2.568
  437   2HB   PHE  57          2HB       PHE  57   2.346  10.914  -1.755
  438    HD1  PHE  57           HD1      PHE  57   3.198   7.589  -3.115
  439    HD2  PHE  57           HD2      PHE  57   4.669  11.336  -1.727
  440    HE1  PHE  57           HE1      PHE  57   5.434   7.028  -3.971
  441    HE2  PHE  57           HE2      PHE  57   6.908  10.778  -2.581
  442    HZ   PHE  57           HZ       PHE  57   7.290   8.621  -3.707
  443    H    CYS  58           H        CYS  58   3.297   7.906   1.312
  444    HA   CYS  58           HA       CYS  58   3.932  10.233   2.909
  445   1HB   CYS  58          1HB       CYS  58   4.367   7.291   3.441
  446   2HB   CYS  58          2HB       CYS  58   4.651   8.587   4.602
  447    HG   CYS  58           HG       CYS  58   2.267   7.368   5.323
  448    H    HIS  59           H        HIS  59   5.744   7.676   1.195
  449    HA   HIS  59           HA       HIS  59   8.014   9.449   1.094
  450   1HB   HIS  59          1HB       HIS  59   9.623   7.870   2.093
  451   2HB   HIS  59          2HB       HIS  59   8.463   8.480   3.249
  452    HD1  HIS  59           HD1      HIS  59  10.192   5.536   2.681
  453    HD2  HIS  59           HD2      HIS  59   6.142   6.316   3.230
  454    HE1  HIS  59           HE1      HIS  59   9.180   3.382   3.482
  455    HE2  HIS  59           HE2      HIS  59   6.757   3.896   3.930
  456    H    SER  60           H        SER  60   9.795   8.628  -0.080
  457    HA   SER  60           HA       SER  60   9.088   6.563  -2.057
  458   1HB   SER  60          1HB       SER  60  11.274   8.653  -2.280
  459   2HB   SER  60          2HB       SER  60  10.652   7.617  -3.562
  460    HG   SER  60           HG       SER  60   8.550   8.775  -2.940
  461    H    GLU  61           H        GLU  61  10.161   4.657  -1.780
  462    HA   GLU  61           HA       GLU  61  12.419   4.765   0.105
  463   1HB   GLU  61          1HB       GLU  61  10.137   3.844   0.899
  464   2HB   GLU  61          2HB       GLU  61  10.517   2.445  -0.103
  465   1HG   GLU  61          1HG       GLU  61  11.116   2.090   2.234
  466   2HG   GLU  61          2HG       GLU  61  12.528   2.034   1.179
  467    H    LYS  62           H        LYS  62  14.139   3.364  -0.219
  468    HA   LYS  62           HA       LYS  62  14.518   2.447  -2.915
  469   1HB   LYS  62          1HB       LYS  62  16.376   3.402  -1.590
  470   2HB   LYS  62          2HB       LYS  62  16.262   2.047  -0.476
  471   1HG   LYS  62          1HG       LYS  62  18.083   1.649  -1.959
  472   2HG   LYS  62          2HG       LYS  62  16.787   0.526  -2.371
  473   1HD   LYS  62          1HD       LYS  62  17.760   1.440  -4.392
  474   2HD   LYS  62          2HD       LYS  62  16.108   2.028  -4.208
  475   1HE   LYS  62          1HE       LYS  62  16.907   4.147  -3.382
  476   2HE   LYS  62          2HE       LYS  62  18.569   3.562  -3.390
  477   1HZ   LYS  62          1HZ       LYS  62  16.851   3.930  -5.785
  478   2HZ   LYS  62          2HZ       LYS  62  18.127   4.942  -5.309
  479   3HZ   LYS  62          3HZ       LYS  62  18.444   3.351  -5.794
  480    H    ALA  63           H        ALA  63  13.426   0.720  -3.517
  481    HA   ALA  63           HA       ALA  63  12.482  -1.234  -1.683
  482   1HB   ALA  63          1HB       ALA  63  11.222  -0.553  -3.658
  483   2HB   ALA  63          2HB       ALA  63  12.466  -1.257  -4.692
  484   3HB   ALA  63          3HB       ALA  63  11.508  -2.294  -3.634
  485    HA   PRO  64           HA       PRO  64  16.028  -3.993  -1.990
  486   1HB   PRO  64          1HB       PRO  64  14.986  -5.899  -0.354
  487   2HB   PRO  64          2HB       PRO  64  15.761  -4.431   0.252
  488   1HG   PRO  64          1HG       PRO  64  12.852  -5.048  -0.062
  489   2HG   PRO  64          2HG       PRO  64  13.686  -4.229   1.270
  490   1HD   PRO  64          1HD       PRO  64  12.317  -2.892  -0.653
  491   2HD   PRO  64          2HD       PRO  64  13.740  -2.213   0.162
  492    H    ASP  65           H        ASP  65  16.314  -6.169  -2.790
  493    HA   ASP  65           HA       ASP  65  14.916  -6.627  -5.148
  494   1HB   ASP  65          1HB       ASP  65  17.195  -7.449  -4.672
  495   2HB   ASP  65          2HB       ASP  65  16.525  -8.628  -3.549
  496    H    GLU  66           H        GLU  66  14.383  -7.924  -1.944
  497    HA   GLU  66           HA       GLU  66  12.717 -10.071  -2.478
  498   1HB   GLU  66          1HB       GLU  66  13.574  -9.597  -0.260
  499   2HB   GLU  66          2HB       GLU  66  12.636  -8.112  -0.182
  500   1HG   GLU  66          1HG       GLU  66  10.569  -9.419  -0.239
  501   2HG   GLU  66          2HG       GLU  66  11.515 -10.905  -0.304
  502    H    VAL  67           H        VAL  67  11.744  -6.685  -1.873
  503    HA   VAL  67           HA       VAL  67   8.982  -7.311  -2.305
  504    HB   VAL  67           HB       VAL  67   8.520  -4.950  -2.052
  505   1HG1  VAL  67          1HG1      VAL  67  10.594  -5.896  -0.083
  506   2HG1  VAL  67          2HG1      VAL  67   9.425  -4.605   0.191
  507   3HG1  VAL  67          3HG1      VAL  67   8.869  -6.263  -0.038
  508   1HG2  VAL  67          1HG2      VAL  67  11.507  -4.553  -2.071
  509   2HG2  VAL  67          2HG2      VAL  67  10.374  -4.019  -3.313
  510   3HG2  VAL  67          3HG2      VAL  67  10.309  -3.315  -1.697
  511    H    ILE  68           H        ILE  68  11.616  -6.259  -4.302
  512    HA   ILE  68           HA       ILE  68  10.240  -5.173  -6.478
  513    HB   ILE  68           HB       ILE  68  12.726  -6.901  -6.548
  514   1HG1  ILE  68          1HG1      ILE  68  13.021  -4.948  -5.112
  515   2HG1  ILE  68          2HG1      ILE  68  13.944  -4.753  -6.598
  516   1HG2  ILE  68          1HG2      ILE  68  11.651  -4.966  -8.596
  517   2HG2  ILE  68          2HG2      ILE  68  13.194  -5.813  -8.690
  518   3HG2  ILE  68          3HG2      ILE  68  11.683  -6.723  -8.741
  519   1HD1  ILE  68          1HD1      ILE  68  12.202  -3.287  -7.480
  520   2HD1  ILE  68          2HD1      ILE  68  11.287  -3.480  -5.984
  521   3HD1  ILE  68          3HD1      ILE  68  12.860  -2.682  -5.961
  522    H    GLU  69           H        GLU  69  11.107  -8.523  -5.752
  523    HA   GLU  69           HA       GLU  69   9.950  -9.751  -7.980
  524   1HB   GLU  69          1HB       GLU  69  11.466 -10.900  -6.433
  525   2HB   GLU  69          2HB       GLU  69  10.259 -10.800  -5.160
  526   1HG   GLU  69          1HG       GLU  69   8.753 -12.193  -6.558
  527   2HG   GLU  69          2HG       GLU  69  10.076 -12.380  -7.709
  528    H    ALA  70           H        ALA  70   8.596  -9.062  -4.779
  529    HA   ALA  70           HA       ALA  70   6.121 -10.328  -5.168
  530   1HB   ALA  70          1HB       ALA  70   6.796  -8.046  -3.318
  531   2HB   ALA  70          2HB       ALA  70   5.382  -9.094  -3.200
  532   3HB   ALA  70          3HB       ALA  70   6.998  -9.761  -2.965
  533    H    ILE  71           H        ILE  71   7.064  -6.923  -5.581
  534    HA   ILE  71           HA       ILE  71   4.456  -6.025  -6.274
  535    HB   ILE  71           HB       ILE  71   7.133  -4.758  -6.879
  536   1HG1  ILE  71          1HG1      ILE  71   5.176  -4.190  -4.642
  537   2HG1  ILE  71          2HG1      ILE  71   6.638  -5.157  -4.462
  538   1HG2  ILE  71          1HG2      ILE  71   5.871  -2.673  -7.131
  539   2HG2  ILE  71          2HG2      ILE  71   5.370  -3.878  -8.318
  540   3HG2  ILE  71          3HG2      ILE  71   4.363  -3.560  -6.906
  541   1HD1  ILE  71          1HD1      ILE  71   6.984  -2.908  -3.649
  542   2HD1  ILE  71          2HD1      ILE  71   7.984  -3.209  -5.070
  543   3HD1  ILE  71          3HD1      ILE  71   6.513  -2.249  -5.216
  544    H    LYS  72           H        LYS  72   7.246  -7.078  -8.174
  545    HA   LYS  72           HA       LYS  72   6.186  -6.452 -10.710
  546   1HB   LYS  72          1HB       LYS  72   8.540  -6.901 -10.412
  547   2HB   LYS  72          2HB       LYS  72   8.202  -8.527  -9.838
  548   1HG   LYS  72          1HG       LYS  72   7.364  -9.132 -12.054
  549   2HG   LYS  72          2HG       LYS  72   7.712  -7.499 -12.626
  550   1HD   LYS  72          1HD       LYS  72   9.470  -9.146 -13.220
  551   2HD   LYS  72          2HD       LYS  72  10.066  -7.808 -12.235
  552   1HE   LYS  72          1HE       LYS  72   9.948  -9.211 -10.243
  553   2HE   LYS  72          2HE       LYS  72   9.319 -10.546 -11.207
  554   1HZ   LYS  72          1HZ       LYS  72  11.368 -10.684 -12.389
  555   2HZ   LYS  72          2HZ       LYS  72  11.965  -9.277 -11.650
  556   3HZ   LYS  72          3HZ       LYS  72  11.728 -10.682 -10.732
  557    H    GLN  73           H        GLN  73   5.709  -9.134  -8.550
  558    HA   GLN  73           HA       GLN  73   4.462 -10.825 -10.524
  559   1HB   GLN  73          1HB       GLN  73   5.741 -11.825  -8.725
  560   2HB   GLN  73          2HB       GLN  73   4.713 -11.057  -7.525
  561   1HG   GLN  73          1HG       GLN  73   2.806 -12.381  -8.367
  562   2HG   GLN  73          2HG       GLN  73   3.909 -13.204  -9.471
  563   1HE2  GLN  73          2HE2      GLN  73   5.426 -14.632  -8.642
  564   2HE2  GLN  73          1HE2      GLN  73   5.314 -15.282  -7.043
  565    H    ASN  74           H        ASN  74   3.355  -8.959  -7.699
  566    HA   ASN  74           HA       ASN  74   0.604  -9.771  -8.272
  567   1HB   ASN  74          1HB       ASN  74   1.805  -8.344  -5.894
  568   2HB   ASN  74          2HB       ASN  74   0.100  -8.751  -6.053
  569   1HD2  ASN  74          2HD2      ASN  74   3.305  -9.973  -5.537
  570   2HD2  ASN  74          1HD2      ASN  74   2.839 -11.561  -5.030
  571    H    GLY  75           H        GLY  75   2.660  -6.991  -8.457
  572   1HA   GLY  75          1HA       GLY  75   2.029  -5.052  -9.722
  573   2HA   GLY  75          2HA       GLY  75   0.352  -5.351  -9.273
  574    H    TYR  76           H        TYR  76   1.277  -5.967  -6.493
  575    HA   TYR  76           HA       TYR  76   2.288  -3.471  -5.468
  576   1HB   TYR  76          1HB       TYR  76   0.350  -2.919  -4.119
  577   2HB   TYR  76          2HB       TYR  76  -0.137  -2.995  -5.807
  578    HD1  TYR  76           HD1      TYR  76  -0.794  -4.156  -2.502
  579    HD2  TYR  76           HD2      TYR  76  -1.268  -5.177  -6.605
  580    HE1  TYR  76           HE1      TYR  76  -2.586  -5.728  -1.897
  581    HE2  TYR  76           HE2      TYR  76  -3.062  -6.752  -6.010
  582    HH   TYR  76           HH       TYR  76  -3.806  -8.041  -4.054
  583    H    PHE  77           H        PHE  77   2.768  -3.603  -3.193
  584    HA   PHE  77           HA       PHE  77   2.493  -6.285  -2.026
  585   1HB   PHE  77          1HB       PHE  77   4.792  -6.055  -2.884
  586   2HB   PHE  77          2HB       PHE  77   4.998  -4.584  -1.939
  587    HD1  PHE  77           HD1      PHE  77   4.113  -8.177  -1.510
  588    HD2  PHE  77           HD2      PHE  77   5.973  -4.723   0.138
  589    HE1  PHE  77           HE1      PHE  77   4.916  -9.519   0.389
  590    HE2  PHE  77           HE2      PHE  77   6.777  -6.059   2.039
  591    HZ   PHE  77           HZ       PHE  77   6.249  -8.461   2.166
  592    H    ILE  78           H        ILE  78   1.400  -6.140  -0.196
  593    HA   ILE  78           HA       ILE  78   1.274  -3.609   1.234
  594    HB   ILE  78           HB       ILE  78  -0.168  -6.207   1.800
  595   1HG1  ILE  78          1HG1      ILE  78  -0.849  -5.243  -0.344
  596   2HG1  ILE  78          2HG1      ILE  78  -2.141  -5.088   0.842
  597   1HG2  ILE  78          1HG2      ILE  78  -1.608  -4.836   3.243
  598   2HG2  ILE  78          2HG2      ILE  78   0.068  -4.849   3.793
  599   3HG2  ILE  78          3HG2      ILE  78  -0.568  -3.444   2.937
  600   1HD1  ILE  78          1HD1      ILE  78  -0.239  -2.907   0.016
  601   2HD1  ILE  78          2HD1      ILE  78  -1.913  -3.083  -0.511
  602   3HD1  ILE  78          3HD1      ILE  78  -1.553  -2.751   1.182
  603    H    TYR  79           H        TYR  79   2.937  -3.240   2.554
  604    HA   TYR  79           HA       TYR  79   4.003  -5.490   4.112
  605   1HB   TYR  79          1HB       TYR  79   5.658  -4.277   2.784
  606   2HB   TYR  79          2HB       TYR  79   5.184  -2.764   3.547
  607    HD1  TYR  79           HD1      TYR  79   6.556  -1.982   5.224
  608    HD2  TYR  79           HD2      TYR  79   6.307  -6.180   4.575
  609    HE1  TYR  79           HE1      TYR  79   8.223  -2.353   6.993
  610    HE2  TYR  79           HE2      TYR  79   7.974  -6.557   6.339
  611    HH   TYR  79           HH       TYR  79   9.049  -3.990   8.423
  612    H    LYS  80           H        LYS  80   3.144  -5.684   6.072
  613    HA   LYS  80           HA       LYS  80   1.967  -3.416   7.383
  614   1HB   LYS  80          1HB       LYS  80   2.059  -5.340   9.333
  615   2HB   LYS  80          2HB       LYS  80   0.717  -5.048   8.244
  616   1HG   LYS  80          1HG       LYS  80   2.917  -6.964   7.560
  617   2HG   LYS  80          2HG       LYS  80   1.523  -7.441   8.530
  618   1HD   LYS  80          1HD       LYS  80   0.108  -6.471   6.625
  619   2HD   LYS  80          2HD       LYS  80   1.595  -6.508   5.677
  620   1HE   LYS  80          1HE       LYS  80   0.187  -8.826   6.966
  621   2HE   LYS  80          2HE       LYS  80   0.358  -8.502   5.244
  622   1HZ   LYS  80          1HZ       LYS  80   2.465  -9.325   7.163
  623   2HZ   LYS  80          2HZ       LYS  80   1.938 -10.150   5.778
  624   3HZ   LYS  80          3HZ       LYS  80   2.827  -8.709   5.620
  625    H    MET  81           H        MET  81   3.272  -1.934   8.217
  626    HA   MET  81           HA       MET  81   5.929  -2.315   8.981
  627   1HB   MET  81          1HB       MET  81   4.906  -0.104   8.496
  628   2HB   MET  81          2HB       MET  81   4.013  -0.213  10.007
  629   1HG   MET  81          1HG       MET  81   6.128  -0.259  11.243
  630   2HG   MET  81          2HG       MET  81   7.007  -0.110   9.721
  631   1HE   MET  81          1HE       MET  81   4.944   1.879   8.183
  632   2HE   MET  81          2HE       MET  81   6.701   2.022   8.077
  633   3HE   MET  81          3HE       MET  81   5.725   3.429   8.498
  634    H    GLU  82           H        GLU  82   2.978  -2.182  10.918
  635    HA   GLU  82           HA       GLU  82   3.947  -4.157  12.724
  636   1HB   GLU  82          1HB       GLU  82   4.877  -1.742  13.430
  637   2HB   GLU  82          2HB       GLU  82   3.282  -1.634  14.165
  638   1HG   GLU  82          1HG       GLU  82   3.708  -3.674  15.420
  639   2HG   GLU  82          2HG       GLU  82   5.295  -3.813  14.667
  640    H    GLY  83           H        GLY  83   2.178  -3.859  14.799
  641   1HA   GLY  83          1HA       GLY  83  -0.101  -3.786  15.345
  642   2HA   GLY  83          2HA       GLY  83  -0.458  -3.320  13.686
  643    H    CYS  84           H        CYS  84   0.576  -5.246  12.186
  644    HA   CYS  84           HA       CYS  84  -0.319  -7.820  13.268
  645   1HB   CYS  84          1HB       CYS  84  -1.037  -6.701  10.547
  646   2HB   CYS  84          2HB       CYS  84  -1.332  -8.359  11.057
  647    HG   CYS  84           HG       CYS  84  -2.616  -6.278  13.263
  648    H    ASN  85           H        ASN  85   0.468  -9.635  11.717
  649    HA   ASN  85           HA       ASN  85   3.250  -8.971  11.019
  650   1HB   ASN  85          1HB       ASN  85   2.084 -11.518  12.151
  651   2HB   ASN  85          2HB       ASN  85   3.727 -11.390  11.532
  652   1HD2  ASN  85          2HD2      ASN  85   2.740 -12.014  14.205
  653   2HD2  ASN  85          1HD2      ASN  85   3.474 -10.857  15.259
  Start of MODEL   15
    1    H    MET   1           H        MET   1  14.326  -0.708 -10.032
    2    HA   MET   1           HA       MET   1  12.422   0.823 -10.281
    3   1HB   MET   1          1HB       MET   1  12.215  -1.683  -9.972
    4   2HB   MET   1          2HB       MET   1  11.913  -1.374  -8.266
    5   1HG   MET   1          1HG       MET   1   9.967   0.015  -8.917
    6   2HG   MET   1          2HG       MET   1  10.238  -0.458 -10.592
    7   1HE   MET   1          1HE       MET   1   8.794  -3.212  -7.195
    8   2HE   MET   1          2HE       MET   1   8.918  -1.455  -7.102
    9   3HE   MET   1          3HE       MET   1  10.380  -2.440  -7.158
   10    H    GLN   2           H        GLN   2  11.364   2.513  -9.434
   11    HA   GLN   2           HA       GLN   2  11.918   3.249  -6.676
   12   1HB   GLN   2          1HB       GLN   2  10.479   4.664  -8.918
   13   2HB   GLN   2          2HB       GLN   2  10.601   5.318  -7.291
   14   1HG   GLN   2          1HG       GLN   2  13.039   5.315  -7.479
   15   2HG   GLN   2          2HG       GLN   2  12.905   4.683  -9.120
   16   1HE2  GLN   2          2HE2      GLN   2  12.401   7.437  -7.051
   17   2HE2  GLN   2          1HE2      GLN   2  12.218   8.601  -8.323
   18    H    ILE   3           H        ILE   3  10.682   2.561  -5.092
   19    HA   ILE   3           HA       ILE   3   7.964   1.682  -5.640
   20    HB   ILE   3           HB       ILE   3   8.048   1.201  -3.081
   21   1HG1  ILE   3          1HG1      ILE   3  10.989   1.398  -3.769
   22   2HG1  ILE   3          2HG1      ILE   3  10.119   2.392  -2.605
   23   1HG2  ILE   3          1HG2      ILE   3   9.161  -0.989  -3.591
   24   2HG2  ILE   3          2HG2      ILE   3   7.831  -0.536  -4.659
   25   3HG2  ILE   3          3HG2      ILE   3   9.497  -0.348  -5.199
   26   1HD1  ILE   3          1HD1      ILE   3  10.645  -0.562  -2.406
   27   2HD1  ILE   3          2HD1      ILE   3  11.419   0.718  -1.470
   28   3HD1  ILE   3          3HD1      ILE   3   9.700   0.385  -1.251
   29    H    HIS   4           H        HIS   4   6.197   2.691  -5.094
   30    HA   HIS   4           HA       HIS   4   6.394   5.360  -3.940
   31   1HB   HIS   4          1HB       HIS   4   3.953   3.904  -5.000
   32   2HB   HIS   4          2HB       HIS   4   4.073   5.622  -4.636
   33    HD1  HIS   4           HD1      HIS   4   4.825   7.121  -6.516
   34    HD2  HIS   4           HD2      HIS   4   5.520   3.102  -7.302
   35    HE1  HIS   4           HE1      HIS   4   5.609   7.026  -8.904
   36    HE2  HIS   4           HE2      HIS   4   6.148   4.593  -9.314
   37    H    VAL   5           H        VAL   5   6.447   5.402  -1.782
   38    HA   VAL   5           HA       VAL   5   5.269   3.215  -0.275
   39    HB   VAL   5           HB       VAL   5   6.877   5.568   0.735
   40   1HG1  VAL   5          1HG1      VAL   5   6.167   2.946   2.048
   41   2HG1  VAL   5          2HG1      VAL   5   7.219   4.188   2.728
   42   3HG1  VAL   5          3HG1      VAL   5   5.510   4.530   2.462
   43   1HG2  VAL   5          1HG2      VAL   5   8.185   4.238  -0.828
   44   2HG2  VAL   5          2HG2      VAL   5   8.768   4.005   0.820
   45   3HG2  VAL   5          3HG2      VAL   5   7.770   2.768   0.052
   46    H    TYR   6           H        TYR   6   3.140   3.420  -0.006
   47    HA   TYR   6           HA       TYR   6   2.045   6.014   0.814
   48   1HB   TYR   6          1HB       TYR   6   0.655   3.463  -0.033
   49   2HB   TYR   6          2HB       TYR   6  -0.172   4.938   0.457
   50    HD1  TYR   6           HD1      TYR   6   1.625   3.246  -2.212
   51    HD2  TYR   6           HD2      TYR   6  -0.081   6.945  -0.980
   52    HE1  TYR   6           HE1      TYR   6   1.684   4.042  -4.536
   53    HE2  TYR   6           HE2      TYR   6  -0.024   7.749  -3.304
   54    HH   TYR   6           HH       TYR   6   0.379   5.768  -5.921
   55    H    ASP   7           H        ASP   7   2.302   6.292   2.936
   56    HA   ASP   7           HA       ASP   7   2.171   4.122   4.823
   57   1HB   ASP   7          1HB       ASP   7   3.555   6.291   5.010
   58   2HB   ASP   7          2HB       ASP   7   2.049   7.067   5.478
   59    H    THR   8           H        THR   8   0.171   3.194   4.963
   60    HA   THR   8           HA       THR   8  -2.143   4.917   4.543
   61    HB   THR   8           HB       THR   8  -2.103   1.903   4.682
   62    HG1  THR   8           HG1      THR   8  -0.678   2.844   3.035
   63   1HG2  THR   8          1HG2      THR   8  -4.147   2.103   3.339
   64   2HG2  THR   8          2HG2      THR   8  -4.317   2.946   4.879
   65   3HG2  THR   8          3HG2      THR   8  -4.019   3.861   3.400
   66    H    TYR   9           H        TYR   9  -3.377   5.587   6.125
   67    HA   TYR   9           HA       TYR   9  -3.308   4.189   8.710
   68   1HB   TYR   9          1HB       TYR   9  -4.128   6.989   7.941
   69   2HB   TYR   9          2HB       TYR   9  -4.493   6.299   9.515
   70    HD1  TYR   9           HD1      TYR   9  -2.793   6.027  11.174
   71    HD2  TYR   9           HD2      TYR   9  -1.799   7.488   7.306
   72    HE1  TYR   9           HE1      TYR   9  -0.602   6.746  12.018
   73    HE2  TYR   9           HE2      TYR   9   0.400   8.207   8.141
   74    HH   TYR   9           HH       TYR   9   1.427   8.830  10.311
   75    H    VAL  10           H        VAL  10  -4.803   2.588   8.588
   76    HA   VAL  10           HA       VAL  10  -7.548   3.423   7.898
   77    HB   VAL  10           HB       VAL  10  -6.356   0.640   7.772
   78   1HG1  VAL  10          1HG1      VAL  10  -9.134   1.600   7.086
   79   2HG1  VAL  10          2HG1      VAL  10  -8.508  -0.023   6.799
   80   3HG1  VAL  10          3HG1      VAL  10  -8.693   0.571   8.449
   81   1HG2  VAL  10          1HG2      VAL  10  -6.719   0.832   5.356
   82   2HG2  VAL  10          2HG2      VAL  10  -7.271   2.494   5.574
   83   3HG2  VAL  10          3HG2      VAL  10  -5.601   2.063   5.946
   84    H    LYS  11           H        LYS  11  -8.618   3.837   9.727
   85    HA   LYS  11           HA       LYS  11  -7.894   2.407  12.152
   86   1HB   LYS  11          1HB       LYS  11  -8.203   4.836  12.293
   87   2HB   LYS  11          2HB       LYS  11  -9.864   4.665  11.734
   88   1HG   LYS  11          1HG       LYS  11 -10.354   3.297  13.733
   89   2HG   LYS  11          2HG       LYS  11  -8.714   3.598  14.304
   90   1HD   LYS  11          1HD       LYS  11  -9.202   6.028  14.280
   91   2HD   LYS  11          2HD       LYS  11 -10.869   5.653  13.831
   92   1HE   LYS  11          1HE       LYS  11  -9.458   4.762  16.347
   93   2HE   LYS  11          2HE       LYS  11 -10.670   6.039  16.235
   94   1HZ   LYS  11          1HZ       LYS  11 -11.331   3.324  15.311
   95   2HZ   LYS  11          2HZ       LYS  11 -11.362   3.675  16.967
   96   3HZ   LYS  11          3HZ       LYS  11 -12.357   4.537  15.900
   97    H    ALA  12           H        ALA  12  -8.941   0.674  12.838
   98    HA   ALA  12           HA       ALA  12 -11.391  -0.210  11.670
   99   1HB   ALA  12          1HB       ALA  12 -10.008  -1.117  14.199
  100   2HB   ALA  12          2HB       ALA  12 -11.334  -1.953  13.392
  101   3HB   ALA  12          3HB       ALA  12  -9.772  -1.798  12.588
  102    H    LYS  13           H        LYS  13 -13.464  -0.103  12.514
  103    HA   LYS  13           HA       LYS  13 -14.085   2.307  13.814
  104   1HB   LYS  13          1HB       LYS  13 -15.638   1.177  12.294
  105   2HB   LYS  13          2HB       LYS  13 -15.812  -0.146  13.442
  106   1HG   LYS  13          1HG       LYS  13 -16.827   1.360  15.054
  107   2HG   LYS  13          2HG       LYS  13 -16.608   2.714  13.946
  108   1HD   LYS  13          1HD       LYS  13 -18.294   0.267  13.423
  109   2HD   LYS  13          2HD       LYS  13 -18.904   1.854  13.898
  110   1HE   LYS  13          1HE       LYS  13 -17.849   2.790  11.839
  111   2HE   LYS  13          2HE       LYS  13 -17.457   1.141  11.354
  112   1HZ   LYS  13          1HZ       LYS  13 -20.174   2.245  11.803
  113   2HZ   LYS  13          2HZ       LYS  13 -19.485   1.847  10.304
  114   3HZ   LYS  13          3HZ       LYS  13 -19.838   0.626  11.428
  115    H    ASP  14           H        ASP  14 -13.966  -1.018  15.033
  116    HA   ASP  14           HA       ASP  14 -14.183   0.091  17.755
  117   1HB   ASP  14          1HB       ASP  14 -15.389  -2.462  16.674
  118   2HB   ASP  14          2HB       ASP  14 -15.306  -2.068  18.388
  119    H    GLY  15           H        GLY  15 -11.748  -0.372  16.334
  120   1HA   GLY  15          1HA       GLY  15 -10.589  -2.284  18.216
  121   2HA   GLY  15          2HA       GLY  15 -10.287  -2.532  16.502
  122    H    HIS  16           H        HIS  16  -8.487  -1.723  15.778
  123    HA   HIS  16           HA       HIS  16  -7.230   0.500  17.244
  124   1HB   HIS  16          1HB       HIS  16  -5.016  -0.547  16.647
  125   2HB   HIS  16          2HB       HIS  16  -5.974  -1.464  17.800
  126    HD1  HIS  16           HD1      HIS  16  -4.873  -3.707  17.249
  127    HD2  HIS  16           HD2      HIS  16  -6.570  -1.850  13.936
  128    HE1  HIS  16           HE1      HIS  16  -4.932  -5.452  15.443
  129    HE2  HIS  16           HE2      HIS  16  -6.163  -4.375  13.529
  130    H    VAL  17           H        VAL  17  -5.421   1.533  15.889
  131    HA   VAL  17           HA       VAL  17  -6.492   2.046  13.216
  132    HB   VAL  17           HB       VAL  17  -4.151   3.437  14.520
  133   1HG1  VAL  17          1HG1      VAL  17  -4.695   5.231  12.944
  134   2HG1  VAL  17          2HG1      VAL  17  -4.338   3.718  12.111
  135   3HG1  VAL  17          3HG1      VAL  17  -6.009   4.254  12.289
  136   1HG2  VAL  17          1HG2      VAL  17  -5.693   5.202  15.212
  137   2HG2  VAL  17          2HG2      VAL  17  -7.054   4.250  14.623
  138   3HG2  VAL  17          3HG2      VAL  17  -6.096   3.668  15.983
  139    H    MET  18           H        MET  18  -5.736   0.872  11.599
  140    HA   MET  18           HA       MET  18  -3.363  -0.729  11.938
  141   1HB   MET  18          1HB       MET  18  -5.208  -0.428   9.557
  142   2HB   MET  18          2HB       MET  18  -3.951  -1.646   9.729
  143   1HG   MET  18          1HG       MET  18  -5.109  -2.621  11.617
  144   2HG   MET  18          2HG       MET  18  -6.340  -1.362  11.536
  145   1HE   MET  18          1HE       MET  18  -5.727  -4.591   8.299
  146   2HE   MET  18          2HE       MET  18  -4.773  -4.482   9.779
  147   3HE   MET  18          3HE       MET  18  -4.610  -3.245   8.533
  148    H    HIS  19           H        HIS  19  -1.443   0.092  11.625
  149    HA   HIS  19           HA       HIS  19  -1.066   2.202   9.613
  150   1HB   HIS  19          1HB       HIS  19   0.720   1.306  11.889
  151   2HB   HIS  19          2HB       HIS  19   1.147   2.543  10.718
  152    HD1  HIS  19           HD1      HIS  19   1.435   3.994  12.957
  153    HD2  HIS  19           HD2      HIS  19  -2.459   2.962  11.925
  154    HE1  HIS  19           HE1      HIS  19  -0.049   5.538  14.274
  155    HE2  HIS  19           HE2      HIS  19  -2.390   4.999  13.527
  156    H    PHE  20           H        PHE  20  -0.711   1.192   7.701
  157    HA   PHE  20           HA       PHE  20   1.557  -0.648   7.629
  158   1HB   PHE  20          1HB       PHE  20   0.375  -2.118   6.024
  159   2HB   PHE  20          2HB       PHE  20  -0.367  -2.114   7.616
  160    HD1  PHE  20           HD1      PHE  20  -0.812  -1.423   4.102
  161    HD2  PHE  20           HD2      PHE  20  -2.512  -0.908   7.969
  162    HE1  PHE  20           HE1      PHE  20  -2.988  -0.918   3.072
  163    HE2  PHE  20           HE2      PHE  20  -4.692  -0.403   6.946
  164    HZ   PHE  20           HZ       PHE  20  -4.930  -0.407   4.494
  165    H    ASP  21           H        ASP  21   2.933  -0.286   6.017
  166    HA   ASP  21           HA       ASP  21   2.230   1.888   4.191
  167   1HB   ASP  21          1HB       ASP  21   4.690   1.917   3.683
  168   2HB   ASP  21          2HB       ASP  21   4.277   2.286   5.351
  169    H    VAL  22           H        VAL  22   1.938   1.647   2.118
  170    HA   VAL  22           HA       VAL  22   2.004  -1.079   1.046
  171    HB   VAL  22           HB       VAL  22   0.616   1.362  -0.080
  172   1HG1  VAL  22          1HG1      VAL  22   0.323  -1.564  -0.745
  173   2HG1  VAL  22          2HG1      VAL  22  -0.656  -0.256  -1.411
  174   3HG1  VAL  22          3HG1      VAL  22   1.071  -0.331  -1.760
  175   1HG2  VAL  22          1HG2      VAL  22  -1.456   0.387   0.809
  176   2HG2  VAL  22          2HG2      VAL  22  -0.511  -0.874   1.602
  177   3HG2  VAL  22          3HG2      VAL  22  -0.320   0.811   2.091
  178    H    PHE  23           H        PHE  23   3.745  -1.576  -0.106
  179    HA   PHE  23           HA       PHE  23   5.212   0.476  -1.556
  180   1HB   PHE  23          1HB       PHE  23   5.688  -2.497  -1.279
  181   2HB   PHE  23          2HB       PHE  23   6.740  -1.400  -2.159
  182    HD1  PHE  23           HD1      PHE  23   6.070  -2.929   0.952
  183    HD2  PHE  23           HD2      PHE  23   7.730   0.570  -0.811
  184    HE1  PHE  23           HE1      PHE  23   7.342  -2.498   3.012
  185    HE2  PHE  23           HE2      PHE  23   9.005   1.007   1.247
  186    HZ   PHE  23           HZ       PHE  23   8.814  -0.529   3.162
  187    H    THR  24           H        THR  24   4.531   1.056  -3.514
  188    HA   THR  24           HA       THR  24   3.505  -1.057  -5.301
  189    HB   THR  24           HB       THR  24   2.120   0.747  -6.383
  190    HG1  THR  24           HG1      THR  24   2.548   2.167  -3.954
  191   1HG2  THR  24          1HG2      THR  24   0.346   0.693  -4.682
  192   2HG2  THR  24          2HG2      THR  24   1.098  -0.887  -4.893
  193   3HG2  THR  24          3HG2      THR  24   1.511   0.107  -3.497
  194    H    ASP  25           H        ASP  25   4.115  -0.947  -7.462
  195    HA   ASP  25           HA       ASP  25   6.405   0.763  -8.054
  196   1HB   ASP  25          1HB       ASP  25   6.799  -1.474  -8.706
  197   2HB   ASP  25          2HB       ASP  25   5.198  -1.634  -9.421
  198    H    VAL  26           H        VAL  26   3.167   0.070  -9.230
  199    HA   VAL  26           HA       VAL  26   3.156   1.672 -11.507
  200    HB   VAL  26           HB       VAL  26   0.816   1.082  -9.685
  201   1HG1  VAL  26          1HG1      VAL  26   0.903   1.835 -12.604
  202   2HG1  VAL  26          2HG1      VAL  26  -0.543   1.387 -11.699
  203   3HG1  VAL  26          3HG1      VAL  26   0.339   2.856 -11.281
  204   1HG2  VAL  26          1HG2      VAL  26   0.397  -0.834 -11.146
  205   2HG2  VAL  26          2HG2      VAL  26   1.866  -0.469 -12.051
  206   3HG2  VAL  26          3HG2      VAL  26   1.970  -0.960 -10.360
  207    H    ARG  27           H        ARG  27   3.238   3.793 -11.784
  208    HA   ARG  27           HA       ARG  27   3.081   5.626  -9.595
  209   1HB   ARG  27          1HB       ARG  27   4.561   6.118 -11.448
  210   2HB   ARG  27          2HB       ARG  27   3.219   6.071 -12.581
  211   1HG   ARG  27          1HG       ARG  27   2.231   8.023 -11.393
  212   2HG   ARG  27          2HG       ARG  27   3.706   8.112 -10.427
  213   1HD   ARG  27          1HD       ARG  27   5.029   8.549 -12.366
  214   2HD   ARG  27          2HD       ARG  27   3.666   8.222 -13.436
  215    HE   ARG  27           HE       ARG  27   2.667  10.239 -12.085
  216   1HH1  ARG  27          1HH1      ARG  27   5.949   9.863 -13.278
  217   2HH1  ARG  27          2HH1      ARG  27   6.179  11.572 -13.537
  218   1HH2  ARG  27          1HH2      ARG  27   2.967  12.459 -12.428
  219   2HH2  ARG  27          2HH2      ARG  27   4.481  13.054 -13.040
  220    H    ASP  28           H        ASP  28   1.032   5.325  -8.729
  221    HA   ASP  28           HA       ASP  28  -1.028   6.944  -9.849
  222   1HB   ASP  28          1HB       ASP  28  -1.200   4.786 -11.177
  223   2HB   ASP  28          2HB       ASP  28  -1.637   3.988  -9.669
  224    H    ASP  29           H        ASP  29  -2.382   7.627  -8.238
  225    HA   ASP  29           HA       ASP  29  -1.846   6.599  -5.566
  226   1HB   ASP  29          1HB       ASP  29  -3.023   8.556  -4.741
  227   2HB   ASP  29          2HB       ASP  29  -1.847   9.047  -5.955
  228    H    LYS  30           H        LYS  30  -4.424   6.690  -7.921
  229    HA   LYS  30           HA       LYS  30  -6.556   5.989  -6.206
  230   1HB   LYS  30          1HB       LYS  30  -6.993   6.889  -8.423
  231   2HB   LYS  30          2HB       LYS  30  -6.190   5.518  -9.174
  232   1HG   LYS  30          1HG       LYS  30  -7.934   4.031  -8.248
  233   2HG   LYS  30          2HG       LYS  30  -8.757   5.448  -7.595
  234   1HD   LYS  30          1HD       LYS  30  -9.790   4.792  -9.682
  235   2HD   LYS  30          2HD       LYS  30  -8.972   6.341  -9.886
  236   1HE   LYS  30          1HE       LYS  30  -8.522   4.970 -11.806
  237   2HE   LYS  30          2HE       LYS  30  -7.040   5.139 -10.869
  238   1HZ   LYS  30          1HZ       LYS  30  -7.500   2.937  -9.894
  239   2HZ   LYS  30          2HZ       LYS  30  -8.847   2.777 -10.909
  240   3HZ   LYS  30          3HZ       LYS  30  -7.289   2.875 -11.570
  241    H    LYS  31           H        LYS  31  -4.330   4.086  -8.181
  242    HA   LYS  31           HA       LYS  31  -5.543   1.587  -7.655
  243   1HB   LYS  31          1HB       LYS  31  -3.915   2.208  -9.525
  244   2HB   LYS  31          2HB       LYS  31  -2.639   1.963  -8.337
  245   1HG   LYS  31          1HG       LYS  31  -3.047  -0.307  -8.172
  246   2HG   LYS  31          2HG       LYS  31  -4.683  -0.162  -8.815
  247   1HD   LYS  31          1HD       LYS  31  -2.134   0.238 -10.380
  248   2HD   LYS  31          2HD       LYS  31  -3.161  -1.197 -10.432
  249   1HE   LYS  31          1HE       LYS  31  -3.883   1.597 -11.304
  250   2HE   LYS  31          2HE       LYS  31  -3.660   0.184 -12.334
  251   1HZ   LYS  31          1HZ       LYS  31  -5.803   0.514 -10.291
  252   2HZ   LYS  31          2HZ       LYS  31  -6.000   0.663 -11.969
  253   3HZ   LYS  31          3HZ       LYS  31  -5.589  -0.839 -11.296
  254    H    ALA  32           H        ALA  32  -3.209   3.495  -5.902
  255    HA   ALA  32           HA       ALA  32  -2.332   1.521  -4.091
  256   1HB   ALA  32          1HB       ALA  32  -2.703   4.481  -3.620
  257   2HB   ALA  32          2HB       ALA  32  -1.758   3.385  -2.613
  258   3HB   ALA  32          3HB       ALA  32  -1.257   3.712  -4.271
  259    H    ILE  33           H        ILE  33  -5.065   3.763  -4.039
  260    HA   ILE  33           HA       ILE  33  -6.229   2.950  -1.614
  261    HB   ILE  33           HB       ILE  33  -7.632   3.936  -4.107
  262   1HG1  ILE  33          1HG1      ILE  33  -6.603   5.494  -1.728
  263   2HG1  ILE  33          2HG1      ILE  33  -5.856   5.466  -3.321
  264   1HG2  ILE  33          1HG2      ILE  33  -9.413   4.629  -2.594
  265   2HG2  ILE  33          2HG2      ILE  33  -9.139   2.888  -2.504
  266   3HG2  ILE  33          3HG2      ILE  33  -8.528   3.945  -1.230
  267   1HD1  ILE  33          1HD1      ILE  33  -7.151   7.484  -3.002
  268   2HD1  ILE  33          2HD1      ILE  33  -7.866   6.487  -4.269
  269   3HD1  ILE  33          3HD1      ILE  33  -8.593   6.528  -2.663
  270    H    GLU  34           H        GLU  34  -6.673   1.842  -4.939
  271    HA   GLU  34           HA       GLU  34  -8.700  -0.017  -4.527
  272   1HB   GLU  34          1HB       GLU  34  -6.428  -0.185  -6.521
  273   2HB   GLU  34          2HB       GLU  34  -7.952  -1.058  -6.619
  274   1HG   GLU  34          1HG       GLU  34  -9.138   1.095  -6.781
  275   2HG   GLU  34          2HG       GLU  34  -7.585   1.926  -6.771
  276    H    PHE  35           H        PHE  35  -5.172  -0.443  -4.371
  277    HA   PHE  35           HA       PHE  35  -5.251  -3.227  -3.874
  278   1HB   PHE  35          1HB       PHE  35  -3.124  -1.166  -3.281
  279   2HB   PHE  35          2HB       PHE  35  -2.898  -2.895  -3.033
  280    HD1  PHE  35           HD1      PHE  35  -4.379  -3.862  -5.484
  281    HD2  PHE  35           HD2      PHE  35  -1.512  -0.767  -4.930
  282    HE1  PHE  35           HE1      PHE  35  -3.660  -4.113  -7.823
  283    HE2  PHE  35           HE2      PHE  35  -0.795  -1.009  -7.267
  284    HZ   PHE  35           HZ       PHE  35  -1.865  -2.689  -8.717
  285    H    ALA  36           H        ALA  36  -5.114  -0.423  -1.727
  286    HA   ALA  36           HA       ALA  36  -4.802  -1.794   0.693
  287   1HB   ALA  36          1HB       ALA  36  -6.255   0.808   0.213
  288   2HB   ALA  36          2HB       ALA  36  -5.649   0.224   1.763
  289   3HB   ALA  36          3HB       ALA  36  -4.519   0.630   0.471
  290    H    LYS  37           H        LYS  37  -7.763  -0.757  -0.990
  291    HA   LYS  37           HA       LYS  37  -9.529  -1.776   0.972
  292   1HB   LYS  37          1HB       LYS  37  -9.992  -1.128  -1.940
  293   2HB   LYS  37          2HB       LYS  37 -11.269  -1.573  -0.816
  294   1HG   LYS  37          1HG       LYS  37 -10.588   0.379   0.594
  295   2HG   LYS  37          2HG       LYS  37  -9.507   0.862  -0.714
  296   1HD   LYS  37          1HD       LYS  37 -12.494   0.507  -0.953
  297   2HD   LYS  37          2HD       LYS  37 -11.660   2.053  -0.790
  298   1HE   LYS  37          1HE       LYS  37 -10.454   1.585  -2.893
  299   2HE   LYS  37          2HE       LYS  37 -11.370   0.087  -3.061
  300   1HZ   LYS  37          1HZ       LYS  37 -12.290   1.943  -4.366
  301   2HZ   LYS  37          2HZ       LYS  37 -13.399   1.341  -3.229
  302   3HZ   LYS  37          3HZ       LYS  37 -12.579   2.796  -2.929
  303    H    GLN  38           H        GLN  38  -8.214  -3.168  -2.013
  304    HA   GLN  38           HA       GLN  38  -9.722  -5.532  -2.025
  305   1HB   GLN  38          1HB       GLN  38  -6.912  -4.995  -2.991
  306   2HB   GLN  38          2HB       GLN  38  -7.752  -6.514  -3.262
  307   1HG   GLN  38          1HG       GLN  38  -9.475  -5.355  -4.527
  308   2HG   GLN  38          2HG       GLN  38  -8.664  -3.817  -4.232
  309   1HE2  GLN  38          2HE2      GLN  38  -6.952  -6.787  -4.851
  310   2HE2  GLN  38          1HE2      GLN  38  -6.355  -6.349  -6.410
  311    H    TRP  39           H        TRP  39  -6.619  -4.782  -0.480
  312    HA   TRP  39           HA       TRP  39  -6.209  -7.339   0.637
  313   1HB   TRP  39          1HB       TRP  39  -4.404  -5.688   0.433
  314   2HB   TRP  39          2HB       TRP  39  -5.209  -4.654   1.612
  315    HD1  TRP  39           HD1      TRP  39  -3.939  -8.330   1.550
  316    HE1  TRP  39           HE1      TRP  39  -2.847  -8.829   3.825
  317    HE3  TRP  39           HE3      TRP  39  -4.717  -3.815   3.816
  318    HZ2  TRP  39           HZ2      TRP  39  -2.373  -7.475   6.254
  319    HZ3  TRP  39           HZ3      TRP  39  -3.910  -3.499   6.120
  320    HH2  TRP  39           HH2      TRP  39  -2.762  -5.294   7.313
  321    H    LEU  40           H        LEU  40  -7.670  -4.387   1.983
  322    HA   LEU  40           HA       LEU  40  -8.285  -5.390   4.515
  323   1HB   LEU  40          1HB       LEU  40  -9.764  -3.357   2.848
  324   2HB   LEU  40          2HB       LEU  40 -10.099  -3.673   4.539
  325    HG   LEU  40           HG       LEU  40  -7.488  -2.625   3.443
  326   1HD1  LEU  40          1HD1      LEU  40  -8.122  -0.534   4.523
  327   2HD1  LEU  40          2HD1      LEU  40  -9.290  -0.994   3.285
  328   3HD1  LEU  40          3HD1      LEU  40  -9.671  -1.236   4.990
  329   1HD2  LEU  40          1HD2      LEU  40  -6.897  -2.271   5.788
  330   2HD2  LEU  40          2HD2      LEU  40  -8.409  -3.031   6.287
  331   3HD2  LEU  40          3HD2      LEU  40  -7.180  -3.979   5.451
  332    H    SER  41           H        SER  41 -10.143  -5.515   1.501
  333    HA   SER  41           HA       SER  41 -12.406  -6.798   2.593
  334   1HB   SER  41          1HB       SER  41 -12.366  -5.644   0.381
  335   2HB   SER  41          2HB       SER  41 -11.377  -6.959  -0.251
  336    HG   SER  41           HG       SER  41 -13.848  -7.509   1.000
  337    H    SER  42           H        SER  42  -9.353  -7.999   1.366
  338    HA   SER  42           HA       SER  42 -10.106 -10.729   1.242
  339   1HB   SER  42          1HB       SER  42  -8.111  -9.658   0.101
  340   2HB   SER  42          2HB       SER  42  -7.312  -9.652   1.672
  341    HG   SER  42           HG       SER  42  -8.430 -12.058   0.769
  342    H    ILE  43           H        ILE  43  -8.636  -8.717   3.768
  343    HA   ILE  43           HA       ILE  43  -8.390 -11.001   5.543
  344    HB   ILE  43           HB       ILE  43  -7.456  -9.411   7.174
  345   1HG1  ILE  43          1HG1      ILE  43  -7.876  -7.353   4.995
  346   2HG1  ILE  43          2HG1      ILE  43  -8.766  -7.429   6.512
  347   1HG2  ILE  43          1HG2      ILE  43  -5.984 -10.517   5.595
  348   2HG2  ILE  43          2HG2      ILE  43  -6.254  -9.232   4.417
  349   3HG2  ILE  43          3HG2      ILE  43  -5.412  -8.881   5.926
  350   1HD1  ILE  43          1HD1      ILE  43  -5.813  -6.928   6.217
  351   2HD1  ILE  43          2HD1      ILE  43  -7.048  -5.723   6.585
  352   3HD1  ILE  43          3HD1      ILE  43  -6.698  -7.009   7.740
  353    H    GLY  44           H        GLY  44 -10.830  -8.795   4.787
  354   1HA   GLY  44          1HA       GLY  44 -13.032  -9.147   5.614
  355   2HA   GLY  44          2HA       GLY  44 -12.345  -9.776   7.102
  356    H    GLU  45           H        GLU  45 -10.700  -7.010   6.268
  357    HA   GLU  45           HA       GLU  45 -12.199  -5.485   8.265
  358   1HB   GLU  45          1HB       GLU  45  -9.454  -5.048   7.071
  359   2HB   GLU  45          2HB       GLU  45 -10.194  -3.999   8.271
  360   1HG   GLU  45          1HG       GLU  45  -9.651  -6.925   8.713
  361   2HG   GLU  45          2HG       GLU  45  -8.540  -5.637   9.170
  362    H    GLU  46           H        GLU  46 -13.359  -5.813   5.733
  363    HA   GLU  46           HA       GLU  46 -12.912  -3.423   4.172
  364   1HB   GLU  46          1HB       GLU  46 -14.821  -4.331   2.800
  365   2HB   GLU  46          2HB       GLU  46 -13.421  -5.381   2.927
  366   1HG   GLU  46          1HG       GLU  46 -14.575  -6.669   4.681
  367   2HG   GLU  46          2HG       GLU  46 -15.991  -5.641   4.470
  368    H    GLY  47           H        GLY  47 -14.039  -3.406   7.011
  369   1HA   GLY  47          1HA       GLY  47 -16.541  -1.954   6.448
  370   2HA   GLY  47          2HA       GLY  47 -16.117  -2.669   7.997
  371    H    ALA  48           H        ALA  48 -14.037  -0.733   5.931
  372    HA   ALA  48           HA       ALA  48 -14.152   1.460   7.881
  373   1HB   ALA  48          1HB       ALA  48 -12.189   0.101   8.417
  374   2HB   ALA  48          2HB       ALA  48 -11.612   0.275   6.759
  375   3HB   ALA  48          3HB       ALA  48 -11.720   1.688   7.808
  376    H    THR  49           H        THR  49 -13.049   3.462   6.964
  377    HA   THR  49           HA       THR  49 -13.880   3.715   4.156
  378    HB   THR  49           HB       THR  49 -13.458   5.928   6.173
  379    HG1  THR  49           HG1      THR  49 -15.310   4.188   6.308
  380   1HG2  THR  49          1HG2      THR  49 -13.298   6.647   3.835
  381   2HG2  THR  49          2HG2      THR  49 -14.856   5.895   3.493
  382   3HG2  THR  49          3HG2      THR  49 -14.764   7.274   4.590
  383    H    VAL  50           H        VAL  50 -12.296   3.784   2.699
  384    HA   VAL  50           HA       VAL  50  -9.719   4.971   3.491
  385    HB   VAL  50           HB       VAL  50 -10.172   2.776   1.456
  386   1HG1  VAL  50          1HG1      VAL  50  -7.615   4.074   2.399
  387   2HG1  VAL  50          2HG1      VAL  50  -7.720   2.676   1.329
  388   3HG1  VAL  50          3HG1      VAL  50  -8.342   4.240   0.800
  389   1HG2  VAL  50          1HG2      VAL  50  -8.849   2.687   4.165
  390   2HG2  VAL  50          2HG2      VAL  50 -10.408   1.974   3.746
  391   3HG2  VAL  50          3HG2      VAL  50  -8.928   1.356   3.011
  392    H    THR  51           H        THR  51  -9.842   6.995   2.717
  393    HA   THR  51           HA       THR  51 -10.434   7.294  -0.157
  394    HB   THR  51           HB       THR  51 -10.802   9.675   0.273
  395    HG1  THR  51           HG1      THR  51 -10.198   8.965   2.982
  396   1HG2  THR  51          1HG2      THR  51 -12.369   7.921   2.168
  397   2HG2  THR  51          2HG2      THR  51 -12.862   9.516   1.599
  398   3HG2  THR  51          3HG2      THR  51 -12.723   8.177   0.460
  399    H    SER  52           H        SER  52  -9.153   9.547  -0.807
  400    HA   SER  52           HA       SER  52  -6.462   8.699  -1.046
  401   1HB   SER  52          1HB       SER  52  -7.611  10.019  -2.776
  402   2HB   SER  52          2HB       SER  52  -7.694  11.393  -1.674
  403    HG   SER  52           HG       SER  52  -5.206  10.822  -1.653
  404    H    GLU  53           H        GLU  53  -7.958  10.140   1.551
  405    HA   GLU  53           HA       GLU  53  -5.684  11.759   2.368
  406   1HB   GLU  53          1HB       GLU  53  -8.346  12.017   2.819
  407   2HB   GLU  53          2HB       GLU  53  -7.861  11.188   4.289
  408   1HG   GLU  53          1HG       GLU  53  -6.672  13.764   3.277
  409   2HG   GLU  53          2HG       GLU  53  -7.905  13.632   4.527
  410    H    GLU  54           H        GLU  54  -7.306   8.752   3.261
  411    HA   GLU  54           HA       GLU  54  -5.696   8.170   5.512
  412   1HB   GLU  54          1HB       GLU  54  -7.425   6.434   3.754
  413   2HB   GLU  54          2HB       GLU  54  -6.542   5.795   5.132
  414   1HG   GLU  54          1HG       GLU  54  -8.794   6.210   5.793
  415   2HG   GLU  54          2HG       GLU  54  -7.751   7.383   6.592
  416    H    CYS  55           H        CYS  55  -5.448   7.362   2.094
  417    HA   CYS  55           HA       CYS  55  -2.938   5.957   2.567
  418   1HB   CYS  55          1HB       CYS  55  -3.025   5.506   0.118
  419   2HB   CYS  55          2HB       CYS  55  -4.452   4.929   0.976
  420    HG   CYS  55           HG       CYS  55  -4.344   7.875  -0.748
  421    H    ARG  56           H        ARG  56  -1.480   7.507   3.141
  422    HA   ARG  56           HA       ARG  56  -1.266   9.881   1.437
  423   1HB   ARG  56          1HB       ARG  56   0.208  10.714   3.362
  424   2HB   ARG  56          2HB       ARG  56  -1.521  10.587   3.649
  425   1HG   ARG  56          1HG       ARG  56  -1.051   8.326   4.677
  426   2HG   ARG  56          2HG       ARG  56   0.657   8.759   4.612
  427   1HD   ARG  56          1HD       ARG  56  -1.353  10.570   5.892
  428   2HD   ARG  56          2HD       ARG  56  -0.677   9.205   6.776
  429    HE   ARG  56           HE       ARG  56   1.492  10.220   6.580
  430   1HH1  ARG  56          1HH1      ARG  56  -1.203  12.241   5.590
  431   2HH1  ARG  56          2HH1      ARG  56  -0.354  13.734   5.884
  432   1HH2  ARG  56          1HH2      ARG  56   2.594  12.183   6.993
  433   2HH2  ARG  56          2HH2      ARG  56   1.814  13.703   6.668
  434    H    PHE  57           H        PHE  57   0.285  10.050   0.037
  435    HA   PHE  57           HA       PHE  57   2.416   8.127  -0.108
  436   1HB   PHE  57          1HB       PHE  57   1.369   8.960  -2.159
  437   2HB   PHE  57          2HB       PHE  57   1.837  10.606  -1.754
  438    HD1  PHE  57           HD1      PHE  57   3.188   7.268  -2.621
  439    HD2  PHE  57           HD2      PHE  57   3.918  11.456  -2.397
  440    HE1  PHE  57           HE1      PHE  57   5.292   6.967  -3.859
  441    HE2  PHE  57           HE2      PHE  57   6.023  11.159  -3.633
  442    HZ   PHE  57           HZ       PHE  57   6.712   8.911  -4.367
  443    H    CYS  58           H        CYS  58   3.999   8.317   1.358
  444    HA   CYS  58           HA       CYS  58   4.783  10.919   2.338
  445   1HB   CYS  58          1HB       CYS  58   5.830   8.161   2.991
  446   2HB   CYS  58          2HB       CYS  58   6.296   9.644   3.820
  447    HG   CYS  58           HG       CYS  58   4.599   8.635   5.613
  448    H    HIS  59           H        HIS  59   6.435   8.231   0.642
  449    HA   HIS  59           HA       HIS  59   7.977  10.128  -0.858
  450   1HB   HIS  59          1HB       HIS  59  10.185   9.479  -0.122
  451   2HB   HIS  59          2HB       HIS  59   9.270  10.061   1.252
  452    HD1  HIS  59           HD1      HIS  59   8.921   8.441   3.202
  453    HD2  HIS  59           HD2      HIS  59  10.728   6.694  -0.114
  454    HE1  HIS  59           HE1      HIS  59   9.725   6.184   3.972
  455    HE2  HIS  59           HE2      HIS  59  11.032   5.263   2.017
  456    H    SER  60           H        SER  60   9.758   8.913  -2.093
  457    HA   SER  60           HA       SER  60   8.963   6.168  -2.755
  458   1HB   SER  60          1HB       SER  60   7.884   7.829  -4.363
  459   2HB   SER  60          2HB       SER  60   9.514   8.241  -4.893
  460    HG   SER  60           HG       SER  60   8.891   5.537  -4.839
  461    H    GLU  61           H        GLU  61  10.728   4.871  -3.050
  462    HA   GLU  61           HA       GLU  61  13.322   6.155  -3.471
  463   1HB   GLU  61          1HB       GLU  61  14.333   4.889  -1.613
  464   2HB   GLU  61          2HB       GLU  61  13.120   6.033  -1.057
  465   1HG   GLU  61          1HG       GLU  61  11.503   4.210  -0.843
  466   2HG   GLU  61          2HG       GLU  61  12.731   3.066  -1.386
  467    H    LYS  62           H        LYS  62  15.066   4.295  -3.530
  468    HA   LYS  62           HA       LYS  62  14.280   2.549  -5.643
  469   1HB   LYS  62          1HB       LYS  62  16.834   2.681  -4.030
  470   2HB   LYS  62          2HB       LYS  62  16.602   1.671  -5.453
  471   1HG   LYS  62          1HG       LYS  62  16.219   3.651  -6.815
  472   2HG   LYS  62          2HG       LYS  62  16.414   4.674  -5.391
  473   1HD   LYS  62          1HD       LYS  62  18.720   3.848  -5.142
  474   2HD   LYS  62          2HD       LYS  62  18.513   2.877  -6.603
  475   1HE   LYS  62          1HE       LYS  62  18.126   4.897  -7.907
  476   2HE   LYS  62          2HE       LYS  62  18.277   5.881  -6.451
  477   1HZ   LYS  62          1HZ       LYS  62  20.407   4.255  -7.733
  478   2HZ   LYS  62          2HZ       LYS  62  20.325   5.947  -7.642
  479   3HZ   LYS  62          3HZ       LYS  62  20.577   5.031  -6.236
  480    H    ALA  63           H        ALA  63  13.542   0.571  -5.552
  481    HA   ALA  63           HA       ALA  63  12.718  -0.467  -3.022
  482   1HB   ALA  63          1HB       ALA  63  11.535  -2.116  -4.296
  483   2HB   ALA  63          2HB       ALA  63  11.342  -0.545  -5.070
  484   3HB   ALA  63          3HB       ALA  63  12.466  -1.725  -5.742
  485    HA   PRO  64           HA       PRO  64  15.959  -3.489  -2.241
  486   1HB   PRO  64          1HB       PRO  64  13.665  -4.901  -0.987
  487   2HB   PRO  64          2HB       PRO  64  15.246  -4.503  -0.307
  488   1HG   PRO  64          1HG       PRO  64  13.062  -3.162   0.429
  489   2HG   PRO  64          2HG       PRO  64  14.619  -2.337   0.225
  490   1HD   PRO  64          1HD       PRO  64  12.240  -2.378  -1.584
  491   2HD   PRO  64          2HD       PRO  64  13.353  -1.045  -1.212
  492    H    ASP  65           H        ASP  65  16.428  -5.569  -3.082
  493    HA   ASP  65           HA       ASP  65  15.348  -5.816  -5.667
  494   1HB   ASP  65          1HB       ASP  65  17.696  -6.357  -5.000
  495   2HB   ASP  65          2HB       ASP  65  17.089  -7.837  -4.261
  496    H    GLU  66           H        GLU  66  14.624  -7.579  -2.705
  497    HA   GLU  66           HA       GLU  66  13.338  -9.723  -4.155
  498   1HB   GLU  66          1HB       GLU  66  12.685 -10.587  -1.929
  499   2HB   GLU  66          2HB       GLU  66  14.412 -10.325  -2.093
  500   1HG   GLU  66          1HG       GLU  66  12.634  -8.282  -0.813
  501   2HG   GLU  66          2HG       GLU  66  13.280  -9.650   0.094
  502    H    VAL  67           H        VAL  67  12.352  -6.711  -2.724
  503    HA   VAL  67           HA       VAL  67   9.578  -7.444  -2.524
  504    HB   VAL  67           HB       VAL  67   9.118  -5.284  -1.776
  505   1HG1  VAL  67          1HG1      VAL  67  10.853  -4.738  -0.159
  506   2HG1  VAL  67          2HG1      VAL  67  10.571  -6.477  -0.241
  507   3HG1  VAL  67          3HG1      VAL  67  11.988  -5.775  -1.025
  508   1HG2  VAL  67          1HG2      VAL  67  11.647  -4.312  -3.101
  509   2HG2  VAL  67          2HG2      VAL  67   9.999  -4.024  -3.660
  510   3HG2  VAL  67          3HG2      VAL  67  10.549  -3.326  -2.135
  511    H    ILE  68           H        ILE  68  11.656  -6.245  -4.958
  512    HA   ILE  68           HA       ILE  68   9.838  -4.845  -6.568
  513    HB   ILE  68           HB       ILE  68  12.404  -6.267  -7.270
  514   1HG1  ILE  68          1HG1      ILE  68  11.833  -3.334  -6.856
  515   2HG1  ILE  68          2HG1      ILE  68  12.398  -4.394  -5.573
  516   1HG2  ILE  68          1HG2      ILE  68  12.436  -4.888  -9.297
  517   2HG2  ILE  68          2HG2      ILE  68  11.048  -5.976  -9.284
  518   3HG2  ILE  68          3HG2      ILE  68  10.835  -4.268  -8.899
  519   1HD1  ILE  68          1HD1      ILE  68  13.863  -3.712  -8.102
  520   2HD1  ILE  68          2HD1      ILE  68  14.214  -3.128  -6.474
  521   3HD1  ILE  68          3HD1      ILE  68  14.426  -4.834  -6.864
  522    H    GLU  69           H        GLU  69  10.966  -8.224  -6.791
  523    HA   GLU  69           HA       GLU  69   9.215  -8.858  -8.933
  524   1HB   GLU  69          1HB       GLU  69  11.278 -10.139  -8.430
  525   2HB   GLU  69          2HB       GLU  69  10.523 -10.737  -6.958
  526   1HG   GLU  69          1HG       GLU  69   8.863 -11.916  -8.216
  527   2HG   GLU  69          2HG       GLU  69   9.429 -11.195  -9.721
  528    H    ALA  70           H        ALA  70   8.951  -8.939  -5.445
  529    HA   ALA  70           HA       ALA  70   6.623 -10.501  -5.230
  530   1HB   ALA  70          1HB       ALA  70   8.043  -9.947  -3.314
  531   2HB   ALA  70          2HB       ALA  70   7.540  -8.261  -3.429
  532   3HB   ALA  70          3HB       ALA  70   6.361  -9.508  -3.022
  533    H    ILE  71           H        ILE  71   7.089  -7.023  -5.696
  534    HA   ILE  71           HA       ILE  71   4.315  -6.370  -5.619
  535    HB   ILE  71           HB       ILE  71   6.636  -4.832  -6.805
  536   1HG1  ILE  71          1HG1      ILE  71   5.219  -4.531  -4.147
  537   2HG1  ILE  71          2HG1      ILE  71   6.794  -5.285  -4.372
  538   1HG2  ILE  71          1HG2      ILE  71   4.532  -4.084  -7.773
  539   2HG2  ILE  71          2HG2      ILE  71   3.836  -3.908  -6.161
  540   3HG2  ILE  71          3HG2      ILE  71   5.169  -2.868  -6.665
  541   1HD1  ILE  71          1HD1      ILE  71   7.010  -3.015  -3.551
  542   2HD1  ILE  71          2HD1      ILE  71   7.693  -3.163  -5.171
  543   3HD1  ILE  71          3HD1      ILE  71   6.114  -2.412  -4.945
  544    H    LYS  72           H        LYS  72   6.495  -7.449  -8.126
  545    HA   LYS  72           HA       LYS  72   4.731  -6.850 -10.301
  546   1HB   LYS  72          1HB       LYS  72   7.035  -8.801 -10.106
  547   2HB   LYS  72          2HB       LYS  72   6.197  -8.387 -11.595
  548   1HG   LYS  72          1HG       LYS  72   7.771  -6.492  -9.864
  549   2HG   LYS  72          2HG       LYS  72   8.287  -7.175 -11.407
  550   1HD   LYS  72          1HD       LYS  72   6.309  -6.088 -12.467
  551   2HD   LYS  72          2HD       LYS  72   5.978  -5.297 -10.926
  552   1HE   LYS  72          1HE       LYS  72   8.157  -4.201 -11.012
  553   2HE   LYS  72          2HE       LYS  72   8.512  -5.012 -12.538
  554   1HZ   LYS  72          1HZ       LYS  72   6.408  -3.893 -13.377
  555   2HZ   LYS  72          2HZ       LYS  72   6.507  -2.903 -12.007
  556   3HZ   LYS  72          3HZ       LYS  72   7.763  -2.900 -13.144
  557    H    GLN  73           H        GLN  73   5.287  -9.585  -8.202
  558    HA   GLN  73           HA       GLN  73   3.587 -11.392  -9.634
  559   1HB   GLN  73          1HB       GLN  73   5.483 -12.183  -8.321
  560   2HB   GLN  73          2HB       GLN  73   4.770 -11.525  -6.858
  561   1HG   GLN  73          1HG       GLN  73   2.877 -13.092  -7.129
  562   2HG   GLN  73          2HG       GLN  73   3.708 -13.800  -8.515
  563   1HE2  GLN  73          2HE2      GLN  73   3.841 -15.810  -7.495
  564   2HE2  GLN  73          1HE2      GLN  73   4.950 -16.106  -6.200
  565    H    ASN  74           H        ASN  74   3.287  -9.668  -6.520
  566    HA   ASN  74           HA       ASN  74   0.556 -10.619  -6.224
  567   1HB   ASN  74          1HB       ASN  74   2.309  -8.902  -4.462
  568   2HB   ASN  74          2HB       ASN  74   0.645  -9.315  -4.066
  569   1HD2  ASN  74          2HD2      ASN  74   3.891 -10.499  -4.415
  570   2HD2  ASN  74          1HD2      ASN  74   3.642 -12.013  -3.607
  571    H    GLY  75           H        GLY  75   2.179  -7.818  -7.361
  572   1HA   GLY  75          1HA       GLY  75   1.097  -6.077  -8.553
  573   2HA   GLY  75          2HA       GLY  75  -0.394  -6.450  -7.694
  574    H    TYR  76           H        TYR  76   1.084  -6.615  -5.140
  575    HA   TYR  76           HA       TYR  76   2.003  -3.934  -4.593
  576   1HB   TYR  76          1HB       TYR  76   0.212  -3.589  -2.839
  577   2HB   TYR  76          2HB       TYR  76  -0.359  -3.489  -4.500
  578    HD1  TYR  76           HD1      TYR  76  -0.587  -5.307  -1.353
  579    HD2  TYR  76           HD2      TYR  76  -1.690  -5.339  -5.463
  580    HE1  TYR  76           HE1      TYR  76  -2.285  -7.026  -0.883
  581    HE2  TYR  76           HE2      TYR  76  -3.386  -7.050  -5.004
  582    HH   TYR  76           HH       TYR  76  -3.760  -8.842  -3.286
  583    H    PHE  77           H        PHE  77   3.003  -3.792  -2.516
  584    HA   PHE  77           HA       PHE  77   3.138  -6.351  -1.054
  585   1HB   PHE  77          1HB       PHE  77   5.300  -5.687  -2.165
  586   2HB   PHE  77          2HB       PHE  77   5.317  -4.253  -1.147
  587    HD1  PHE  77           HD1      PHE  77   5.992  -4.364   1.131
  588    HD2  PHE  77           HD2      PHE  77   5.518  -7.926  -1.150
  589    HE1  PHE  77           HE1      PHE  77   7.117  -5.645   2.905
  590    HE2  PHE  77           HE2      PHE  77   6.643  -9.212   0.620
  591    HZ   PHE  77           HZ       PHE  77   7.443  -8.071   2.651
  592    H    ILE  78           H        ILE  78   2.215  -6.260   0.865
  593    HA   ILE  78           HA       ILE  78   1.774  -3.634   2.107
  594    HB   ILE  78           HB       ILE  78   0.409  -6.268   2.703
  595   1HG1  ILE  78          1HG1      ILE  78  -0.167  -5.431   0.462
  596   2HG1  ILE  78          2HG1      ILE  78  -1.543  -5.330   1.554
  597   1HG2  ILE  78          1HG2      ILE  78   0.449  -4.795   4.628
  598   2HG2  ILE  78          2HG2      ILE  78  -0.199  -3.473   3.657
  599   3HG2  ILE  78          3HG2      ILE  78  -1.186  -4.901   3.975
  600   1HD1  ILE  78          1HD1      ILE  78  -1.371  -3.360   0.143
  601   2HD1  ILE  78          2HD1      ILE  78  -1.143  -2.947   1.842
  602   3HD1  ILE  78          3HD1      ILE  78   0.250  -3.045   0.765
  603    H    TYR  79           H        TYR  79   3.197  -3.126   3.662
  604    HA   TYR  79           HA       TYR  79   4.251  -5.297   5.340
  605   1HB   TYR  79          1HB       TYR  79   5.934  -3.808   4.291
  606   2HB   TYR  79          2HB       TYR  79   5.209  -2.431   5.113
  607    HD1  TYR  79           HD1      TYR  79   7.167  -5.516   5.574
  608    HD2  TYR  79           HD2      TYR  79   5.615  -2.027   7.449
  609    HE1  TYR  79           HE1      TYR  79   8.605  -5.932   7.525
  610    HE2  TYR  79           HE2      TYR  79   7.051  -2.430   9.401
  611    HH   TYR  79           HH       TYR  79   8.192  -4.350  10.482
  612    H    LYS  80           H        LYS  80   3.492  -5.542   7.347
  613    HA   LYS  80           HA       LYS  80   1.553  -3.638   8.348
  614   1HB   LYS  80          1HB       LYS  80   2.575  -6.170   9.645
  615   2HB   LYS  80          2HB       LYS  80   1.154  -5.252  10.122
  616   1HG   LYS  80          1HG       LYS  80   0.154  -5.752   7.911
  617   2HG   LYS  80          2HG       LYS  80   1.545  -6.780   7.560
  618   1HD   LYS  80          1HD       LYS  80   0.993  -8.106   9.595
  619   2HD   LYS  80          2HD       LYS  80  -0.474  -7.139   9.770
  620   1HE   LYS  80          1HE       LYS  80  -1.082  -9.150   8.655
  621   2HE   LYS  80          2HE       LYS  80  -1.113  -7.856   7.461
  622   1HZ   LYS  80          1HZ       LYS  80  -0.048  -9.736   6.497
  623   2HZ   LYS  80          2HZ       LYS  80   1.153  -8.576   6.783
  624   3HZ   LYS  80          3HZ       LYS  80   0.998  -9.910   7.820
  625    H    MET  81           H        MET  81   2.597  -1.811   8.969
  626    HA   MET  81           HA       MET  81   5.102  -1.856  10.319
  627   1HB   MET  81          1HB       MET  81   4.444   0.005   8.861
  628   2HB   MET  81          2HB       MET  81   3.150   0.421   9.978
  629   1HG   MET  81          1HG       MET  81   4.849   0.832  11.726
  630   2HG   MET  81          2HG       MET  81   6.105   0.527  10.528
  631   1HE   MET  81          1HE       MET  81   4.616   1.826   7.952
  632   2HE   MET  81          2HE       MET  81   6.341   2.009   8.273
  633   3HE   MET  81          3HE       MET  81   5.348   3.430   7.947
  634    H    GLU  82           H        GLU  82   1.942  -0.593  11.370
  635    HA   GLU  82           HA       GLU  82   2.402  -1.580  14.083
  636   1HB   GLU  82          1HB       GLU  82   2.122   1.320  13.319
  637   2HB   GLU  82          2HB       GLU  82   1.626   0.751  14.906
  638   1HG   GLU  82          1HG       GLU  82   4.380   0.251  13.834
  639   2HG   GLU  82          2HG       GLU  82   3.956   1.738  14.681
  640    H    GLY  83           H        GLY  83   0.372  -1.137  15.454
  641   1HA   GLY  83          1HA       GLY  83  -1.892  -1.455  15.736
  642   2HA   GLY  83          2HA       GLY  83  -2.100  -0.532  14.253
  643    H    CYS  84           H        CYS  84  -0.247  -3.467  14.338
  644    HA   CYS  84           HA       CYS  84  -2.437  -4.904  13.002
  645   1HB   CYS  84          1HB       CYS  84   0.456  -4.895  12.108
  646   2HB   CYS  84          2HB       CYS  84  -0.853  -5.809  11.369
  647    HG   CYS  84           HG       CYS  84  -0.648  -2.390  11.433
  648    H    ASN  85           H        ASN  85  -0.154  -4.800  15.415
  649    HA   ASN  85           HA       ASN  85  -0.368  -7.703  15.838
  650   1HB   ASN  85          1HB       ASN  85   2.044  -5.973  16.457
  651   2HB   ASN  85          2HB       ASN  85   1.876  -7.673  16.881
  652   1HD2  ASN  85          2HD2      ASN  85   2.561  -5.395  14.388
  653   2HD2  ASN  85          1HD2      ASN  85   3.006  -6.542  13.175
  Start of MODEL   16
    1    H    MET   1           H        MET   1  14.766  -0.239  -9.825
    2    HA   MET   1           HA       MET   1  12.076   0.610 -10.727
    3   1HB   MET   1          1HB       MET   1  12.247  -1.820 -10.625
    4   2HB   MET   1          2HB       MET   1  12.951  -1.729  -9.018
    5   1HG   MET   1          1HG       MET   1  10.861  -0.817  -8.150
    6   2HG   MET   1          2HG       MET   1  10.156  -0.897  -9.764
    7   1HE   MET   1          1HE       MET   1   8.964  -2.233  -7.036
    8   2HE   MET   1          2HE       MET   1   8.364  -3.757  -7.688
    9   3HE   MET   1          3HE       MET   1   8.123  -2.259  -8.585
   10    H    GLN   2           H        GLN   2  10.820   1.616  -9.166
   11    HA   GLN   2           HA       GLN   2  12.126   2.242  -6.607
   12   1HB   GLN   2          1HB       GLN   2  11.224   4.515  -6.711
   13   2HB   GLN   2          2HB       GLN   2  12.289   4.210  -8.076
   14   1HG   GLN   2          1HG       GLN   2  10.434   3.950  -9.555
   15   2HG   GLN   2          2HG       GLN   2   9.292   3.996  -8.214
   16   1HE2  GLN   2          2HE2      GLN   2  12.071   6.095  -8.437
   17   2HE2  GLN   2          1HE2      GLN   2  11.180   7.554  -8.709
   18    H    ILE   3           H        ILE   3  10.677   2.534  -4.844
   19    HA   ILE   3           HA       ILE   3   7.990   1.458  -5.381
   20    HB   ILE   3           HB       ILE   3   7.927   0.970  -2.912
   21   1HG1  ILE   3          1HG1      ILE   3  10.915   1.419  -3.117
   22   2HG1  ILE   3          2HG1      ILE   3   9.798   2.502  -2.297
   23   1HG2  ILE   3          1HG2      ILE   3   9.240  -1.088  -3.135
   24   2HG2  ILE   3          2HG2      ILE   3   8.273  -0.760  -4.572
   25   3HG2  ILE   3          3HG2      ILE   3  10.005  -0.432  -4.582
   26   1HD1  ILE   3          1HD1      ILE   3   9.222   0.703  -0.738
   27   2HD1  ILE   3          2HD1      ILE   3  10.376  -0.353  -1.549
   28   3HD1  ILE   3          3HD1      ILE   3  10.942   1.090  -0.707
   29    H    HIS   4           H        HIS   4   6.258   2.640  -4.998
   30    HA   HIS   4           HA       HIS   4   6.586   5.250  -3.723
   31   1HB   HIS   4          1HB       HIS   4   4.366   4.031  -5.367
   32   2HB   HIS   4          2HB       HIS   4   4.158   5.539  -4.481
   33    HD1  HIS   4           HD1      HIS   4   4.480   7.494  -5.928
   34    HD2  HIS   4           HD2      HIS   4   6.894   4.322  -7.089
   35    HE1  HIS   4           HE1      HIS   4   5.772   8.324  -7.910
   36    HE2  HIS   4           HE2      HIS   4   7.402   6.475  -8.427
   37    H    VAL   5           H        VAL   5   6.389   5.246  -1.605
   38    HA   VAL   5           HA       VAL   5   4.936   3.109  -0.290
   39    HB   VAL   5           HB       VAL   5   6.501   5.388   0.930
   40   1HG1  VAL   5          1HG1      VAL   5   4.880   4.421   2.471
   41   2HG1  VAL   5          2HG1      VAL   5   5.504   2.807   2.132
   42   3HG1  VAL   5          3HG1      VAL   5   6.524   3.994   2.946
   43   1HG2  VAL   5          1HG2      VAL   5   7.339   2.544   0.364
   44   2HG2  VAL   5          2HG2      VAL   5   7.918   3.984  -0.473
   45   3HG2  VAL   5          3HG2      VAL   5   8.293   3.746   1.234
   46    H    TYR   6           H        TYR   6   2.824   3.347  -0.184
   47    HA   TYR   6           HA       TYR   6   1.697   5.954   0.550
   48   1HB   TYR   6          1HB       TYR   6   0.444   3.440  -0.566
   49   2HB   TYR   6          2HB       TYR   6  -0.506   4.797   0.026
   50    HD1  TYR   6           HD1      TYR   6  -1.083   6.517  -1.420
   51    HD2  TYR   6           HD2      TYR   6   2.168   3.970  -2.443
   52    HE1  TYR   6           HE1      TYR   6  -0.939   7.594  -3.625
   53    HE2  TYR   6           HE2      TYR   6   2.320   5.041  -4.651
   54    HH   TYR   6           HH       TYR   6   0.639   7.942  -5.396
   55    H    ASP   7           H        ASP   7   1.934   6.117   2.734
   56    HA   ASP   7           HA       ASP   7   1.499   3.920   4.510
   57   1HB   ASP   7          1HB       ASP   7   2.931   5.985   4.986
   58   2HB   ASP   7          2HB       ASP   7   1.421   6.845   5.264
   59    H    THR   8           H        THR   8  -0.441   3.054   4.670
   60    HA   THR   8           HA       THR   8  -2.794   4.754   4.307
   61    HB   THR   8           HB       THR   8  -2.703   1.738   4.449
   62    HG1  THR   8           HG1      THR   8  -1.434   2.885   2.699
   63   1HG2  THR   8          1HG2      THR   8  -4.917   2.733   4.788
   64   2HG2  THR   8          2HG2      THR   8  -4.737   3.656   3.295
   65   3HG2  THR   8          3HG2      THR   8  -4.833   1.896   3.239
   66    H    TYR   9           H        TYR   9  -3.395   5.657   6.175
   67    HA   TYR   9           HA       TYR   9  -3.102   4.251   8.691
   68   1HB   TYR   9          1HB       TYR   9  -4.431   6.916   8.131
   69   2HB   TYR   9          2HB       TYR   9  -3.958   6.296   9.706
   70    HD1  TYR   9           HD1      TYR   9  -1.585   6.233  10.351
   71    HD2  TYR   9           HD2      TYR   9  -2.825   7.906   6.641
   72    HE1  TYR   9           HE1      TYR   9   0.595   7.348  10.132
   73    HE2  TYR   9           HE2      TYR   9  -0.646   9.021   6.409
   74    HH   TYR   9           HH       TYR   9   1.187   9.797   7.863
   75    H    VAL  10           H        VAL  10  -4.515   2.595   8.876
   76    HA   VAL  10           HA       VAL  10  -7.351   3.154   8.333
   77    HB   VAL  10           HB       VAL  10  -5.964   0.474   8.573
   78   1HG1  VAL  10          1HG1      VAL  10  -8.804   1.148   7.806
   79   2HG1  VAL  10          2HG1      VAL  10  -8.081  -0.460   7.761
   80   3HG1  VAL  10          3HG1      VAL  10  -8.285   0.372   9.303
   81   1HG2  VAL  10          1HG2      VAL  10  -5.314   1.648   6.544
   82   2HG2  VAL  10          2HG2      VAL  10  -6.361   0.279   6.163
   83   3HG2  VAL  10          3HG2      VAL  10  -7.010   1.920   6.142
   84    H    LYS  11           H        LYS  11  -8.403   3.711  10.126
   85    HA   LYS  11           HA       LYS  11  -7.574   2.859  12.726
   86   1HB   LYS  11          1HB       LYS  11 -10.145   4.187  11.834
   87   2HB   LYS  11          2HB       LYS  11  -9.648   3.963  13.507
   88   1HG   LYS  11          1HG       LYS  11  -7.672   5.362  13.093
   89   2HG   LYS  11          2HG       LYS  11  -8.214   5.613  11.434
   90   1HD   LYS  11          1HD       LYS  11  -8.828   7.518  12.796
   91   2HD   LYS  11          2HD       LYS  11 -10.280   6.652  12.295
   92   1HE   LYS  11          1HE       LYS  11 -10.391   5.558  14.472
   93   2HE   LYS  11          2HE       LYS  11  -8.918   6.389  14.973
   94   1HZ   LYS  11          1HZ       LYS  11 -11.471   7.723  14.239
   95   2HZ   LYS  11          2HZ       LYS  11 -10.917   7.466  15.820
   96   3HZ   LYS  11          3HZ       LYS  11 -10.061   8.497  14.779
   97    H    ALA  12           H        ALA  12  -7.607   0.718  12.960
   98    HA   ALA  12           HA       ALA  12  -9.377  -1.065  11.735
   99   1HB   ALA  12          1HB       ALA  12  -7.174  -1.709  12.578
  100   2HB   ALA  12          2HB       ALA  12  -7.737  -1.473  14.232
  101   3HB   ALA  12          3HB       ALA  12  -8.442  -2.745  13.234
  102    H    LYS  13           H        LYS  13 -11.004  -2.403  12.643
  103    HA   LYS  13           HA       LYS  13 -12.931  -0.874  14.077
  104   1HB   LYS  13          1HB       LYS  13 -13.488  -2.553  12.335
  105   2HB   LYS  13          2HB       LYS  13 -12.947  -3.825  13.420
  106   1HG   LYS  13          1HG       LYS  13 -15.347  -3.667  13.449
  107   2HG   LYS  13          2HG       LYS  13 -14.694  -3.194  15.015
  108   1HD   LYS  13          1HD       LYS  13 -14.922  -0.828  14.378
  109   2HD   LYS  13          2HD       LYS  13 -15.620  -1.324  12.835
  110   1HE   LYS  13          1HE       LYS  13 -17.356  -0.682  14.427
  111   2HE   LYS  13          2HE       LYS  13 -17.476  -2.389  14.002
  112   1HZ   LYS  13          1HZ       LYS  13 -16.358  -2.945  16.079
  113   2HZ   LYS  13          2HZ       LYS  13 -16.248  -1.302  16.481
  114   3HZ   LYS  13          3HZ       LYS  13 -17.765  -2.048  16.376
  115    H    ASP  14           H        ASP  14 -10.557  -3.225  14.948
  116    HA   ASP  14           HA       ASP  14 -11.474  -3.887  17.527
  117   1HB   ASP  14          1HB       ASP  14  -9.677  -5.133  16.415
  118   2HB   ASP  14          2HB       ASP  14  -8.632  -3.717  16.494
  119    H    GLY  15           H        GLY  15  -9.887  -1.066  16.259
  120   1HA   GLY  15          1HA       GLY  15 -10.160   1.022  17.431
  121   2HA   GLY  15          2HA       GLY  15 -10.039   0.135  18.943
  122    H    HIS  16           H        HIS  16  -7.951  -0.068  16.096
  123    HA   HIS  16           HA       HIS  16  -5.781   1.177  17.631
  124   1HB   HIS  16          1HB       HIS  16  -5.675  -1.368  17.731
  125   2HB   HIS  16          2HB       HIS  16  -5.401  -1.339  15.996
  126    HD1  HIS  16           HD1      HIS  16  -3.722  -0.815  19.255
  127    HD2  HIS  16           HD2      HIS  16  -2.843  -0.360  15.215
  128    HE1  HIS  16           HE1      HIS  16  -1.231  -0.509  19.133
  129    HE2  HIS  16           HE2      HIS  16  -0.707  -0.526  16.670
  130    H    VAL  17           H        VAL  17  -4.272   2.291  16.348
  131    HA   VAL  17           HA       VAL  17  -5.231   3.043  13.734
  132    HB   VAL  17           HB       VAL  17  -2.618   3.817  15.052
  133   1HG1  VAL  17          1HG1      VAL  17  -2.684   5.725  13.508
  134   2HG1  VAL  17          2HG1      VAL  17  -2.623   4.186  12.648
  135   3HG1  VAL  17          3HG1      VAL  17  -4.145   5.069  12.770
  136   1HG2  VAL  17          1HG2      VAL  17  -3.759   5.881  15.714
  137   2HG2  VAL  17          2HG2      VAL  17  -5.274   5.249  15.069
  138   3HG2  VAL  17          3HG2      VAL  17  -4.506   4.463  16.449
  139    H    MET  18           H        MET  18  -5.150   1.143  12.585
  140    HA   MET  18           HA       MET  18  -2.655  -0.310  12.344
  141   1HB   MET  18          1HB       MET  18  -4.739  -1.571  12.534
  142   2HB   MET  18          2HB       MET  18  -5.379  -0.769  11.109
  143   1HG   MET  18          1HG       MET  18  -3.723  -1.839   9.717
  144   2HG   MET  18          2HG       MET  18  -2.967  -2.569  11.132
  145   1HE   MET  18          1HE       MET  18  -3.106  -4.981  10.007
  146   2HE   MET  18          2HE       MET  18  -3.829  -4.244   8.577
  147   3HE   MET  18          3HE       MET  18  -4.589  -5.648   9.325
  148    H    HIS  19           H        HIS  19  -1.315   1.114  11.267
  149    HA   HIS  19           HA       HIS  19  -2.145   1.715   8.512
  150   1HB   HIS  19          1HB       HIS  19  -0.856   3.700   8.498
  151   2HB   HIS  19          2HB       HIS  19  -1.742   3.721  10.013
  152    HD1  HIS  19           HD1      HIS  19   1.422   4.509   8.744
  153    HD2  HIS  19           HD2      HIS  19   0.106   2.535  12.163
  154    HE1  HIS  19           HE1      HIS  19   3.335   4.624  10.375
  155    HE2  HIS  19           HE2      HIS  19   2.619   3.166  12.308
  156    H    PHE  20           H        PHE  20  -0.851   1.134   6.867
  157    HA   PHE  20           HA       PHE  20   1.565  -0.381   7.545
  158   1HB   PHE  20          1HB       PHE  20   0.784  -2.100   5.830
  159   2HB   PHE  20          2HB       PHE  20  -0.059  -2.092   7.375
  160    HD1  PHE  20           HD1      PHE  20  -2.365  -1.404   7.533
  161    HD2  PHE  20           HD2      PHE  20  -0.323  -1.358   3.797
  162    HE1  PHE  20           HE1      PHE  20  -4.518  -1.180   6.364
  163    HE2  PHE  20           HE2      PHE  20  -2.474  -1.132   2.622
  164    HZ   PHE  20           HZ       PHE  20  -4.573  -1.042   3.906
  165    H    ASP  21           H        ASP  21   2.767  -1.014   5.489
  166    HA   ASP  21           HA       ASP  21   2.976   1.413   3.864
  167   1HB   ASP  21          1HB       ASP  21   4.839  -0.954   4.163
  168   2HB   ASP  21          2HB       ASP  21   5.142   0.418   3.109
  169    H    VAL  22           H        VAL  22   1.800   1.398   2.064
  170    HA   VAL  22           HA       VAL  22   1.424  -1.075   0.569
  171    HB   VAL  22           HB       VAL  22   0.424   1.715  -0.051
  172   1HG1  VAL  22          1HG1      VAL  22  -0.320  -0.946  -1.264
  173   2HG1  VAL  22          2HG1      VAL  22  -1.080   0.602  -1.630
  174   3HG1  VAL  22          3HG1      VAL  22   0.610   0.329  -2.050
  175   1HG2  VAL  22          1HG2      VAL  22  -0.539   0.845   2.009
  176   2HG2  VAL  22          2HG2      VAL  22  -1.748   0.896   0.726
  177   3HG2  VAL  22          3HG2      VAL  22  -1.005  -0.639   1.176
  178    H    PHE  23           H        PHE  23   3.301  -1.621  -0.395
  179    HA   PHE  23           HA       PHE  23   4.911   0.393  -1.730
  180   1HB   PHE  23          1HB       PHE  23   5.268  -2.606  -1.528
  181   2HB   PHE  23          2HB       PHE  23   6.433  -1.491  -2.232
  182    HD1  PHE  23           HD1      PHE  23   5.503  -3.228   0.662
  183    HD2  PHE  23           HD2      PHE  23   7.213   0.444  -0.636
  184    HE1  PHE  23           HE1      PHE  23   6.539  -2.934   2.873
  185    HE2  PHE  23           HE2      PHE  23   8.255   0.744   1.573
  186    HZ   PHE  23           HZ       PHE  23   7.919  -0.947   3.330
  187    H    THR  24           H        THR  24   4.171   1.088  -3.631
  188    HA   THR  24           HA       THR  24   3.350  -0.946  -5.596
  189    HB   THR  24           HB       THR  24   1.838   0.840  -6.573
  190    HG1  THR  24           HG1      THR  24   2.187   2.012  -3.994
  191   1HG2  THR  24          1HG2      THR  24   0.014   0.407  -4.998
  192   2HG2  THR  24          2HG2      THR  24   0.950  -1.056  -5.310
  193   3HG2  THR  24          3HG2      THR  24   1.177  -0.166  -3.803
  194    H    ASP  25           H        ASP  25   4.261  -0.794  -7.589
  195    HA   ASP  25           HA       ASP  25   6.092   1.453  -8.070
  196   1HB   ASP  25          1HB       ASP  25   7.228   0.083  -9.624
  197   2HB   ASP  25          2HB       ASP  25   6.822  -1.005  -8.301
  198    H    VAL  26           H        VAL  26   3.016   0.408  -8.767
  199    HA   VAL  26           HA       VAL  26   2.647   1.007 -11.462
  200    HB   VAL  26           HB       VAL  26   0.995  -0.207 -10.105
  201   1HG1  VAL  26          1HG1      VAL  26  -0.547   0.995  -8.636
  202   2HG1  VAL  26          2HG1      VAL  26   1.117   1.089  -8.056
  203   3HG1  VAL  26          3HG1      VAL  26   0.386   2.473  -8.870
  204   1HG2  VAL  26          1HG2      VAL  26   0.279   0.757 -12.213
  205   2HG2  VAL  26          2HG2      VAL  26  -1.029   0.829 -11.034
  206   3HG2  VAL  26          3HG2      VAL  26  -0.102   2.281 -11.411
  207    H    ARG  27           H        ARG  27   2.849   3.098  -8.680
  208    HA   ARG  27           HA       ARG  27   3.198   5.337  -8.508
  209   1HB   ARG  27          1HB       ARG  27   4.589   4.870 -10.603
  210   2HB   ARG  27          2HB       ARG  27   3.220   5.475 -11.520
  211   1HG   ARG  27          1HG       ARG  27   3.422   7.633 -10.384
  212   2HG   ARG  27          2HG       ARG  27   4.809   7.019  -9.481
  213   1HD   ARG  27          1HD       ARG  27   4.576   7.518 -12.436
  214   2HD   ARG  27          2HD       ARG  27   5.707   8.240 -11.291
  215    HE   ARG  27           HE       ARG  27   5.792   5.384 -12.040
  216   1HH1  ARG  27          1HH1      ARG  27   7.392   8.422 -11.361
  217   2HH1  ARG  27          2HH1      ARG  27   8.988   7.794 -11.657
  218   1HH2  ARG  27          1HH2      ARG  27   7.851   4.548 -12.415
  219   2HH2  ARG  27          2HH2      ARG  27   9.253   5.576 -12.268
  220    H    ASP  28           H        ASP  28   0.554   4.078  -8.903
  221    HA   ASP  28           HA       ASP  28  -0.966   6.413  -9.859
  222   1HB   ASP  28          1HB       ASP  28  -1.229   4.291 -11.189
  223   2HB   ASP  28          2HB       ASP  28  -1.924   3.545  -9.756
  224    H    ASP  29           H        ASP  29  -2.037   7.477  -8.348
  225    HA   ASP  29           HA       ASP  29  -1.904   6.762  -5.626
  226   1HB   ASP  29          1HB       ASP  29  -2.053   9.095  -6.471
  227   2HB   ASP  29          2HB       ASP  29  -3.723   8.797  -6.935
  228    H    LYS  30           H        LYS  30  -4.583   6.733  -7.933
  229    HA   LYS  30           HA       LYS  30  -6.550   5.876  -6.090
  230   1HB   LYS  30          1HB       LYS  30  -7.198   7.007  -8.110
  231   2HB   LYS  30          2HB       LYS  30  -6.416   5.789  -9.106
  232   1HG   LYS  30          1HG       LYS  30  -8.053   4.140  -8.425
  233   2HG   LYS  30          2HG       LYS  30  -8.814   5.315  -7.348
  234   1HD   LYS  30          1HD       LYS  30  -9.475   6.683  -9.192
  235   2HD   LYS  30          2HD       LYS  30  -8.526   5.714 -10.322
  236   1HE   LYS  30          1HE       LYS  30 -10.868   4.680  -8.731
  237   2HE   LYS  30          2HE       LYS  30 -10.969   5.254 -10.394
  238   1HZ   LYS  30          1HZ       LYS  30  -9.264   3.000  -9.483
  239   2HZ   LYS  30          2HZ       LYS  30 -10.765   2.834 -10.246
  240   3HZ   LYS  30          3HZ       LYS  30  -9.459   3.526 -11.081
  241    H    LYS  31           H        LYS  31  -4.395   4.183  -8.304
  242    HA   LYS  31           HA       LYS  31  -5.569   1.622  -8.024
  243   1HB   LYS  31          1HB       LYS  31  -4.043   2.292  -9.864
  244   2HB   LYS  31          2HB       LYS  31  -2.710   2.304  -8.718
  245   1HG   LYS  31          1HG       LYS  31  -2.728   0.267 -10.042
  246   2HG   LYS  31          2HG       LYS  31  -2.997  -0.080  -8.334
  247   1HD   LYS  31          1HD       LYS  31  -4.489  -1.411  -9.715
  248   2HD   LYS  31          2HD       LYS  31  -5.409  -0.249  -8.760
  249   1HE   LYS  31          1HE       LYS  31  -5.613   1.212 -10.688
  250   2HE   LYS  31          2HE       LYS  31  -4.613   0.119 -11.646
  251   1HZ   LYS  31          1HZ       LYS  31  -7.223  -0.629 -10.436
  252   2HZ   LYS  31          2HZ       LYS  31  -7.017  -0.139 -12.050
  253   3HZ   LYS  31          3HZ       LYS  31  -6.286  -1.565 -11.496
  254    H    ALA  32           H        ALA  32  -2.932   3.243  -6.300
  255    HA   ALA  32           HA       ALA  32  -2.145   1.084  -4.687
  256   1HB   ALA  32          1HB       ALA  32  -2.092   4.028  -4.019
  257   2HB   ALA  32          2HB       ALA  32  -1.169   2.762  -3.209
  258   3HB   ALA  32          3HB       ALA  32  -0.842   3.148  -4.899
  259    H    ILE  33           H        ILE  33  -4.538   3.640  -4.135
  260    HA   ILE  33           HA       ILE  33  -5.396   2.729  -1.599
  261    HB   ILE  33           HB       ILE  33  -6.871   4.371  -3.664
  262   1HG1  ILE  33          1HG1      ILE  33  -5.300   5.190  -1.211
  263   2HG1  ILE  33          2HG1      ILE  33  -4.758   5.364  -2.877
  264   1HG2  ILE  33          1HG2      ILE  33  -7.477   3.948  -0.741
  265   2HG2  ILE  33          2HG2      ILE  33  -8.290   5.104  -1.796
  266   3HG2  ILE  33          3HG2      ILE  33  -8.439   3.374  -2.103
  267   1HD1  ILE  33          1HD1      ILE  33  -6.604   6.904  -3.305
  268   2HD1  ILE  33          2HD1      ILE  33  -7.122   6.738  -1.627
  269   3HD1  ILE  33          3HD1      ILE  33  -5.561   7.468  -1.999
  270    H    GLU  34           H        GLU  34  -6.441   2.040  -4.885
  271    HA   GLU  34           HA       GLU  34  -8.742   0.557  -4.342
  272   1HB   GLU  34          1HB       GLU  34  -8.054   1.362  -6.576
  273   2HB   GLU  34          2HB       GLU  34  -6.757   0.179  -6.590
  274   1HG   GLU  34          1HG       GLU  34  -8.309  -1.629  -6.660
  275   2HG   GLU  34          2HG       GLU  34  -9.669  -0.536  -6.399
  276    H    PHE  35           H        PHE  35  -5.352  -0.452  -4.554
  277    HA   PHE  35           HA       PHE  35  -5.845  -3.205  -4.072
  278   1HB   PHE  35          1HB       PHE  35  -3.369  -1.514  -3.733
  279   2HB   PHE  35          2HB       PHE  35  -3.393  -3.246  -3.424
  280    HD1  PHE  35           HD1      PHE  35  -5.124  -4.172  -5.639
  281    HD2  PHE  35           HD2      PHE  35  -1.980  -1.307  -5.576
  282    HE1  PHE  35           HE1      PHE  35  -4.670  -4.625  -8.015
  283    HE2  PHE  35           HE2      PHE  35  -1.525  -1.748  -7.951
  284    HZ   PHE  35           HZ       PHE  35  -2.868  -3.412  -9.175
  285    H    ALA  36           H        ALA  36  -5.184  -0.457  -1.970
  286    HA   ALA  36           HA       ALA  36  -4.862  -1.889   0.430
  287   1HB   ALA  36          1HB       ALA  36  -4.236   0.463   0.197
  288   2HB   ALA  36          2HB       ALA  36  -5.937   0.903   0.041
  289   3HB   ALA  36          3HB       ALA  36  -5.337   0.225   1.554
  290    H    LYS  37           H        LYS  37  -7.731  -0.543  -1.148
  291    HA   LYS  37           HA       LYS  37  -9.581  -1.121   0.878
  292   1HB   LYS  37          1HB       LYS  37  -9.934  -0.874  -2.107
  293   2HB   LYS  37          2HB       LYS  37 -11.279  -1.092  -0.995
  294   1HG   LYS  37          1HG       LYS  37 -10.582   0.989   0.165
  295   2HG   LYS  37          2HG       LYS  37  -9.363   1.224  -1.090
  296   1HD   LYS  37          1HD       LYS  37 -11.078   1.341  -2.790
  297   2HD   LYS  37          2HD       LYS  37 -12.326   0.967  -1.599
  298   1HE   LYS  37          1HE       LYS  37 -11.733   3.048  -0.396
  299   2HE   LYS  37          2HE       LYS  37 -10.592   3.431  -1.685
  300   1HZ   LYS  37          1HZ       LYS  37 -13.514   3.045  -2.074
  301   2HZ   LYS  37          2HZ       LYS  37 -12.750   4.553  -1.934
  302   3HZ   LYS  37          3HZ       LYS  37 -12.396   3.541  -3.250
  303    H    GLN  38           H        GLN  38  -8.658  -3.047  -1.982
  304    HA   GLN  38           HA       GLN  38 -10.476  -5.145  -1.383
  305   1HB   GLN  38          1HB       GLN  38  -9.316  -6.434  -3.108
  306   2HB   GLN  38          2HB       GLN  38  -9.681  -4.807  -3.657
  307   1HG   GLN  38          1HG       GLN  38  -7.390  -4.136  -3.323
  308   2HG   GLN  38          2HG       GLN  38  -6.998  -5.714  -2.641
  309   1HE2  GLN  38          2HE2      GLN  38  -6.818  -7.490  -3.998
  310   2HE2  GLN  38          1HE2      GLN  38  -6.685  -7.327  -5.714
  311    H    TRP  39           H        TRP  39  -7.320  -4.386  -0.221
  312    HA   TRP  39           HA       TRP  39  -6.759  -7.029   0.754
  313   1HB   TRP  39          1HB       TRP  39  -4.967  -5.364   0.253
  314   2HB   TRP  39          2HB       TRP  39  -5.530  -4.398   1.612
  315    HD1  TRP  39           HD1      TRP  39  -3.971  -7.870   0.915
  316    HE1  TRP  39           HE1      TRP  39  -2.653  -8.597   3.009
  317    HE3  TRP  39           HE3      TRP  39  -5.194  -3.999   4.023
  318    HZ2  TRP  39           HZ2      TRP  39  -2.199  -7.649   5.620
  319    HZ3  TRP  39           HZ3      TRP  39  -4.271  -3.985   6.304
  320    HH2  TRP  39           HH2      TRP  39  -2.804  -5.773   7.084
  321    H    LEU  40           H        LEU  40  -8.115  -4.046   2.063
  322    HA   LEU  40           HA       LEU  40  -8.318  -4.939   4.741
  323   1HB   LEU  40          1HB       LEU  40  -9.817  -2.797   3.243
  324   2HB   LEU  40          2HB       LEU  40  -9.985  -3.078   4.967
  325    HG   LEU  40           HG       LEU  40  -7.433  -2.275   3.564
  326   1HD1  LEU  40          1HD1      LEU  40  -9.080  -0.483   3.621
  327   2HD1  LEU  40          2HD1      LEU  40  -9.281  -0.713   5.359
  328   3HD1  LEU  40          3HD1      LEU  40  -7.739  -0.148   4.716
  329   1HD2  LEU  40          1HD2      LEU  40  -8.047  -2.637   6.495
  330   2HD2  LEU  40          2HD2      LEU  40  -7.006  -3.669   5.516
  331   3HD2  LEU  40          3HD2      LEU  40  -6.546  -1.996   5.829
  332    H    SER  41           H        SER  41 -10.624  -4.949   2.034
  333    HA   SER  41           HA       SER  41 -12.727  -6.123   3.553
  334   1HB   SER  41          1HB       SER  41 -13.659  -6.647   1.229
  335   2HB   SER  41          2HB       SER  41 -13.369  -4.946   1.594
  336    HG   SER  41           HG       SER  41 -12.433  -5.200  -0.341
  337    H    SER  42           H        SER  42  -9.933  -7.349   1.969
  338    HA   SER  42           HA       SER  42 -10.767 -10.055   1.731
  339   1HB   SER  42          1HB       SER  42  -8.926  -9.111   0.397
  340   2HB   SER  42          2HB       SER  42  -7.982  -8.872   1.865
  341    HG   SER  42           HG       SER  42  -7.274 -10.798   1.478
  342    H    ILE  43           H        ILE  43  -9.152  -8.178   4.256
  343    HA   ILE  43           HA       ILE  43  -8.829 -10.574   5.888
  344    HB   ILE  43           HB       ILE  43  -7.697  -9.111   7.517
  345   1HG1  ILE  43          1HG1      ILE  43  -8.106  -6.933   5.455
  346   2HG1  ILE  43          2HG1      ILE  43  -8.942  -7.030   6.999
  347   1HG2  ILE  43          1HG2      ILE  43  -6.409 -10.233   5.795
  348   2HG2  ILE  43          2HG2      ILE  43  -6.677  -8.886   4.689
  349   3HG2  ILE  43          3HG2      ILE  43  -5.713  -8.652   6.149
  350   1HD1  ILE  43          1HD1      ILE  43  -7.123  -5.435   7.085
  351   2HD1  ILE  43          2HD1      ILE  43  -6.811  -6.794   8.164
  352   3HD1  ILE  43          3HD1      ILE  43  -5.979  -6.690   6.613
  353    H    GLY  44           H        GLY  44 -11.020  -7.936   5.543
  354   1HA   GLY  44          1HA       GLY  44 -13.245  -8.291   6.422
  355   2HA   GLY  44          2HA       GLY  44 -12.516  -9.035   7.835
  356    H    GLU  45           H        GLU  45 -10.626  -6.444   7.236
  357    HA   GLU  45           HA       GLU  45 -12.007  -4.875   9.262
  358   1HB   GLU  45          1HB       GLU  45  -9.223  -4.792   8.133
  359   2HB   GLU  45          2HB       GLU  45  -9.855  -3.469   9.104
  360   1HG   GLU  45          1HG       GLU  45  -9.619  -6.340   9.977
  361   2HG   GLU  45          2HG       GLU  45  -8.542  -5.022  10.440
  362    H    GLU  46           H        GLU  46 -13.607  -4.624   7.346
  363    HA   GLU  46           HA       GLU  46 -12.883  -2.383   5.621
  364   1HB   GLU  46          1HB       GLU  46 -14.155  -4.435   4.803
  365   2HB   GLU  46          2HB       GLU  46 -15.525  -3.846   5.733
  366   1HG   GLU  46          1HG       GLU  46 -15.523  -1.783   4.411
  367   2HG   GLU  46          2HG       GLU  46 -14.171  -2.403   3.465
  368    H    GLY  47           H        GLY  47 -12.867  -1.738   8.280
  369   1HA   GLY  47          1HA       GLY  47 -15.408  -0.325   8.754
  370   2HA   GLY  47          2HA       GLY  47 -14.212  -0.704   9.987
  371    H    ALA  48           H        ALA  48 -13.490   0.616   6.824
  372    HA   ALA  48           HA       ALA  48 -13.097   3.282   7.872
  373   1HB   ALA  48          1HB       ALA  48 -10.741   1.683   6.875
  374   2HB   ALA  48          2HB       ALA  48 -10.724   3.385   7.338
  375   3HB   ALA  48          3HB       ALA  48 -11.036   2.146   8.552
  376    H    THR  49           H        THR  49 -13.596   4.698   6.347
  377    HA   THR  49           HA       THR  49 -13.835   3.910   3.582
  378    HB   THR  49           HB       THR  49 -14.023   6.708   4.716
  379    HG1  THR  49           HG1      THR  49 -15.487   5.283   5.799
  380   1HG2  THR  49          1HG2      THR  49 -13.868   6.584   2.283
  381   2HG2  THR  49          2HG2      THR  49 -15.206   5.436   2.245
  382   3HG2  THR  49          3HG2      THR  49 -15.482   7.093   2.778
  383    H    VAL  50           H        VAL  50 -11.905   3.539   2.617
  384    HA   VAL  50           HA       VAL  50  -9.578   5.074   3.379
  385    HB   VAL  50           HB       VAL  50  -9.790   2.941   1.250
  386   1HG1  VAL  50          1HG1      VAL  50  -7.804   4.344   1.055
  387   2HG1  VAL  50          2HG1      VAL  50  -7.411   4.040   2.747
  388   3HG1  VAL  50          3HG1      VAL  50  -7.376   2.717   1.582
  389   1HG2  VAL  50          1HG2      VAL  50 -10.521   2.070   3.403
  390   2HG2  VAL  50          2HG2      VAL  50  -8.954   1.395   2.955
  391   3HG2  VAL  50          3HG2      VAL  50  -9.049   2.679   4.161
  392    H    THR  51           H        THR  51  -9.523   7.075   2.602
  393    HA   THR  51           HA       THR  51  -9.747   7.406  -0.316
  394    HB   THR  51           HB       THR  51 -10.115   9.835   0.180
  395    HG1  THR  51           HG1      THR  51 -10.382  10.514   2.245
  396   1HG2  THR  51          1HG2      THR  51 -12.108   7.940   1.432
  397   2HG2  THR  51          2HG2      THR  51 -12.444   9.592   0.910
  398   3HG2  THR  51          3HG2      THR  51 -12.015   8.361  -0.278
  399    H    SER  52           H        SER  52  -8.348   9.632  -0.800
  400    HA   SER  52           HA       SER  52  -5.648   8.879  -0.363
  401   1HB   SER  52          1HB       SER  52  -6.751  11.514  -1.372
  402   2HB   SER  52          2HB       SER  52  -5.080  10.968  -1.521
  403    HG   SER  52           HG       SER  52  -5.628   9.620  -3.083
  404    H    GLU  53           H        GLU  53  -7.864  10.531   1.581
  405    HA   GLU  53           HA       GLU  53  -5.967  12.055   3.084
  406   1HB   GLU  53          1HB       GLU  53  -8.777  11.172   3.771
  407   2HB   GLU  53          2HB       GLU  53  -7.824  12.319   4.686
  408   1HG   GLU  53          1HG       GLU  53  -9.168  13.710   3.463
  409   2HG   GLU  53          2HG       GLU  53  -7.726  13.636   2.453
  410    H    GLU  54           H        GLU  54  -7.310   8.836   3.173
  411    HA   GLU  54           HA       GLU  54  -6.146   8.239   5.770
  412   1HB   GLU  54          1HB       GLU  54  -7.509   6.353   3.839
  413   2HB   GLU  54          2HB       GLU  54  -7.181   6.066   5.541
  414   1HG   GLU  54          1HG       GLU  54  -9.058   8.151   4.451
  415   2HG   GLU  54          2HG       GLU  54  -9.530   6.586   5.108
  416    H    CYS  55           H        CYS  55  -5.835   7.166   2.406
  417    HA   CYS  55           HA       CYS  55  -3.271   5.903   3.015
  418   1HB   CYS  55          1HB       CYS  55  -4.969   4.703   1.618
  419   2HB   CYS  55          2HB       CYS  55  -4.816   5.972   0.409
  420    HG   CYS  55           HG       CYS  55  -2.687   3.457   1.167
  421    H    ARG  56           H        ARG  56  -1.766   7.486   3.212
  422    HA   ARG  56           HA       ARG  56  -1.802   9.632   1.205
  423   1HB   ARG  56          1HB       ARG  56  -0.659   9.610   3.997
  424   2HB   ARG  56          2HB       ARG  56  -0.466  10.935   2.858
  425   1HG   ARG  56          1HG       ARG  56  -2.961  11.100   2.762
  426   2HG   ARG  56          2HG       ARG  56  -3.022   9.933   4.085
  427   1HD   ARG  56          1HD       ARG  56  -3.197  12.263   4.869
  428   2HD   ARG  56          2HD       ARG  56  -1.780  11.436   5.516
  429    HE   ARG  56           HE       ARG  56  -0.414  12.849   4.306
  430   1HH1  ARG  56          1HH1      ARG  56  -3.755  13.365   3.378
  431   2HH1  ARG  56          2HH1      ARG  56  -3.404  14.798   2.455
  432   1HH2  ARG  56          1HH2      ARG  56   0.039  14.726   3.123
  433   2HH2  ARG  56          2HH2      ARG  56  -1.250  15.570   2.310
  434    H    PHE  57           H        PHE  57  -0.382   9.472  -0.332
  435    HA   PHE  57           HA       PHE  57   1.891   7.852  -0.385
  436   1HB   PHE  57          1HB       PHE  57   0.980   8.705  -2.439
  437   2HB   PHE  57          2HB       PHE  57   1.212  10.370  -1.916
  438    HD1  PHE  57           HD1      PHE  57   3.153   7.261  -2.587
  439    HD2  PHE  57           HD2      PHE  57   3.072  11.515  -2.617
  440    HE1  PHE  57           HE1      PHE  57   5.367   7.295  -3.655
  441    HE2  PHE  57           HE2      PHE  57   5.284  11.555  -3.685
  442    HZ   PHE  57           HZ       PHE  57   6.436   9.443  -4.204
  443    H    CYS  58           H        CYS  58   3.762   8.004   0.641
  444    HA   CYS  58           HA       CYS  58   4.389  10.520   1.997
  445   1HB   CYS  58          1HB       CYS  58   5.578   7.771   2.400
  446   2HB   CYS  58          2HB       CYS  58   5.868   9.188   3.405
  447    HG   CYS  58           HG       CYS  58   2.630   8.404   3.104
  448    H    HIS  59           H        HIS  59   6.112   7.979   0.152
  449    HA   HIS  59           HA       HIS  59   7.694   9.908  -1.235
  450   1HB   HIS  59          1HB       HIS  59   9.894   9.089  -0.291
  451   2HB   HIS  59          2HB       HIS  59   8.947  10.116   0.770
  452    HD1  HIS  59           HD1      HIS  59   8.624   9.261   3.077
  453    HD2  HIS  59           HD2      HIS  59   9.550   6.211   0.401
  454    HE1  HIS  59           HE1      HIS  59   8.849   7.176   4.470
  455    HE2  HIS  59           HE2      HIS  59   9.271   5.320   2.819
  456    H    SER  60           H        SER  60   9.382   8.920  -2.545
  457    HA   SER  60           HA       SER  60   8.911   6.064  -3.134
  458   1HB   SER  60          1HB       SER  60   9.722   8.201  -5.126
  459   2HB   SER  60          2HB       SER  60   9.321   6.521  -5.480
  460    HG   SER  60           HG       SER  60   7.691   8.664  -5.219
  461    H    GLU  61           H        GLU  61  10.739   4.808  -3.108
  462    HA   GLU  61           HA       GLU  61  13.339   5.977  -3.473
  463   1HB   GLU  61          1HB       GLU  61  14.163   5.286  -1.206
  464   2HB   GLU  61          2HB       GLU  61  13.073   6.662  -1.217
  465   1HG   GLU  61          1HG       GLU  61  11.229   5.173  -0.552
  466   2HG   GLU  61          2HG       GLU  61  12.375   3.832  -0.470
  467    H    LYS  62           H        LYS  62  14.912   4.066  -2.270
  468    HA   LYS  62           HA       LYS  62  14.755   2.010  -4.235
  469   1HB   LYS  62          1HB       LYS  62  16.557   2.251  -1.818
  470   2HB   LYS  62          2HB       LYS  62  16.794   1.151  -3.170
  471   1HG   LYS  62          1HG       LYS  62  16.803   4.157  -3.355
  472   2HG   LYS  62          2HG       LYS  62  18.236   3.127  -3.307
  473   1HD   LYS  62          1HD       LYS  62  17.588   2.071  -5.384
  474   2HD   LYS  62          2HD       LYS  62  16.081   2.989  -5.413
  475   1HE   LYS  62          1HE       LYS  62  17.305   5.060  -5.652
  476   2HE   LYS  62          2HE       LYS  62  18.839   4.203  -5.496
  477   1HZ   LYS  62          1HZ       LYS  62  18.387   3.041  -7.541
  478   2HZ   LYS  62          2HZ       LYS  62  16.870   3.784  -7.681
  479   3HZ   LYS  62          3HZ       LYS  62  18.285   4.712  -7.812
  480    H    ALA  63           H        ALA  63  14.606  -0.238  -3.900
  481    HA   ALA  63           HA       ALA  63  13.229  -1.038  -1.422
  482   1HB   ALA  63          1HB       ALA  63  12.434  -1.795  -4.228
  483   2HB   ALA  63          2HB       ALA  63  11.688  -2.393  -2.746
  484   3HB   ALA  63          3HB       ALA  63  11.567  -0.685  -3.166
  485    HA   PRO  64           HA       PRO  64  16.069  -4.464  -1.388
  486   1HB   PRO  64          1HB       PRO  64  14.525  -6.261  -0.017
  487   2HB   PRO  64          2HB       PRO  64  15.411  -4.940   0.750
  488   1HG   PRO  64          1HG       PRO  64  12.521  -5.096  -0.009
  489   2HG   PRO  64          2HG       PRO  64  13.259  -4.439   1.465
  490   1HD   PRO  64          1HD       PRO  64  12.408  -2.849  -0.535
  491   2HD   PRO  64          2HD       PRO  64  13.840  -2.450   0.437
  492    H    ASP  65           H        ASP  65  16.382  -6.518  -2.311
  493    HA   ASP  65           HA       ASP  65  15.344  -6.933  -4.808
  494   1HB   ASP  65          1HB       ASP  65  16.685  -8.801  -2.875
  495   2HB   ASP  65          2HB       ASP  65  16.198  -9.335  -4.474
  496    H    GLU  66           H        GLU  66  14.233  -8.381  -1.786
  497    HA   GLU  66           HA       GLU  66  12.617 -10.386  -2.823
  498   1HB   GLU  66          1HB       GLU  66  13.165 -10.347  -0.488
  499   2HB   GLU  66          2HB       GLU  66  12.365  -8.796  -0.271
  500   1HG   GLU  66          1HG       GLU  66  10.214  -9.794  -0.667
  501   2HG   GLU  66          2HG       GLU  66  10.965 -11.343  -1.051
  502    H    VAL  67           H        VAL  67  11.621  -7.099  -1.828
  503    HA   VAL  67           HA       VAL  67   8.919  -7.528  -2.591
  504    HB   VAL  67           HB       VAL  67   8.549  -5.163  -2.201
  505   1HG1  VAL  67          1HG1      VAL  67   8.650  -6.625  -0.267
  506   2HG1  VAL  67          2HG1      VAL  67  10.393  -6.376  -0.148
  507   3HG1  VAL  67          3HG1      VAL  67   9.290  -5.029   0.130
  508   1HG2  VAL  67          1HG2      VAL  67  11.545  -4.933  -1.947
  509   2HG2  VAL  67          2HG2      VAL  67  10.550  -4.251  -3.234
  510   3HG2  VAL  67          3HG2      VAL  67  10.381  -3.659  -1.581
  511    H    ILE  68           H        ILE  68  11.740  -6.453  -4.291
  512    HA   ILE  68           HA       ILE  68  10.669  -4.995  -6.387
  513    HB   ILE  68           HB       ILE  68  12.953  -6.971  -6.481
  514   1HG1  ILE  68          1HG1      ILE  68  13.327  -5.192  -4.865
  515   2HG1  ILE  68          2HG1      ILE  68  14.371  -4.960  -6.262
  516   1HG2  ILE  68          1HG2      ILE  68  12.134  -6.531  -8.720
  517   2HG2  ILE  68          2HG2      ILE  68  12.224  -4.794  -8.433
  518   3HG2  ILE  68          3HG2      ILE  68  13.700  -5.759  -8.476
  519   1HD1  ILE  68          1HD1      ILE  68  12.838  -3.258  -7.113
  520   2HD1  ILE  68          2HD1      ILE  68  11.814  -3.483  -5.694
  521   3HD1  ILE  68          3HD1      ILE  68  13.452  -2.856  -5.509
  522    H    GLU  69           H        GLU  69  11.285  -8.505  -6.328
  523    HA   GLU  69           HA       GLU  69  10.050  -8.952  -8.840
  524   1HB   GLU  69          1HB       GLU  69  11.773 -10.433  -7.704
  525   2HB   GLU  69          2HB       GLU  69  10.466 -11.022  -6.684
  526   1HG   GLU  69          1HG       GLU  69   9.259 -11.740  -8.713
  527   2HG   GLU  69          2HG       GLU  69  10.647 -11.240  -9.679
  528    H    ALA  70           H        ALA  70   8.929  -9.101  -5.510
  529    HA   ALA  70           HA       ALA  70   6.493 -10.425  -6.021
  530   1HB   ALA  70          1HB       ALA  70   7.481 -10.249  -3.782
  531   2HB   ALA  70          2HB       ALA  70   7.114  -8.523  -3.767
  532   3HB   ALA  70          3HB       ALA  70   5.803  -9.704  -3.821
  533    H    ILE  71           H        ILE  71   7.238  -6.942  -5.726
  534    HA   ILE  71           HA       ILE  71   4.562  -6.090  -6.036
  535    HB   ILE  71           HB       ILE  71   7.109  -4.574  -6.627
  536   1HG1  ILE  71          1HG1      ILE  71   5.323  -4.517  -4.185
  537   2HG1  ILE  71          2HG1      ILE  71   6.841  -5.405  -4.286
  538   1HG2  ILE  71          1HG2      ILE  71   5.737  -2.554  -6.410
  539   2HG2  ILE  71          2HG2      ILE  71   5.199  -3.562  -7.753
  540   3HG2  ILE  71          3HG2      ILE  71   4.295  -3.556  -6.239
  541   1HD1  ILE  71          1HD1      ILE  71   7.135  -3.305  -3.122
  542   2HD1  ILE  71          2HD1      ILE  71   8.035  -3.304  -4.638
  543   3HD1  ILE  71          3HD1      ILE  71   6.513  -2.424  -4.517
  544    H    LYS  72           H        LYS  72   7.135  -6.698  -8.386
  545    HA   LYS  72           HA       LYS  72   5.721  -5.604 -10.601
  546   1HB   LYS  72          1HB       LYS  72   7.982  -7.604 -10.519
  547   2HB   LYS  72          2HB       LYS  72   7.389  -6.821 -11.979
  548   1HG   LYS  72          1HG       LYS  72   7.934  -4.633 -10.934
  549   2HG   LYS  72          2HG       LYS  72   8.696  -5.511  -9.611
  550   1HD   LYS  72          1HD       LYS  72   9.479  -5.709 -12.519
  551   2HD   LYS  72          2HD       LYS  72  10.329  -4.765 -11.295
  552   1HE   LYS  72          1HE       LYS  72  10.778  -6.819 -10.033
  553   2HE   LYS  72          2HE       LYS  72   9.938  -7.757 -11.267
  554   1HZ   LYS  72          1HZ       LYS  72  12.414  -6.156 -11.669
  555   2HZ   LYS  72          2HZ       LYS  72  12.315  -7.848 -11.592
  556   3HZ   LYS  72          3HZ       LYS  72  11.593  -7.014 -12.884
  557    H    GLN  73           H        GLN  73   5.426  -8.522  -8.887
  558    HA   GLN  73           HA       GLN  73   4.023  -9.832 -11.104
  559   1HB   GLN  73          1HB       GLN  73   5.804 -10.953  -9.536
  560   2HB   GLN  73          2HB       GLN  73   4.456 -11.099  -8.420
  561   1HG   GLN  73          1HG       GLN  73   4.429 -12.172 -11.230
  562   2HG   GLN  73          2HG       GLN  73   4.902 -13.114  -9.819
  563   1HE2  GLN  73          2HE2      GLN  73   2.715 -13.475 -11.735
  564   2HE2  GLN  73          1HE2      GLN  73   1.266 -13.530 -10.786
  565    H    ASN  74           H        ASN  74   3.546  -8.914  -7.703
  566    HA   ASN  74           HA       ASN  74   0.782  -9.752  -7.732
  567   1HB   ASN  74          1HB       ASN  74   2.250  -8.162  -5.613
  568   2HB   ASN  74          2HB       ASN  74   0.715  -8.992  -5.417
  569   1HD2  ASN  74          2HD2      ASN  74   1.731 -11.321  -6.981
  570   2HD2  ASN  74          1HD2      ASN  74   2.758 -12.175  -5.886
  571    H    GLY  75           H        GLY  75   2.553  -6.820  -8.240
  572   1HA   GLY  75          1HA       GLY  75   1.605  -4.890  -9.244
  573   2HA   GLY  75          2HA       GLY  75   0.031  -5.370  -8.620
  574    H    TYR  76           H        TYR  76   1.427  -5.981  -5.998
  575    HA   TYR  76           HA       TYR  76   2.281  -3.464  -4.954
  576   1HB   TYR  76          1HB       TYR  76   0.388  -3.046  -3.480
  577   2HB   TYR  76          2HB       TYR  76  -0.164  -3.064  -5.151
  578    HD1  TYR  76           HD1      TYR  76  -1.166  -5.327  -6.000
  579    HD2  TYR  76           HD2      TYR  76  -0.721  -4.322  -1.890
  580    HE1  TYR  76           HE1      TYR  76  -2.876  -6.993  -5.414
  581    HE2  TYR  76           HE2      TYR  76  -2.428  -5.988  -1.293
  582    HH   TYR  76           HH       TYR  76  -3.534  -8.345  -3.456
  583    H    PHE  77           H        PHE  77   2.960  -3.631  -2.765
  584    HA   PHE  77           HA       PHE  77   2.805  -6.333  -1.602
  585   1HB   PHE  77          1HB       PHE  77   5.086  -5.860  -2.510
  586   2HB   PHE  77          2HB       PHE  77   5.192  -4.477  -1.425
  587    HD1  PHE  77           HD1      PHE  77   5.005  -8.151  -1.585
  588    HD2  PHE  77           HD2      PHE  77   5.725  -4.753   0.871
  589    HE1  PHE  77           HE1      PHE  77   5.894  -9.619   0.178
  590    HE2  PHE  77           HE2      PHE  77   6.615  -6.213   2.640
  591    HZ   PHE  77           HZ       PHE  77   6.701  -8.651   2.293
  592    H    ILE  78           H        ILE  78   1.970  -6.361   0.396
  593    HA   ILE  78           HA       ILE  78   1.621  -3.772   1.747
  594    HB   ILE  78           HB       ILE  78   0.047  -6.331   2.097
  595   1HG1  ILE  78          1HG1      ILE  78  -0.424  -5.227  -0.039
  596   2HG1  ILE  78          2HG1      ILE  78  -1.800  -5.094   1.050
  597   1HG2  ILE  78          1HG2      ILE  78  -1.451  -4.992   3.500
  598   2HG2  ILE  78          2HG2      ILE  78   0.178  -5.070   4.171
  599   3HG2  ILE  78          3HG2      ILE  78  -0.362  -3.612   3.339
  600   1HD1  ILE  78          1HD1      ILE  78   0.221  -2.938   0.486
  601   2HD1  ILE  78          2HD1      ILE  78  -1.420  -3.023  -0.155
  602   3HD1  ILE  78          3HD1      ILE  78  -1.159  -2.800   1.576
  603    H    TYR  79           H        TYR  79   3.103  -3.462   3.289
  604    HA   TYR  79           HA       TYR  79   3.744  -5.746   5.032
  605   1HB   TYR  79          1HB       TYR  79   5.742  -4.763   4.026
  606   2HB   TYR  79          2HB       TYR  79   5.279  -3.168   4.615
  607    HD1  TYR  79           HD1      TYR  79   5.925  -2.454   6.760
  608    HD2  TYR  79           HD2      TYR  79   6.237  -6.575   5.751
  609    HE1  TYR  79           HE1      TYR  79   7.117  -2.874   8.868
  610    HE2  TYR  79           HE2      TYR  79   7.433  -7.006   7.857
  611    HH   TYR  79           HH       TYR  79   7.534  -4.773  10.397
  612    H    LYS  80           H        LYS  80   2.837  -5.763   6.968
  613    HA   LYS  80           HA       LYS  80   1.271  -3.535   7.881
  614   1HB   LYS  80          1HB       LYS  80   2.028  -5.970   9.492
  615   2HB   LYS  80          2HB       LYS  80   0.632  -4.926   9.709
  616   1HG   LYS  80          1HG       LYS  80  -0.281  -5.720   7.578
  617   2HG   LYS  80          2HG       LYS  80   1.111  -6.791   7.397
  618   1HD   LYS  80          1HD       LYS  80   0.453  -7.751   9.666
  619   2HD   LYS  80          2HD       LYS  80  -1.076  -6.897   9.456
  620   1HE   LYS  80          1HE       LYS  80  -1.352  -9.156   8.700
  621   2HE   LYS  80          2HE       LYS  80  -1.376  -8.085   7.298
  622   1HZ   LYS  80          1HZ       LYS  80  -0.008 -10.152   7.050
  623   2HZ   LYS  80          2HZ       LYS  80   0.820  -8.711   6.723
  624   3HZ   LYS  80          3HZ       LYS  80   1.064  -9.516   8.198
  625    H    MET  81           H        MET  81   2.365  -1.774   8.599
  626    HA   MET  81           HA       MET  81   4.882  -1.989   9.947
  627   1HB   MET  81          1HB       MET  81   4.116  -0.019   8.536
  628   2HB   MET  81          2HB       MET  81   3.080   0.434   9.882
  629   1HG   MET  81          1HG       MET  81   5.135   0.493  11.316
  630   2HG   MET  81          2HG       MET  81   6.079   0.293   9.842
  631   1HE   MET  81          1HE       MET  81   5.742   2.050   7.716
  632   2HE   MET  81          2HE       MET  81   4.824   3.549   7.873
  633   3HE   MET  81          3HE       MET  81   3.990   1.997   7.911
  634    H    GLU  82           H        GLU  82   2.029  -0.258  11.149
  635    HA   GLU  82           HA       GLU  82   2.185  -1.839  13.625
  636   1HB   GLU  82          1HB       GLU  82   1.426   1.053  13.230
  637   2HB   GLU  82          2HB       GLU  82   0.926   0.156  14.655
  638   1HG   GLU  82          1HG       GLU  82   2.828   1.273  15.349
  639   2HG   GLU  82          2HG       GLU  82   3.418  -0.345  14.978
  640    H    GLY  83           H        GLY  83   0.728  -3.411  13.164
  641   1HA   GLY  83          1HA       GLY  83  -2.037  -2.813  13.215
  642   2HA   GLY  83          2HA       GLY  83  -1.538  -3.148  11.563
  643    H    CYS  84           H        CYS  84  -0.822  -4.504  14.751
  644    HA   CYS  84           HA       CYS  84  -2.110  -6.965  14.325
  645   1HB   CYS  84          1HB       CYS  84  -0.007  -8.385  14.219
  646   2HB   CYS  84          2HB       CYS  84  -0.417  -7.527  12.737
  647    HG   CYS  84           HG       CYS  84   2.419  -7.593  14.205
  648    H    ASN  85           H        ASN  85   0.799  -5.572  15.769
  649    HA   ASN  85           HA       ASN  85  -0.383  -5.952  18.413
  650   1HB   ASN  85          1HB       ASN  85   2.426  -6.789  17.644
  651   2HB   ASN  85          2HB       ASN  85   1.901  -6.567  19.309
  652   1HD2  ASN  85          2HD2      ASN  85   0.348  -7.987  20.175
  653   2HD2  ASN  85          1HD2      ASN  85   0.075  -9.552  19.481
  Start of MODEL   17
    1    H    MET   1           H        MET   1  14.286  -0.744 -10.201
    2    HA   MET   1           HA       MET   1  12.404   0.696 -10.344
    3   1HB   MET   1          1HB       MET   1  12.102  -1.778  -9.979
    4   2HB   MET   1          2HB       MET   1  11.877  -1.440  -8.270
    5   1HG   MET   1          1HG       MET   1   9.935  -0.035  -8.832
    6   2HG   MET   1          2HG       MET   1  10.139  -0.473 -10.527
    7   1HE   MET   1          1HE       MET   1  10.414  -2.559  -7.166
    8   2HE   MET   1          2HE       MET   1   8.821  -3.319  -7.150
    9   3HE   MET   1          3HE       MET   1   8.964  -1.569  -7.000
   10    H    GLN   2           H        GLN   2  11.013   2.178  -9.436
   11    HA   GLN   2           HA       GLN   2  11.752   3.154  -6.774
   12   1HB   GLN   2          1HB       GLN   2   9.995   4.365  -8.918
   13   2HB   GLN   2          2HB       GLN   2  10.386   5.130  -7.385
   14   1HG   GLN   2          1HG       GLN   2  12.738   5.193  -8.004
   15   2HG   GLN   2          2HG       GLN   2  12.361   4.399  -9.533
   16   1HE2  GLN   2          2HE2      GLN   2  13.554   7.015  -8.980
   17   2HE2  GLN   2          1HE2      GLN   2  12.550   8.178  -9.785
   18    H    ILE   3           H        ILE   3  10.542   2.696  -5.050
   19    HA   ILE   3           HA       ILE   3   7.880   1.572  -5.481
   20    HB   ILE   3           HB       ILE   3   7.998   1.316  -2.896
   21   1HG1  ILE   3          1HG1      ILE   3  10.925   1.606  -3.615
   22   2HG1  ILE   3          2HG1      ILE   3  10.009   2.643  -2.526
   23   1HG2  ILE   3          1HG2      ILE   3   9.558  -0.338  -4.856
   24   2HG2  ILE   3          2HG2      ILE   3   9.184  -0.855  -3.212
   25   3HG2  ILE   3          3HG2      ILE   3   7.881  -0.546  -4.359
   26   1HD1  ILE   3          1HD1      ILE   3  11.410   1.114  -1.284
   27   2HD1  ILE   3          2HD1      ILE   3   9.708   0.746  -1.004
   28   3HD1  ILE   3          3HD1      ILE   3  10.661  -0.262  -2.095
   29    H    HIS   4           H        HIS   4   6.141   2.688  -5.291
   30    HA   HIS   4           HA       HIS   4   6.187   5.382  -4.234
   31   1HB   HIS   4          1HB       HIS   4   3.872   3.732  -5.304
   32   2HB   HIS   4          2HB       HIS   4   3.834   5.457  -4.962
   33    HD1  HIS   4           HD1      HIS   4   3.709   6.615  -7.149
   34    HD2  HIS   4           HD2      HIS   4   6.372   3.416  -7.245
   35    HE1  HIS   4           HE1      HIS   4   4.751   6.659  -9.440
   36    HE2  HIS   4           HE2      HIS   4   6.214   4.609  -9.529
   37    H    VAL   5           H        VAL   5   6.183   5.575  -2.083
   38    HA   VAL   5           HA       VAL   5   5.140   3.438  -0.428
   39    HB   VAL   5           HB       VAL   5   6.405   6.042   0.441
   40   1HG1  VAL   5          1HG1      VAL   5   6.854   4.855   2.531
   41   2HG1  VAL   5          2HG1      VAL   5   5.125   4.935   2.193
   42   3HG1  VAL   5          3HG1      VAL   5   6.010   3.436   1.909
   43   1HG2  VAL   5          1HG2      VAL   5   7.699   3.356  -0.025
   44   2HG2  VAL   5          2HG2      VAL   5   7.932   4.808  -1.001
   45   3HG2  VAL   5          3HG2      VAL   5   8.486   4.771   0.673
   46    H    TYR   6           H        TYR   6   2.992   3.417  -0.216
   47    HA   TYR   6           HA       TYR   6   1.634   5.932   0.471
   48   1HB   TYR   6          1HB       TYR   6   0.622   3.312  -0.614
   49   2HB   TYR   6          2HB       TYR   6  -0.467   4.483   0.122
   50    HD1  TYR   6           HD1      TYR   6   1.946   3.997  -2.650
   51    HD2  TYR   6           HD2      TYR   6  -1.225   6.361  -1.086
   52    HE1  TYR   6           HE1      TYR   6   1.790   5.196  -4.792
   53    HE2  TYR   6           HE2      TYR   6  -1.390   7.565  -3.223
   54    HH   TYR   6           HH       TYR   6  -0.247   8.018  -5.172
   55    H    ASP   7           H        ASP   7   1.965   6.200   2.586
   56    HA   ASP   7           HA       ASP   7   1.893   4.098   4.524
   57   1HB   ASP   7          1HB       ASP   7   3.227   6.114   4.879
   58   2HB   ASP   7          2HB       ASP   7   1.781   7.111   4.806
   59    H    THR   8           H        THR   8   0.044   3.072   4.991
   60    HA   THR   8           HA       THR   8  -2.462   4.591   4.716
   61    HB   THR   8           HB       THR   8  -2.128   1.600   4.462
   62    HG1  THR   8           HG1      THR   8  -0.993   2.944   2.829
   63   1HG2  THR   8          1HG2      THR   8  -4.394   2.350   4.995
   64   2HG2  THR   8          2HG2      THR   8  -4.352   3.472   3.634
   65   3HG2  THR   8          3HG2      THR   8  -4.310   1.732   3.346
   66    H    TYR   9           H        TYR   9  -2.979   5.227   6.733
   67    HA   TYR   9           HA       TYR   9  -2.855   3.269   8.907
   68   1HB   TYR   9          1HB       TYR   9  -3.157   6.256   8.837
   69   2HB   TYR   9          2HB       TYR   9  -3.620   5.347  10.270
   70    HD1  TYR   9           HD1      TYR   9  -1.869   6.866  11.341
   71    HD2  TYR   9           HD2      TYR   9  -0.892   3.857   8.499
   72    HE1  TYR   9           HE1      TYR   9   0.454   6.882  12.134
   73    HE2  TYR   9           HE2      TYR   9   1.439   3.871   9.280
   74    HH   TYR   9           HH       TYR   9   2.982   5.448  10.435
   75    H    VAL  10           H        VAL  10  -4.554   1.941   8.490
   76    HA   VAL  10           HA       VAL  10  -7.174   3.076   7.938
   77    HB   VAL  10           HB       VAL  10  -6.320   0.188   8.218
   78   1HG1  VAL  10          1HG1      VAL  10  -8.939   1.350   7.272
   79   2HG1  VAL  10          2HG1      VAL  10  -8.492  -0.356   7.212
   80   3HG1  VAL  10          3HG1      VAL  10  -8.674   0.456   8.768
   81   1HG2  VAL  10          1HG2      VAL  10  -6.921   1.843   5.771
   82   2HG2  VAL  10          2HG2      VAL  10  -5.329   1.285   6.285
   83   3HG2  VAL  10          3HG2      VAL  10  -6.552   0.118   5.782
   84    H    LYS  11           H        LYS  11  -8.191   3.904   9.641
   85    HA   LYS  11           HA       LYS  11  -7.827   2.850  12.289
   86   1HB   LYS  11          1HB       LYS  11  -9.740   4.946  11.250
   87   2HB   LYS  11          2HB       LYS  11  -9.492   4.561  12.948
   88   1HG   LYS  11          1HG       LYS  11  -7.147   5.247  12.746
   89   2HG   LYS  11          2HG       LYS  11  -7.431   5.671  11.056
   90   1HD   LYS  11          1HD       LYS  11  -9.133   7.295  11.770
   91   2HD   LYS  11          2HD       LYS  11  -8.791   6.895  13.454
   92   1HE   LYS  11          1HE       LYS  11  -6.483   7.649  13.162
   93   2HE   LYS  11          2HE       LYS  11  -6.826   8.043  11.478
   94   1HZ   LYS  11          1HZ       LYS  11  -8.384   9.712  12.181
   95   2HZ   LYS  11          2HZ       LYS  11  -8.185   9.273  13.811
   96   3HZ   LYS  11          3HZ       LYS  11  -6.901   9.980  12.961
   97    H    ALA  12           H        ALA  12  -8.564   0.780  12.351
   98    HA   ALA  12           HA       ALA  12 -11.033  -0.116  11.336
   99   1HB   ALA  12          1HB       ALA  12 -10.685  -2.095  12.709
  100   2HB   ALA  12          2HB       ALA  12  -9.188  -1.632  11.902
  101   3HB   ALA  12          3HB       ALA  12  -9.417  -1.265  13.612
  102    H    LYS  13           H        LYS  13 -12.922  -0.772  12.563
  103    HA   LYS  13           HA       LYS  13 -13.848   1.444  14.094
  104   1HB   LYS  13          1HB       LYS  13 -15.251  -1.206  13.789
  105   2HB   LYS  13          2HB       LYS  13 -15.971   0.365  14.105
  106   1HG   LYS  13          1HG       LYS  13 -15.149   1.079  11.842
  107   2HG   LYS  13          2HG       LYS  13 -14.728  -0.612  11.552
  108   1HD   LYS  13          1HD       LYS  13 -17.152  -1.126  12.202
  109   2HD   LYS  13          2HD       LYS  13 -17.438   0.603  11.986
  110   1HE   LYS  13          1HE       LYS  13 -18.001  -0.467   9.939
  111   2HE   LYS  13          2HE       LYS  13 -16.476   0.380   9.685
  112   1HZ   LYS  13          1HZ       LYS  13 -15.283  -1.668   9.872
  113   2HZ   LYS  13          2HZ       LYS  13 -16.684  -2.507  10.328
  114   3HZ   LYS  13          3HZ       LYS  13 -16.541  -1.898   8.757
  115    H    ASP  14           H        ASP  14 -13.377  -1.997  14.874
  116    HA   ASP  14           HA       ASP  14 -13.304  -1.212  17.711
  117   1HB   ASP  14          1HB       ASP  14 -14.621  -3.599  16.441
  118   2HB   ASP  14          2HB       ASP  14 -14.196  -3.574  18.151
  119    H    GLY  15           H        GLY  15 -11.539  -2.440  15.206
  120   1HA   GLY  15          1HA       GLY  15  -9.855  -4.180  16.794
  121   2HA   GLY  15          2HA       GLY  15  -9.552  -3.652  15.142
  122    H    HIS  16           H        HIS  16  -8.158  -2.034  14.789
  123    HA   HIS  16           HA       HIS  16  -7.685   0.053  16.657
  124   1HB   HIS  16          1HB       HIS  16  -5.244  -0.420  17.005
  125   2HB   HIS  16          2HB       HIS  16  -6.316  -1.532  17.842
  126    HD1  HIS  16           HD1      HIS  16  -5.587  -3.876  17.694
  127    HD2  HIS  16           HD2      HIS  16  -4.364  -1.679  14.372
  128    HE1  HIS  16           HE1      HIS  16  -4.266  -5.471  16.268
  129    HE2  HIS  16           HE2      HIS  16  -3.400  -4.084  14.350
  130    H    VAL  17           H        VAL  17  -5.888   1.511  15.842
  131    HA   VAL  17           HA       VAL  17  -6.183   2.042  13.100
  132    HB   VAL  17           HB       VAL  17  -3.891   2.905  14.881
  133   1HG1  VAL  17          1HG1      VAL  17  -4.962   4.088  12.321
  134   2HG1  VAL  17          2HG1      VAL  17  -3.689   4.787  13.323
  135   3HG1  VAL  17          3HG1      VAL  17  -3.427   3.241  12.516
  136   1HG2  VAL  17          1HG2      VAL  17  -5.194   4.948  15.260
  137   2HG2  VAL  17          2HG2      VAL  17  -6.535   4.257  14.346
  138   3HG2  VAL  17          3HG2      VAL  17  -6.030   3.518  15.867
  139    H    MET  18           H        MET  18  -5.589   0.668  11.566
  140    HA   MET  18           HA       MET  18  -3.515  -1.260  11.917
  141   1HB   MET  18          1HB       MET  18  -5.087  -0.449   9.466
  142   2HB   MET  18          2HB       MET  18  -3.965  -1.801   9.516
  143   1HG   MET  18          1HG       MET  18  -6.443  -1.518  11.205
  144   2HG   MET  18          2HG       MET  18  -6.290  -2.513   9.757
  145   1HE   MET  18          1HE       MET  18  -3.422  -3.747   9.995
  146   2HE   MET  18          2HE       MET  18  -4.846  -4.707   9.597
  147   3HE   MET  18          3HE       MET  18  -3.744  -5.249  10.863
  148    H    HIS  19           H        HIS  19  -1.482  -0.714  11.947
  149    HA   HIS  19           HA       HIS  19  -0.495   1.531  10.385
  150   1HB   HIS  19          1HB       HIS  19   0.836  -0.242  12.444
  151   2HB   HIS  19          2HB       HIS  19   1.646   1.078  11.612
  152    HD1  HIS  19           HD1      HIS  19  -0.236   0.341  14.615
  153    HD2  HIS  19           HD2      HIS  19   0.362   3.672  12.194
  154    HE1  HIS  19           HE1      HIS  19  -0.898   2.323  16.009
  155    HE2  HIS  19           HE2      HIS  19  -0.320   4.333  14.597
  156    H    PHE  20           H        PHE  20  -0.259   0.941   8.271
  157    HA   PHE  20           HA       PHE  20   1.956  -0.798   7.689
  158   1HB   PHE  20          1HB       PHE  20   0.790  -2.322   6.210
  159   2HB   PHE  20          2HB       PHE  20   0.053  -2.404   7.802
  160    HD1  PHE  20           HD1      PHE  20  -2.156  -1.313   8.189
  161    HD2  PHE  20           HD2      PHE  20  -0.444  -1.670   4.308
  162    HE1  PHE  20           HE1      PHE  20  -4.364  -0.914   7.180
  163    HE2  PHE  20           HE2      PHE  20  -2.648  -1.269   3.294
  164    HZ   PHE  20           HZ       PHE  20  -4.612  -0.891   4.731
  165    H    ASP  21           H        ASP  21   2.678  -0.575   5.472
  166    HA   ASP  21           HA       ASP  21   1.358   1.613   4.031
  167   1HB   ASP  21          1HB       ASP  21   3.666   2.321   3.227
  168   2HB   ASP  21          2HB       ASP  21   3.252   2.716   4.888
  169    H    VAL  22           H        VAL  22   1.640   1.619   1.767
  170    HA   VAL  22           HA       VAL  22   1.945  -1.118   0.737
  171    HB   VAL  22           HB       VAL  22   0.412   1.171  -0.512
  172   1HG1  VAL  22          1HG1      VAL  22   0.437  -1.781  -1.136
  173   2HG1  VAL  22          2HG1      VAL  22  -0.598  -0.575  -1.902
  174   3HG1  VAL  22          3HG1      VAL  22   1.152  -0.501  -2.116
  175   1HG2  VAL  22          1HG2      VAL  22  -0.645  -1.153   1.098
  176   2HG2  VAL  22          2HG2      VAL  22  -0.587   0.530   1.627
  177   3HG2  VAL  22          3HG2      VAL  22  -1.616   0.067   0.273
  178    H    PHE  23           H        PHE  23   3.817  -1.426  -0.272
  179    HA   PHE  23           HA       PHE  23   5.074   0.750  -1.759
  180   1HB   PHE  23          1HB       PHE  23   5.950  -2.110  -1.284
  181   2HB   PHE  23          2HB       PHE  23   6.878  -0.920  -2.188
  182    HD1  PHE  23           HD1      PHE  23   6.600  -2.493   0.863
  183    HD2  PHE  23           HD2      PHE  23   7.199   1.375  -0.805
  184    HE1  PHE  23           HE1      PHE  23   7.697  -1.769   2.942
  185    HE2  PHE  23           HE2      PHE  23   8.299   2.105   1.270
  186    HZ   PHE  23           HZ       PHE  23   8.551   0.532   3.145
  187    H    THR  24           H        THR  24   4.327   1.107  -3.779
  188    HA   THR  24           HA       THR  24   3.847  -1.280  -5.433
  189    HB   THR  24           HB       THR  24   1.660  -0.408  -4.794
  190    HG1  THR  24           HG1      THR  24   1.475  -1.203  -6.794
  191   1HG2  THR  24          1HG2      THR  24   2.255   1.920  -4.374
  192   2HG2  THR  24          2HG2      THR  24   2.558   2.171  -6.093
  193   3HG2  THR  24          3HG2      THR  24   0.924   1.820  -5.527
  194    H    ASP  25           H        ASP  25   4.287  -1.100  -7.621
  195    HA   ASP  25           HA       ASP  25   6.152   0.986  -8.396
  196   1HB   ASP  25          1HB       ASP  25   6.738  -1.257  -9.036
  197   2HB   ASP  25          2HB       ASP  25   5.156  -1.529  -9.753
  198    H    VAL  26           H        VAL  26   2.846   0.251  -8.642
  199    HA   VAL  26           HA       VAL  26   2.166   1.485 -11.083
  200    HB   VAL  26           HB       VAL  26   0.499   1.104  -8.585
  201   1HG1  VAL  26          1HG1      VAL  26  -0.369   1.671 -11.414
  202   2HG1  VAL  26          2HG1      VAL  26  -1.442   1.286 -10.067
  203   3HG1  VAL  26          3HG1      VAL  26  -0.496   2.775 -10.045
  204   1HG2  VAL  26          1HG2      VAL  26  -0.367  -0.882  -9.761
  205   2HG2  VAL  26          2HG2      VAL  26   0.802  -0.605 -11.053
  206   3HG2  VAL  26          3HG2      VAL  26   1.361  -0.997  -9.426
  207    H    ARG  27           H        ARG  27   1.474   3.570 -11.548
  208    HA   ARG  27           HA       ARG  27   2.473   5.571  -9.641
  209   1HB   ARG  27          1HB       ARG  27   1.913   5.957 -12.586
  210   2HB   ARG  27          2HB       ARG  27   2.777   7.053 -11.523
  211   1HG   ARG  27          1HG       ARG  27   4.495   6.074 -12.688
  212   2HG   ARG  27          2HG       ARG  27   4.425   5.054 -11.249
  213   1HD   ARG  27          1HD       ARG  27   3.125   3.398 -12.452
  214   2HD   ARG  27          2HD       ARG  27   3.087   4.431 -13.880
  215    HE   ARG  27           HE       ARG  27   5.684   4.152 -13.611
  216   1HH1  ARG  27          1HH1      ARG  27   3.189   1.737 -13.231
  217   2HH1  ARG  27          2HH1      ARG  27   4.199   0.418 -13.734
  218   1HH2  ARG  27          1HH2      ARG  27   7.013   2.439 -14.315
  219   2HH2  ARG  27          2HH2      ARG  27   6.379   0.818 -14.353
  220    H    ASP  28           H        ASP  28  -0.185   4.296  -9.621
  221    HA   ASP  28           HA       ASP  28  -1.842   6.675 -10.115
  222   1HB   ASP  28          1HB       ASP  28  -2.291   4.713 -11.638
  223   2HB   ASP  28          2HB       ASP  28  -2.813   3.817 -10.217
  224    H    ASP  29           H        ASP  29  -2.668   7.543  -8.373
  225    HA   ASP  29           HA       ASP  29  -2.203   6.494  -5.792
  226   1HB   ASP  29          1HB       ASP  29  -4.055   8.738  -6.629
  227   2HB   ASP  29          2HB       ASP  29  -3.494   8.429  -4.991
  228    H    LYS  30           H        LYS  30  -4.998   6.486  -7.909
  229    HA   LYS  30           HA       LYS  30  -6.856   5.608  -5.929
  230   1HB   LYS  30          1HB       LYS  30  -7.527   6.780  -8.018
  231   2HB   LYS  30          2HB       LYS  30  -7.036   5.367  -8.939
  232   1HG   LYS  30          1HG       LYS  30  -9.412   5.328  -8.681
  233   2HG   LYS  30          2HG       LYS  30  -8.719   4.032  -7.705
  234   1HD   LYS  30          1HD       LYS  30 -10.438   5.127  -6.428
  235   2HD   LYS  30          2HD       LYS  30  -8.871   5.518  -5.719
  236   1HE   LYS  30          1HE       LYS  30 -10.266   7.500  -5.802
  237   2HE   LYS  30          2HE       LYS  30  -8.895   7.678  -6.898
  238   1HZ   LYS  30          1HZ       LYS  30 -11.610   6.826  -7.752
  239   2HZ   LYS  30          2HZ       LYS  30 -11.040   8.419  -7.841
  240   3HZ   LYS  30          3HZ       LYS  30 -10.295   7.203  -8.757
  241    H    LYS  31           H        LYS  31  -4.813   4.038  -8.331
  242    HA   LYS  31           HA       LYS  31  -5.753   1.412  -7.893
  243   1HB   LYS  31          1HB       LYS  31  -3.225   2.537  -9.042
  244   2HB   LYS  31          2HB       LYS  31  -3.379   0.808  -8.761
  245   1HG   LYS  31          1HG       LYS  31  -5.198   2.487 -10.477
  246   2HG   LYS  31          2HG       LYS  31  -3.955   1.371 -11.052
  247   1HD   LYS  31          1HD       LYS  31  -5.128  -0.486  -9.975
  248   2HD   LYS  31          2HD       LYS  31  -6.369   0.627  -9.400
  249   1HE   LYS  31          1HE       LYS  31  -6.920   1.170 -11.741
  250   2HE   LYS  31          2HE       LYS  31  -5.726  -0.014 -12.275
  251   1HZ   LYS  31          1HZ       LYS  31  -7.888  -1.014 -12.300
  252   2HZ   LYS  31          2HZ       LYS  31  -6.988  -1.715 -11.048
  253   3HZ   LYS  31          3HZ       LYS  31  -8.175  -0.566 -10.685
  254    H    ALA  32           H        ALA  32  -3.219   3.312  -6.330
  255    HA   ALA  32           HA       ALA  32  -2.187   1.301  -4.676
  256   1HB   ALA  32          1HB       ALA  32  -1.436   3.113  -3.217
  257   2HB   ALA  32          2HB       ALA  32  -1.137   3.497  -4.912
  258   3HB   ALA  32          3HB       ALA  32  -2.491   4.243  -4.065
  259    H    ILE  33           H        ILE  33  -4.867   3.557  -4.181
  260    HA   ILE  33           HA       ILE  33  -5.752   2.629  -1.689
  261    HB   ILE  33           HB       ILE  33  -7.239   3.902  -3.986
  262   1HG1  ILE  33          1HG1      ILE  33  -6.348   4.996  -1.314
  263   2HG1  ILE  33          2HG1      ILE  33  -5.511   5.256  -2.840
  264   1HG2  ILE  33          1HG2      ILE  33  -8.824   2.585  -2.693
  265   2HG2  ILE  33          2HG2      ILE  33  -8.267   3.355  -1.207
  266   3HG2  ILE  33          3HG2      ILE  33  -9.090   4.311  -2.441
  267   1HD1  ILE  33          1HD1      ILE  33  -7.412   6.482  -3.697
  268   2HD1  ILE  33          2HD1      ILE  33  -8.308   6.163  -2.212
  269   3HD1  ILE  33          3HD1      ILE  33  -6.864   7.173  -2.168
  270    H    GLU  34           H        GLU  34  -6.582   1.652  -4.977
  271    HA   GLU  34           HA       GLU  34  -8.542  -0.236  -4.431
  272   1HB   GLU  34          1HB       GLU  34  -7.988   0.603  -6.676
  273   2HB   GLU  34          2HB       GLU  34  -6.462  -0.263  -6.623
  274   1HG   GLU  34          1HG       GLU  34  -7.665  -2.382  -6.534
  275   2HG   GLU  34          2HG       GLU  34  -9.199  -1.514  -6.584
  276    H    PHE  35           H        PHE  35  -5.035  -0.721  -4.798
  277    HA   PHE  35           HA       PHE  35  -5.047  -3.487  -4.285
  278   1HB   PHE  35          1HB       PHE  35  -2.837  -1.465  -3.875
  279   2HB   PHE  35          2HB       PHE  35  -2.619  -3.209  -3.836
  280    HD1  PHE  35           HD1      PHE  35  -4.363  -3.993  -6.125
  281    HD2  PHE  35           HD2      PHE  35  -1.552  -0.826  -5.704
  282    HE1  PHE  35           HE1      PHE  35  -3.991  -4.006  -8.558
  283    HE2  PHE  35           HE2      PHE  35  -1.180  -0.828  -8.134
  284    HZ   PHE  35           HZ       PHE  35  -2.400  -2.418  -9.564
  285    H    ALA  36           H        ALA  36  -4.637  -0.708  -2.129
  286    HA   ALA  36           HA       ALA  36  -4.094  -2.146   0.226
  287   1HB   ALA  36          1HB       ALA  36  -4.783  -0.129   1.414
  288   2HB   ALA  36          2HB       ALA  36  -3.768   0.278   0.030
  289   3HB   ALA  36          3HB       ALA  36  -5.516   0.501  -0.060
  290    H    LYS  37           H        LYS  37  -7.129  -1.080  -1.242
  291    HA   LYS  37           HA       LYS  37  -8.849  -2.021   0.774
  292   1HB   LYS  37          1HB       LYS  37  -9.203  -1.338  -2.113
  293   2HB   LYS  37          2HB       LYS  37 -10.507  -2.142  -1.251
  294   1HG   LYS  37          1HG       LYS  37 -10.387  -0.312   0.444
  295   2HG   LYS  37          2HG       LYS  37  -9.271   0.525  -0.637
  296   1HD   LYS  37          1HD       LYS  37 -10.913   0.718  -2.333
  297   2HD   LYS  37          2HD       LYS  37 -11.989  -0.417  -1.517
  298   1HE   LYS  37          1HE       LYS  37 -12.226   1.208   0.335
  299   2HE   LYS  37          2HE       LYS  37 -11.240   2.350  -0.582
  300   1HZ   LYS  37          1HZ       LYS  37 -13.743   1.173  -1.642
  301   2HZ   LYS  37          2HZ       LYS  37 -13.714   2.632  -0.784
  302   3HZ   LYS  37          3HZ       LYS  37 -12.875   2.499  -2.253
  303    H    GLN  38           H        GLN  38  -7.484  -3.592  -2.063
  304    HA   GLN  38           HA       GLN  38  -9.029  -5.905  -2.099
  305   1HB   GLN  38          1HB       GLN  38  -6.112  -5.563  -2.809
  306   2HB   GLN  38          2HB       GLN  38  -7.064  -6.990  -3.192
  307   1HG   GLN  38          1HG       GLN  38  -8.556  -5.643  -4.561
  308   2HG   GLN  38          2HG       GLN  38  -7.627  -4.198  -4.161
  309   1HE2  GLN  38          2HE2      GLN  38  -8.172  -5.403  -6.745
  310   2HE2  GLN  38          1HE2      GLN  38  -6.636  -5.728  -7.459
  311    H    TRP  39           H        TRP  39  -6.183  -5.146  -0.144
  312    HA   TRP  39           HA       TRP  39  -6.124  -7.734   1.100
  313   1HB   TRP  39          1HB       TRP  39  -4.085  -6.374   0.929
  314   2HB   TRP  39          2HB       TRP  39  -4.819  -5.132   1.939
  315    HD1  TRP  39           HD1      TRP  39  -4.031  -8.928   2.301
  316    HE1  TRP  39           HE1      TRP  39  -3.196  -9.334   4.703
  317    HE3  TRP  39           HE3      TRP  39  -4.437  -4.162   4.114
  318    HZ2  TRP  39           HZ2      TRP  39  -2.756  -7.826   7.049
  319    HZ3  TRP  39           HZ3      TRP  39  -3.784  -3.729   6.446
  320    HH2  TRP  39           HH2      TRP  39  -2.963  -5.524   7.881
  321    H    LEU  40           H        LEU  40  -7.432  -4.560   1.881
  322    HA   LEU  40           HA       LEU  40  -8.273  -5.145   4.510
  323   1HB   LEU  40          1HB       LEU  40  -9.329  -3.146   2.515
  324   2HB   LEU  40          2HB       LEU  40  -9.799  -3.198   4.203
  325    HG   LEU  40           HG       LEU  40  -6.999  -2.688   3.193
  326   1HD1  LEU  40          1HD1      LEU  40  -9.031  -0.811   4.391
  327   2HD1  LEU  40          2HD1      LEU  40  -7.365  -0.407   3.976
  328   3HD1  LEU  40          3HD1      LEU  40  -8.511  -0.839   2.707
  329   1HD2  LEU  40          1HD2      LEU  40  -8.147  -2.601   5.980
  330   2HD2  LEU  40          2HD2      LEU  40  -7.019  -3.806   5.358
  331   3HD2  LEU  40          3HD2      LEU  40  -6.511  -2.126   5.525
  332    H    SER  41           H        SER  41  -9.745  -5.723   1.376
  333    HA   SER  41           HA       SER  41 -12.322  -6.418   2.303
  334   1HB   SER  41          1HB       SER  41 -10.834  -7.333  -0.171
  335   2HB   SER  41          2HB       SER  41 -12.562  -7.552   0.112
  336    HG   SER  41           HG       SER  41 -12.747  -5.264   0.226
  337    H    SER  42           H        SER  42  -9.338  -8.234   1.945
  338    HA   SER  42           HA       SER  42 -10.482 -10.794   2.359
  339   1HB   SER  42          1HB       SER  42  -7.629  -9.873   2.775
  340   2HB   SER  42          2HB       SER  42  -8.167 -11.548   2.627
  341    HG   SER  42           HG       SER  42  -7.333 -10.520   0.648
  342    H    ILE  43           H        ILE  43  -8.968  -8.425   4.524
  343    HA   ILE  43           HA       ILE  43  -9.426 -10.145   6.816
  344    HB   ILE  43           HB       ILE  43  -8.494  -8.285   8.158
  345   1HG1  ILE  43          1HG1      ILE  43  -8.134  -6.932   5.473
  346   2HG1  ILE  43          2HG1      ILE  43  -9.257  -6.423   6.729
  347   1HG2  ILE  43          1HG2      ILE  43  -6.208  -8.459   7.289
  348   2HG2  ILE  43          2HG2      ILE  43  -7.037 -10.015   7.270
  349   3HG2  ILE  43          3HG2      ILE  43  -6.838  -9.102   5.774
  350   1HD1  ILE  43          1HD1      ILE  43  -6.256  -6.454   6.936
  351   2HD1  ILE  43          2HD1      ILE  43  -7.282  -5.034   6.726
  352   3HD1  ILE  43          3HD1      ILE  43  -7.366  -5.972   8.218
  353    H    GLY  44           H        GLY  44 -11.209  -7.933   5.039
  354   1HA   GLY  44          1HA       GLY  44 -13.394  -7.270   5.286
  355   2HA   GLY  44          2HA       GLY  44 -13.454  -8.189   6.780
  356    H    GLU  45           H        GLU  45 -11.154  -5.600   6.140
  357    HA   GLU  45           HA       GLU  45 -12.480  -4.058   8.277
  358   1HB   GLU  45          1HB       GLU  45  -9.552  -4.368   7.642
  359   2HB   GLU  45          2HB       GLU  45 -10.162  -3.096   8.688
  360   1HG   GLU  45          1HG       GLU  45 -10.361  -6.065   9.138
  361   2HG   GLU  45          2HG       GLU  45  -9.355  -4.920  10.022
  362    H    GLU  46           H        GLU  46 -12.652  -3.960   5.221
  363    HA   GLU  46           HA       GLU  46 -11.486  -1.415   4.544
  364   1HB   GLU  46          1HB       GLU  46 -12.530  -1.714   2.373
  365   2HB   GLU  46          2HB       GLU  46 -11.730  -3.199   2.865
  366   1HG   GLU  46          1HG       GLU  46 -13.781  -4.245   3.378
  367   2HG   GLU  46          2HG       GLU  46 -14.667  -2.726   3.252
  368    H    GLY  47           H        GLY  47 -13.559  -1.641   6.723
  369   1HA   GLY  47          1HA       GLY  47 -15.884  -0.260   5.787
  370   2HA   GLY  47          2HA       GLY  47 -15.422  -0.501   7.467
  371    H    ALA  48           H        ALA  48 -12.723   0.713   6.584
  372    HA   ALA  48           HA       ALA  48 -13.411   3.451   7.196
  373   1HB   ALA  48          1HB       ALA  48 -11.430   2.417   8.203
  374   2HB   ALA  48          2HB       ALA  48 -10.730   2.199   6.598
  375   3HB   ALA  48          3HB       ALA  48 -10.999   3.824   7.231
  376    H    THR  49           H        THR  49 -13.132   5.210   5.819
  377    HA   THR  49           HA       THR  49 -13.492   4.608   3.032
  378    HB   THR  49           HB       THR  49 -13.182   7.329   4.314
  379    HG1  THR  49           HG1      THR  49 -14.985   5.846   5.066
  380   1HG2  THR  49          1HG2      THR  49 -12.921   7.326   1.882
  381   2HG2  THR  49          2HG2      THR  49 -14.448   6.461   1.711
  382   3HG2  THR  49          3HG2      THR  49 -14.432   8.107   2.347
  383    H    VAL  50           H        VAL  50 -11.562   3.711   2.335
  384    HA   VAL  50           HA       VAL  50  -9.037   4.856   2.933
  385    HB   VAL  50           HB       VAL  50  -9.654   2.974   0.650
  386   1HG1  VAL  50          1HG1      VAL  50  -7.311   2.276   0.971
  387   2HG1  VAL  50          2HG1      VAL  50  -7.452   3.975   0.518
  388   3HG1  VAL  50          3HG1      VAL  50  -7.122   3.532   2.193
  389   1HG2  VAL  50          1HG2      VAL  50  -9.014   2.343   3.529
  390   2HG2  VAL  50          2HG2      VAL  50 -10.536   2.025   2.696
  391   3HG2  VAL  50          3HG2      VAL  50  -9.074   1.162   2.220
  392    H    THR  51           H        THR  51  -8.914   6.931   2.362
  393    HA   THR  51           HA       THR  51  -8.785   7.471  -0.518
  394    HB   THR  51           HB       THR  51 -10.806   8.569   0.274
  395    HG1  THR  51           HG1      THR  51 -10.387  10.402  -0.714
  396   1HG2  THR  51          1HG2      THR  51 -10.282   8.705   2.652
  397   2HG2  THR  51          2HG2      THR  51  -9.056   9.927   2.315
  398   3HG2  THR  51          3HG2      THR  51 -10.758  10.281   2.022
  399    H    SER  52           H        SER  52  -7.680   9.730  -0.704
  400    HA   SER  52           HA       SER  52  -5.007   9.526  -0.237
  401   1HB   SER  52          1HB       SER  52  -6.764  11.956  -0.497
  402   2HB   SER  52          2HB       SER  52  -5.007  11.969  -0.722
  403    HG   SER  52           HG       SER  52  -5.246  11.025  -2.616
  404    H    GLU  53           H        GLU  53  -7.432  10.637   2.008
  405    HA   GLU  53           HA       GLU  53  -5.577  11.973   3.738
  406   1HB   GLU  53          1HB       GLU  53  -7.830  12.784   3.687
  407   2HB   GLU  53          2HB       GLU  53  -8.468  11.194   4.085
  408   1HG   GLU  53          1HG       GLU  53  -7.705  11.324   6.301
  409   2HG   GLU  53          2HG       GLU  53  -6.649  12.687   5.941
  410    H    GLU  54           H        GLU  54  -7.026   8.754   3.601
  411    HA   GLU  54           HA       GLU  54  -5.846   8.125   6.195
  412   1HB   GLU  54          1HB       GLU  54  -7.659   6.462   4.435
  413   2HB   GLU  54          2HB       GLU  54  -7.074   5.983   6.025
  414   1HG   GLU  54          1HG       GLU  54  -8.143   8.219   6.803
  415   2HG   GLU  54          2HG       GLU  54  -9.044   8.103   5.294
  416    H    CYS  55           H        CYS  55  -5.437   7.408   2.790
  417    HA   CYS  55           HA       CYS  55  -2.991   5.940   3.506
  418   1HB   CYS  55          1HB       CYS  55  -2.964   5.164   1.143
  419   2HB   CYS  55          2HB       CYS  55  -4.405   4.649   2.010
  420    HG   CYS  55           HG       CYS  55  -4.423   7.408   0.017
  421    H    ARG  56           H        ARG  56  -1.559   7.521   3.886
  422    HA   ARG  56           HA       ARG  56  -1.517   9.880   2.169
  423   1HB   ARG  56          1HB       ARG  56  -0.156   9.251   4.788
  424   2HB   ARG  56          2HB       ARG  56   0.053  10.760   3.910
  425   1HG   ARG  56          1HG       ARG  56  -2.251  11.324   4.195
  426   2HG   ARG  56          2HG       ARG  56  -2.605   9.734   4.873
  427   1HD   ARG  56          1HD       ARG  56  -1.239  10.214   6.805
  428   2HD   ARG  56          2HD       ARG  56  -0.740  11.755   6.109
  429    HE   ARG  56           HE       ARG  56  -2.987  12.555   6.415
  430   1HH1  ARG  56          1HH1      ARG  56  -2.234   9.514   7.994
  431   2HH1  ARG  56          2HH1      ARG  56  -3.542   9.638   9.128
  432   1HH2  ARG  56          1HH2      ARG  56  -4.711  12.732   7.917
  433   2HH2  ARG  56          2HH2      ARG  56  -4.946  11.476   9.092
  434    H    PHE  57           H        PHE  57  -0.077  10.146   0.620
  435    HA   PHE  57           HA       PHE  57   1.910   8.157   0.105
  436   1HB   PHE  57          1HB       PHE  57   0.681   9.322  -1.702
  437   2HB   PHE  57          2HB       PHE  57   1.468  10.829  -1.244
  438    HD1  PHE  57           HD1      PHE  57   3.430  11.444  -2.290
  439    HD2  PHE  57           HD2      PHE  57   2.265   7.353  -2.306
  440    HE1  PHE  57           HE1      PHE  57   5.307  10.918  -3.789
  441    HE2  PHE  57           HE2      PHE  57   4.142   6.819  -3.802
  442    HZ   PHE  57           HZ       PHE  57   5.665   8.604  -4.547
  443    H    CYS  58           H        CYS  58   3.925   8.109   0.832
  444    HA   CYS  58           HA       CYS  58   4.935  10.372   2.349
  445   1HB   CYS  58          1HB       CYS  58   6.176   7.652   1.890
  446   2HB   CYS  58          2HB       CYS  58   6.702   8.852   3.067
  447    HG   CYS  58           HG       CYS  58   5.462   7.390   4.834
  448    H    HIS  59           H        HIS  59   6.335   8.228  -0.135
  449    HA   HIS  59           HA       HIS  59   7.232  10.268  -1.831
  450   1HB   HIS  59          1HB       HIS  59   9.664  10.196  -1.395
  451   2HB   HIS  59          2HB       HIS  59   8.782  10.864  -0.032
  452    HD1  HIS  59           HD1      HIS  59   9.279   9.852   2.204
  453    HD2  HIS  59           HD2      HIS  59  10.477   7.406  -0.945
  454    HE1  HIS  59           HE1      HIS  59  10.487   7.914   3.260
  455    HE2  HIS  59           HE2      HIS  59  11.093   6.382   1.349
  456    H    SER  60           H        SER  60   9.217   9.304  -3.175
  457    HA   SER  60           HA       SER  60   8.708   6.427  -3.572
  458   1HB   SER  60          1HB       SER  60   9.566   8.432  -5.678
  459   2HB   SER  60          2HB       SER  60   9.127   6.744  -5.941
  460    HG   SER  60           HG       SER  60   7.457   8.900  -5.168
  461    H    GLU  61           H        GLU  61  10.431   5.144  -3.272
  462    HA   GLU  61           HA       GLU  61  13.114   6.324  -3.515
  463   1HB   GLU  61          1HB       GLU  61  13.839   5.088  -1.504
  464   2HB   GLU  61          2HB       GLU  61  12.611   6.290  -1.135
  465   1HG   GLU  61          1HG       GLU  61  10.914   4.515  -1.086
  466   2HG   GLU  61          2HG       GLU  61  12.174   3.325  -1.414
  467    H    LYS  62           H        LYS  62  14.784   4.390  -3.318
  468    HA   LYS  62           HA       LYS  62  14.253   2.637  -5.475
  469   1HB   LYS  62          1HB       LYS  62  16.385   1.578  -4.926
  470   2HB   LYS  62          2HB       LYS  62  16.538   3.328  -4.897
  471   1HG   LYS  62          1HG       LYS  62  16.625   3.387  -2.548
  472   2HG   LYS  62          2HG       LYS  62  16.063   1.722  -2.409
  473   1HD   LYS  62          1HD       LYS  62  18.145   0.945  -3.452
  474   2HD   LYS  62          2HD       LYS  62  18.706   2.615  -3.559
  475   1HE   LYS  62          1HE       LYS  62  18.772   2.821  -1.182
  476   2HE   LYS  62          2HE       LYS  62  17.960   1.270  -0.970
  477   1HZ   LYS  62          1HZ       LYS  62  20.633   1.591  -2.225
  478   2HZ   LYS  62          2HZ       LYS  62  20.382   1.186  -0.593
  479   3HZ   LYS  62          3HZ       LYS  62  19.861   0.136  -1.818
  480    H    ALA  63           H        ALA  63  13.826   0.440  -5.489
  481    HA   ALA  63           HA       ALA  63  12.420  -0.486  -3.113
  482   1HB   ALA  63          1HB       ALA  63  11.364  -2.090  -4.530
  483   2HB   ALA  63          2HB       ALA  63  11.330  -0.527  -5.349
  484   3HB   ALA  63          3HB       ALA  63  12.499  -1.752  -5.840
  485    HA   PRO  64           HA       PRO  64  15.753  -3.358  -2.098
  486   1HB   PRO  64          1HB       PRO  64  13.606  -4.506  -0.413
  487   2HB   PRO  64          2HB       PRO  64  15.224  -3.970   0.048
  488   1HG   PRO  64          1HG       PRO  64  13.048  -2.558   0.715
  489   2HG   PRO  64          2HG       PRO  64  14.576  -1.765   0.282
  490   1HD   PRO  64          1HD       PRO  64  12.092  -2.116  -1.348
  491   2HD   PRO  64          2HD       PRO  64  13.193  -0.725  -1.252
  492    H    ASP  65           H        ASP  65  16.166  -5.198  -3.188
  493    HA   ASP  65           HA       ASP  65  14.438  -6.128  -5.155
  494   1HB   ASP  65          1HB       ASP  65  16.896  -6.392  -5.190
  495   2HB   ASP  65          2HB       ASP  65  16.767  -7.604  -3.920
  496    H    GLU  66           H        GLU  66  14.850  -7.164  -1.865
  497    HA   GLU  66           HA       GLU  66  13.569  -9.645  -1.933
  498   1HB   GLU  66          1HB       GLU  66  14.876  -8.874  -0.037
  499   2HB   GLU  66          2HB       GLU  66  13.718  -7.589   0.274
  500   1HG   GLU  66          1HG       GLU  66  12.024  -9.222   0.852
  501   2HG   GLU  66          2HG       GLU  66  13.137 -10.536   0.470
  502    H    VAL  67           H        VAL  67  12.194  -6.475  -2.233
  503    HA   VAL  67           HA       VAL  67   9.529  -7.502  -1.507
  504    HB   VAL  67           HB       VAL  67   8.801  -5.306  -1.138
  505   1HG1  VAL  67          1HG1      VAL  67  11.698  -5.338  -0.329
  506   2HG1  VAL  67          2HG1      VAL  67  10.448  -4.295   0.351
  507   3HG1  VAL  67          3HG1      VAL  67  10.358  -6.042   0.578
  508   1HG2  VAL  67          1HG2      VAL  67   9.981  -3.289  -1.839
  509   2HG2  VAL  67          2HG2      VAL  67  11.232  -4.277  -2.593
  510   3HG2  VAL  67          3HG2      VAL  67   9.586  -4.309  -3.223
  511    H    ILE  68           H        ILE  68  11.420  -7.007  -4.201
  512    HA   ILE  68           HA       ILE  68   9.537  -5.565  -5.807
  513    HB   ILE  68           HB       ILE  68  12.159  -6.860  -6.540
  514   1HG1  ILE  68          1HG1      ILE  68  11.353  -4.016  -5.918
  515   2HG1  ILE  68          2HG1      ILE  68  12.299  -5.068  -4.878
  516   1HG2  ILE  68          1HG2      ILE  68  10.727  -6.628  -8.513
  517   2HG2  ILE  68          2HG2      ILE  68  10.450  -4.932  -8.119
  518   3HG2  ILE  68          3HG2      ILE  68  12.066  -5.479  -8.567
  519   1HD1  ILE  68          1HD1      ILE  68  13.114  -3.938  -7.536
  520   2HD1  ILE  68          2HD1      ILE  68  13.738  -3.503  -5.943
  521   3HD1  ILE  68          3HD1      ILE  68  14.057  -5.105  -6.608
  522    H    GLU  69           H        GLU  69  10.514  -8.956  -5.579
  523    HA   GLU  69           HA       GLU  69   9.171  -9.765  -7.935
  524   1HB   GLU  69          1HB       GLU  69  10.869 -11.170  -6.824
  525   2HB   GLU  69          2HB       GLU  69   9.765 -11.423  -5.478
  526   1HG   GLU  69          1HG       GLU  69   8.257 -12.652  -6.820
  527   2HG   GLU  69          2HG       GLU  69   9.082 -12.177  -8.303
  528    H    ALA  70           H        ALA  70   8.146  -9.538  -4.555
  529    HA   ALA  70           HA       ALA  70   5.563 -10.571  -4.831
  530   1HB   ALA  70          1HB       ALA  70   5.014  -9.320  -2.815
  531   2HB   ALA  70          2HB       ALA  70   6.600 -10.078  -2.668
  532   3HB   ALA  70          3HB       ALA  70   6.477  -8.351  -3.003
  533    H    ILE  71           H        ILE  71   6.745  -7.251  -5.246
  534    HA   ILE  71           HA       ILE  71   4.243  -6.116  -5.933
  535    HB   ILE  71           HB       ILE  71   7.022  -5.170  -6.669
  536   1HG1  ILE  71          1HG1      ILE  71   5.230  -4.385  -4.362
  537   2HG1  ILE  71          2HG1      ILE  71   6.654  -5.411  -4.236
  538   1HG2  ILE  71          1HG2      ILE  71   4.405  -3.669  -6.633
  539   2HG2  ILE  71          2HG2      ILE  71   5.990  -2.968  -6.954
  540   3HG2  ILE  71          3HG2      ILE  71   5.303  -4.149  -8.072
  541   1HD1  ILE  71          1HD1      ILE  71   8.057  -3.550  -4.954
  542   2HD1  ILE  71          2HD1      ILE  71   6.627  -2.525  -5.083
  543   3HD1  ILE  71          3HD1      ILE  71   7.128  -3.146  -3.512
  544    H    LYS  72           H        LYS  72   6.769  -7.696  -7.778
  545    HA   LYS  72           HA       LYS  72   5.858  -6.998 -10.354
  546   1HB   LYS  72          1HB       LYS  72   8.108  -7.867  -9.909
  547   2HB   LYS  72          2HB       LYS  72   7.425  -9.417  -9.445
  548   1HG   LYS  72          1HG       LYS  72   6.621  -9.770 -11.702
  549   2HG   LYS  72          2HG       LYS  72   7.223  -8.182 -12.182
  550   1HD   LYS  72          1HD       LYS  72   8.922 -10.455 -11.152
  551   2HD   LYS  72          2HD       LYS  72   8.741 -10.005 -12.849
  552   1HE   LYS  72          1HE       LYS  72   9.847  -8.236 -10.671
  553   2HE   LYS  72          2HE       LYS  72  10.807  -9.113 -11.860
  554   1HZ   LYS  72          1HZ       LYS  72   9.621  -7.838 -13.604
  555   2HZ   LYS  72          2HZ       LYS  72   8.883  -6.908 -12.393
  556   3HZ   LYS  72          3HZ       LYS  72  10.572  -6.867 -12.585
  557    H    GLN  73           H        GLN  73   5.020  -9.616  -8.164
  558    HA   GLN  73           HA       GLN  73   3.407 -10.939 -10.169
  559   1HB   GLN  73          1HB       GLN  73   3.798 -11.526  -7.232
  560   2HB   GLN  73          2HB       GLN  73   2.859 -12.524  -8.333
  561   1HG   GLN  73          1HG       GLN  73   4.882 -12.908  -9.674
  562   2HG   GLN  73          2HG       GLN  73   5.810 -11.959  -8.515
  563   1HE2  GLN  73          2HE2      GLN  73   4.124 -14.933  -9.097
  564   2HE2  GLN  73          1HE2      GLN  73   4.732 -15.785  -7.716
  565    H    ASN  74           H        ASN  74   2.840  -9.062  -7.208
  566    HA   ASN  74           HA       ASN  74  -0.042  -9.439  -7.526
  567   1HB   ASN  74          1HB       ASN  74   1.578  -8.224  -5.283
  568   2HB   ASN  74          2HB       ASN  74  -0.179  -8.340  -5.285
  569   1HD2  ASN  74          2HD2      ASN  74   2.810 -10.079  -5.038
  570   2HD2  ASN  74          1HD2      ASN  74   2.129 -11.577  -4.489
  571    H    GLY  75           H        GLY  75   2.381  -6.948  -7.799
  572   1HA   GLY  75          1HA       GLY  75   2.038  -4.908  -8.959
  573   2HA   GLY  75          2HA       GLY  75   0.309  -5.063  -8.666
  574    H    TYR  76           H        TYR  76   1.545  -5.878  -5.826
  575    HA   TYR  76           HA       TYR  76   2.168  -3.266  -4.774
  576   1HB   TYR  76          1HB       TYR  76   0.271  -3.203  -3.212
  577   2HB   TYR  76          2HB       TYR  76  -0.286  -3.170  -4.880
  578    HD1  TYR  76           HD1      TYR  76  -0.344  -4.967  -1.738
  579    HD2  TYR  76           HD2      TYR  76  -1.308  -5.225  -5.871
  580    HE1  TYR  76           HE1      TYR  76  -1.816  -6.878  -1.268
  581    HE2  TYR  76           HE2      TYR  76  -2.787  -7.137  -5.413
  582    HH   TYR  76           HH       TYR  76  -3.061  -8.893  -3.703
  583    H    PHE  77           H        PHE  77   3.028  -3.349  -2.691
  584    HA   PHE  77           HA       PHE  77   3.255  -6.024  -1.479
  585   1HB   PHE  77          1HB       PHE  77   5.421  -5.263  -2.421
  586   2HB   PHE  77          2HB       PHE  77   5.330  -3.814  -1.429
  587    HD1  PHE  77           HD1      PHE  77   6.034  -3.834   0.822
  588    HD2  PHE  77           HD2      PHE  77   5.641  -7.495  -1.312
  589    HE1  PHE  77           HE1      PHE  77   7.177  -5.017   2.649
  590    HE2  PHE  77           HE2      PHE  77   6.788  -8.683   0.512
  591    HZ   PHE  77           HZ       PHE  77   7.557  -7.444   2.497
  592    H    ILE  78           H        ILE  78   1.966  -6.021   0.238
  593    HA   ILE  78           HA       ILE  78   1.425  -3.593   1.712
  594    HB   ILE  78           HB       ILE  78   0.517  -6.424   2.274
  595   1HG1  ILE  78          1HG1      ILE  78  -0.328  -5.599   0.119
  596   2HG1  ILE  78          2HG1      ILE  78  -1.629  -5.738   1.298
  597   1HG2  ILE  78          1HG2      ILE  78   0.466  -5.019   4.265
  598   2HG2  ILE  78          2HG2      ILE  78  -0.462  -3.799   3.396
  599   3HG2  ILE  78          3HG2      ILE  78  -1.170  -5.382   3.715
  600   1HD1  ILE  78          1HD1      ILE  78  -0.242  -3.190   0.490
  601   2HD1  ILE  78          2HD1      ILE  78  -1.849  -3.712  -0.014
  602   3HD1  ILE  78          3HD1      ILE  78  -1.540  -3.328   1.678
  603    H    TYR  79           H        TYR  79   3.220  -2.964   2.838
  604    HA   TYR  79           HA       TYR  79   4.648  -4.923   4.432
  605   1HB   TYR  79          1HB       TYR  79   5.983  -3.168   3.400
  606   2HB   TYR  79          2HB       TYR  79   5.016  -1.928   4.197
  607    HD1  TYR  79           HD1      TYR  79   5.491  -1.249   6.416
  608    HD2  TYR  79           HD2      TYR  79   7.416  -4.686   4.811
  609    HE1  TYR  79           HE1      TYR  79   6.977  -1.324   8.374
  610    HE2  TYR  79           HE2      TYR  79   8.911  -4.767   6.761
  611    HH   TYR  79           HH       TYR  79   8.333  -3.012   9.587
  612    H    LYS  80           H        LYS  80   3.724  -5.586   6.225
  613    HA   LYS  80           HA       LYS  80   1.859  -3.966   7.684
  614   1HB   LYS  80          1HB       LYS  80   3.154  -6.551   8.566
  615   2HB   LYS  80          2HB       LYS  80   1.663  -5.845   9.177
  616   1HG   LYS  80          1HG       LYS  80   0.578  -6.224   7.041
  617   2HG   LYS  80          2HG       LYS  80   2.080  -6.868   6.376
  618   1HD   LYS  80          1HD       LYS  80   2.021  -8.635   8.123
  619   2HD   LYS  80          2HD       LYS  80   0.437  -8.033   8.616
  620   1HE   LYS  80          1HE       LYS  80  -0.423  -8.486   6.369
  621   2HE   LYS  80          2HE       LYS  80   1.160  -9.088   5.885
  622   1HZ   LYS  80          1HZ       LYS  80   0.935 -10.782   7.667
  623   2HZ   LYS  80          2HZ       LYS  80  -0.662 -10.269   7.907
  624   3HZ   LYS  80          3HZ       LYS  80  -0.201 -10.941   6.418
  625    H    MET  81           H        MET  81   2.903  -2.165   8.378
  626    HA   MET  81           HA       MET  81   5.464  -1.956   9.407
  627   1HB   MET  81          1HB       MET  81   4.068  -0.042   8.730
  628   2HB   MET  81          2HB       MET  81   3.039  -0.300  10.130
  629   1HG   MET  81          1HG       MET  81   4.976   0.161  11.590
  630   2HG   MET  81          2HG       MET  81   5.937   0.510  10.153
  631   1HE   MET  81          1HE       MET  81   3.751   1.943   8.309
  632   2HE   MET  81          2HE       MET  81   5.406   2.531   8.481
  633   3HE   MET  81          3HE       MET  81   4.051   3.637   8.697
  634    H    GLU  82           H        GLU  82   2.477  -1.902  11.339
  635    HA   GLU  82           HA       GLU  82   3.535  -3.804  13.218
  636   1HB   GLU  82          1HB       GLU  82   4.542  -1.506  13.809
  637   2HB   GLU  82          2HB       GLU  82   2.915  -1.061  14.306
  638   1HG   GLU  82          1HG       GLU  82   2.900  -2.781  15.981
  639   2HG   GLU  82          2HG       GLU  82   4.447  -3.403  15.410
  640    H    GLY  83           H        GLY  83   1.194  -3.043  11.413
  641   1HA   GLY  83          1HA       GLY  83  -1.071  -2.587  13.061
  642   2HA   GLY  83          2HA       GLY  83  -1.098  -3.175  11.406
  643    H    CYS  84           H        CYS  84   0.597  -5.476  12.034
  644    HA   CYS  84           HA       CYS  84  -1.449  -7.132  13.323
  645   1HB   CYS  84          1HB       CYS  84   0.856  -7.982  11.558
  646   2HB   CYS  84          2HB       CYS  84  -0.446  -9.011  12.146
  647    HG   CYS  84           HG       CYS  84  -1.608  -8.762   9.848
  648    H    ASN  85           H        ASN  85  -1.030  -7.195  15.434
  649    HA   ASN  85           HA       ASN  85   1.701  -7.171  16.411
  650   1HB   ASN  85          1HB       ASN  85  -0.104  -5.761  17.444
  651   2HB   ASN  85          2HB       ASN  85  -0.873  -7.243  18.000
  652   1HD2  ASN  85          2HD2      ASN  85   0.032  -8.389  19.691
  653   2HD2  ASN  85          1HD2      ASN  85   1.286  -7.734  20.690
  Start of MODEL   18
    1    H    MET   1           H        MET   1  14.223  -0.427 -10.463
    2    HA   MET   1           HA       MET   1  12.054   0.532 -10.218
    3   1HB   MET   1          1HB       MET   1  12.398  -1.911  -9.883
    4   2HB   MET   1          2HB       MET   1  12.565  -1.626  -8.159
    5   1HG   MET   1          1HG       MET   1  10.276  -0.827  -8.045
    6   2HG   MET   1          2HG       MET   1  10.103  -1.043  -9.786
    7   1HE   MET   1          1HE       MET   1   8.112  -2.291  -7.606
    8   2HE   MET   1          2HE       MET   1   7.871  -3.908  -8.266
    9   3HE   MET   1          3HE       MET   1   7.901  -2.513  -9.343
   10    H    GLN   2           H        GLN   2  11.043   2.170  -9.294
   11    HA   GLN   2           HA       GLN   2  11.791   2.939  -6.558
   12   1HB   GLN   2          1HB       GLN   2  10.424   4.515  -8.753
   13   2HB   GLN   2          2HB       GLN   2  10.787   5.133  -7.146
   14   1HG   GLN   2          1HG       GLN   2  12.887   4.107  -9.031
   15   2HG   GLN   2          2HG       GLN   2  12.384   5.795  -8.962
   16   1HE2  GLN   2          2HE2      GLN   2  14.962   4.498  -8.386
   17   2HE2  GLN   2          1HE2      GLN   2  15.378   4.990  -6.781
   18    H    ILE   3           H        ILE   3  10.405   2.571  -4.963
   19    HA   ILE   3           HA       ILE   3   7.697   1.722  -5.670
   20    HB   ILE   3           HB       ILE   3   7.589   1.049  -3.220
   21   1HG1  ILE   3          1HG1      ILE   3  10.578   1.483  -3.441
   22   2HG1  ILE   3          2HG1      ILE   3   9.478   2.408  -2.427
   23   1HG2  ILE   3          1HG2      ILE   3   7.820  -0.570  -4.976
   24   2HG2  ILE   3          2HG2      ILE   3   9.555  -0.268  -5.077
   25   3HG2  ILE   3          3HG2      ILE   3   8.874  -1.022  -3.637
   26   1HD1  ILE   3          1HD1      ILE   3  10.715   0.773  -1.130
   27   2HD1  ILE   3          2HD1      ILE   3   8.990   0.401  -1.128
   28   3HD1  ILE   3          3HD1      ILE   3  10.093  -0.525  -2.148
   29    H    HIS   4           H        HIS   4   5.996   2.937  -5.365
   30    HA   HIS   4           HA       HIS   4   6.225   5.482  -4.016
   31   1HB   HIS   4          1HB       HIS   4   4.016   4.089  -5.515
   32   2HB   HIS   4          2HB       HIS   4   3.692   5.539  -4.570
   33    HD1  HIS   4           HD1      HIS   4   3.539   7.455  -6.119
   34    HD2  HIS   4           HD2      HIS   4   6.557   4.815  -7.215
   35    HE1  HIS   4           HE1      HIS   4   4.682   8.516  -8.084
   36    HE2  HIS   4           HE2      HIS   4   6.671   7.036  -8.535
   37    H    VAL   5           H        VAL   5   6.120   5.604  -1.899
   38    HA   VAL   5           HA       VAL   5   4.953   3.447  -0.366
   39    HB   VAL   5           HB       VAL   5   6.233   5.993   0.638
   40   1HG1  VAL   5          1HG1      VAL   5   6.532   4.726   2.720
   41   2HG1  VAL   5          2HG1      VAL   5   4.830   4.900   2.294
   42   3HG1  VAL   5          3HG1      VAL   5   5.658   3.368   2.011
   43   1HG2  VAL   5          1HG2      VAL   5   7.800   4.744  -0.744
   44   2HG2  VAL   5          2HG2      VAL   5   8.260   4.651   0.956
   45   3HG2  VAL   5          3HG2      VAL   5   7.469   3.278   0.180
   46    H    TYR   6           H        TYR   6   2.782   3.503  -0.406
   47    HA   TYR   6           HA       TYR   6   1.470   5.976   0.493
   48   1HB   TYR   6          1HB       TYR   6   0.300   3.487  -0.773
   49   2HB   TYR   6          2HB       TYR   6  -0.645   4.856  -0.205
   50    HD1  TYR   6           HD1      TYR   6  -0.556   7.006  -1.407
   51    HD2  TYR   6           HD2      TYR   6   1.494   3.571  -2.846
   52    HE1  TYR   6           HE1      TYR   6  -0.354   8.062  -3.620
   53    HE2  TYR   6           HE2      TYR   6   1.709   4.616  -5.060
   54    HH   TYR   6           HH       TYR   6   0.352   6.419  -6.368
   55    H    ASP   7           H        ASP   7   2.000   5.782   2.697
   56    HA   ASP   7           HA       ASP   7   1.360   3.358   4.093
   57   1HB   ASP   7          1HB       ASP   7   2.107   4.563   6.076
   58   2HB   ASP   7          2HB       ASP   7   3.281   4.700   4.784
   59    H    THR   8           H        THR   8  -0.537   2.848   4.869
   60    HA   THR   8           HA       THR   8  -2.642   4.889   4.738
   61    HB   THR   8           HB       THR   8  -3.041   1.903   4.906
   62    HG1  THR   8           HG1      THR   8  -1.773   3.054   2.993
   63   1HG2  THR   8          1HG2      THR   8  -5.185   2.425   3.839
   64   2HG2  THR   8          2HG2      THR   8  -5.006   3.301   5.359
   65   3HG2  THR   8          3HG2      THR   8  -4.766   4.139   3.825
   66    H    TYR   9           H        TYR   9  -3.740   5.511   6.491
   67    HA   TYR   9           HA       TYR   9  -3.195   4.162   9.052
   68   1HB   TYR   9          1HB       TYR   9  -4.374   6.897   8.498
   69   2HB   TYR   9          2HB       TYR   9  -4.098   6.221  10.094
   70    HD1  TYR   9           HD1      TYR   9  -2.030   6.479  11.164
   71    HD2  TYR   9           HD2      TYR   9  -2.361   7.349   7.012
   72    HE1  TYR   9           HE1      TYR   9   0.215   7.479  11.201
   73    HE2  TYR   9           HE2      TYR   9  -0.117   8.348   7.038
   74    HH   TYR   9           HH       TYR   9   1.556   9.105   8.372
   75    H    VAL  10           H        VAL  10  -4.720   2.431   8.671
   76    HA   VAL  10           HA       VAL  10  -7.512   3.187   8.284
   77    HB   VAL  10           HB       VAL  10  -6.336   0.422   8.627
   78   1HG1  VAL  10          1HG1      VAL  10  -8.456  -0.359   7.682
   79   2HG1  VAL  10          2HG1      VAL  10  -8.701   0.517   9.192
   80   3HG1  VAL  10          3HG1      VAL  10  -9.052   1.302   7.650
   81   1HG2  VAL  10          1HG2      VAL  10  -5.450   1.498   6.635
   82   2HG2  VAL  10          2HG2      VAL  10  -6.577   0.212   6.202
   83   3HG2  VAL  10          3HG2      VAL  10  -7.086   1.898   6.108
   84    H    LYS  11           H        LYS  11  -8.772   3.646   9.957
   85    HA   LYS  11           HA       LYS  11  -8.002   2.856  12.642
   86   1HB   LYS  11          1HB       LYS  11 -10.377   4.423  11.602
   87   2HB   LYS  11          2HB       LYS  11 -10.122   4.061  13.301
   88   1HG   LYS  11          1HG       LYS  11  -9.379   6.281  12.930
   89   2HG   LYS  11          2HG       LYS  11  -7.940   5.284  13.144
   90   1HD   LYS  11          1HD       LYS  11  -7.660   5.191  10.706
   91   2HD   LYS  11          2HD       LYS  11  -9.085   6.213  10.510
   92   1HE   LYS  11          1HE       LYS  11  -7.981   8.024  11.681
   93   2HE   LYS  11          2HE       LYS  11  -6.578   7.001  11.990
   94   1HZ   LYS  11          1HZ       LYS  11  -6.344   6.814   9.527
   95   2HZ   LYS  11          2HZ       LYS  11  -7.535   8.000   9.358
   96   3HZ   LYS  11          3HZ       LYS  11  -6.072   8.369  10.140
   97    H    ALA  12           H        ALA  12  -8.227   0.696  12.869
   98    HA   ALA  12           HA       ALA  12 -10.430  -0.737  11.723
   99   1HB   ALA  12          1HB       ALA  12  -9.431  -2.703  12.740
  100   2HB   ALA  12          2HB       ALA  12  -8.202  -1.738  11.921
  101   3HB   ALA  12          3HB       ALA  12  -8.340  -1.683  13.679
  102    H    LYS  13           H        LYS  13 -12.043  -1.865  12.806
  103    HA   LYS  13           HA       LYS  13 -13.305  -0.565  14.953
  104   1HB   LYS  13          1HB       LYS  13 -13.713  -3.400  13.981
  105   2HB   LYS  13          2HB       LYS  13 -14.852  -2.456  14.933
  106   1HG   LYS  13          1HG       LYS  13 -15.152  -0.910  13.109
  107   2HG   LYS  13          2HG       LYS  13 -13.929  -1.749  12.157
  108   1HD   LYS  13          1HD       LYS  13 -16.164  -2.389  11.437
  109   2HD   LYS  13          2HD       LYS  13 -15.320  -3.765  12.148
  110   1HE   LYS  13          1HE       LYS  13 -16.522  -3.413  14.250
  111   2HE   LYS  13          2HE       LYS  13 -17.360  -2.033  13.543
  112   1HZ   LYS  13          1HZ       LYS  13 -18.355  -3.519  11.911
  113   2HZ   LYS  13          2HZ       LYS  13 -17.552  -4.847  12.599
  114   3HZ   LYS  13          3HZ       LYS  13 -18.733  -4.014  13.489
  115    H    ASP  14           H        ASP  14 -10.879  -2.956  14.805
  116    HA   ASP  14           HA       ASP  14 -11.158  -4.075  17.409
  117   1HB   ASP  14          1HB       ASP  14  -8.740  -3.946  15.591
  118   2HB   ASP  14          2HB       ASP  14  -8.900  -4.979  17.007
  119    H    GLY  15           H        GLY  15 -10.621  -0.985  16.719
  120   1HA   GLY  15          1HA       GLY  15  -9.865   0.764  18.015
  121   2HA   GLY  15          2HA       GLY  15  -9.475  -0.406  19.268
  122    H    HIS  16           H        HIS  16  -8.216  -0.757  16.073
  123    HA   HIS  16           HA       HIS  16  -5.555  -0.027  17.089
  124   1HB   HIS  16          1HB       HIS  16  -6.450  -2.395  15.486
  125   2HB   HIS  16          2HB       HIS  16  -4.805  -1.793  15.310
  126    HD1  HIS  16           HD1      HIS  16  -7.125  -3.106  18.035
  127    HD2  HIS  16           HD2      HIS  16  -3.073  -2.668  17.203
  128    HE1  HIS  16           HE1      HIS  16  -5.917  -4.302  19.885
  129    HE2  HIS  16           HE2      HIS  16  -3.469  -4.146  19.287
  130    H    VAL  17           H        VAL  17  -4.491   1.444  15.969
  131    HA   VAL  17           HA       VAL  17  -5.521   2.413  13.454
  132    HB   VAL  17           HB       VAL  17  -2.962   3.196  14.874
  133   1HG1  VAL  17          1HG1      VAL  17  -2.984   3.796  12.513
  134   2HG1  VAL  17          2HG1      VAL  17  -4.542   4.596  12.718
  135   3HG1  VAL  17          3HG1      VAL  17  -3.109   5.235  13.524
  136   1HG2  VAL  17          1HG2      VAL  17  -5.693   4.473  15.008
  137   2HG2  VAL  17          2HG2      VAL  17  -4.891   3.596  16.310
  138   3HG2  VAL  17          3HG2      VAL  17  -4.219   5.119  15.728
  139    H    MET  18           H        MET  18  -5.240   0.981  11.855
  140    HA   MET  18           HA       MET  18  -2.884  -0.667  11.705
  141   1HB   MET  18          1HB       MET  18  -5.153  -0.348   9.732
  142   2HB   MET  18          2HB       MET  18  -3.929  -1.607   9.693
  143   1HG   MET  18          1HG       MET  18  -5.957  -1.205  11.880
  144   2HG   MET  18          2HG       MET  18  -6.055  -2.405  10.591
  145   1HE   MET  18          1HE       MET  18  -4.378  -4.437  10.332
  146   2HE   MET  18          2HE       MET  18  -3.004  -4.719  11.404
  147   3HE   MET  18          3HE       MET  18  -3.018  -3.314  10.336
  148    H    HIS  19           H        HIS  19  -1.207   0.770  11.432
  149    HA   HIS  19           HA       HIS  19  -1.207   2.384   8.996
  150   1HB   HIS  19          1HB       HIS  19  -0.493   3.429  11.157
  151   2HB   HIS  19          2HB       HIS  19   0.865   2.311  11.200
  152    HD1  HIS  19           HD1      HIS  19   2.792   3.890  10.845
  153    HD2  HIS  19           HD2      HIS  19  -0.226   4.393   8.029
  154    HE1  HIS  19           HE1      HIS  19   3.685   5.551   9.181
  155    HE2  HIS  19           HE2      HIS  19   1.804   5.927   7.541
  156    H    PHE  20           H        PHE  20  -0.777   1.100   7.329
  157    HA   PHE  20           HA       PHE  20   1.702  -0.472   7.448
  158   1HB   PHE  20          1HB       PHE  20   0.629  -2.056   5.824
  159   2HB   PHE  20          2HB       PHE  20  -0.092  -2.066   7.426
  160    HD1  PHE  20           HD1      PHE  20  -0.590  -1.251   3.904
  161    HD2  PHE  20           HD2      PHE  20  -2.325  -1.188   7.790
  162    HE1  PHE  20           HE1      PHE  20  -2.807  -0.879   2.905
  163    HE2  PHE  20           HE2      PHE  20  -4.542  -0.816   6.797
  164    HZ   PHE  20           HZ       PHE  20  -4.787  -0.662   4.351
  165    H    ASP  21           H        ASP  21   2.920  -0.559   5.528
  166    HA   ASP  21           HA       ASP  21   2.522   1.824   3.879
  167   1HB   ASP  21          1HB       ASP  21   4.913  -0.020   4.107
  168   2HB   ASP  21          2HB       ASP  21   4.853   1.457   3.151
  169    H    VAL  22           H        VAL  22   1.473   1.581   2.032
  170    HA   VAL  22           HA       VAL  22   1.470  -0.981   0.664
  171    HB   VAL  22           HB       VAL  22   0.144   1.610  -0.167
  172   1HG1  VAL  22          1HG1      VAL  22  -1.234   0.177  -1.603
  173   2HG1  VAL  22          2HG1      VAL  22   0.476   0.075  -2.024
  174   3HG1  VAL  22          3HG1      VAL  22  -0.284  -1.225  -1.106
  175   1HG2  VAL  22          1HG2      VAL  22  -1.926   0.631   0.710
  176   2HG2  VAL  22          2HG2      VAL  22  -1.011  -0.752   1.312
  177   3HG2  VAL  22          3HG2      VAL  22  -0.721   0.855   1.978
  178    H    PHE  23           H        PHE  23   3.457  -1.304  -0.208
  179    HA   PHE  23           HA       PHE  23   4.766   0.797  -1.713
  180   1HB   PHE  23          1HB       PHE  23   5.514  -2.105  -1.289
  181   2HB   PHE  23          2HB       PHE  23   6.505  -0.931  -2.148
  182    HD1  PHE  23           HD1      PHE  23   6.656   1.387  -0.615
  183    HD2  PHE  23           HD2      PHE  23   6.330  -2.620   0.773
  184    HE1  PHE  23           HE1      PHE  23   7.728   2.037   1.500
  185    HE2  PHE  23           HE2      PHE  23   7.401  -1.976   2.893
  186    HZ   PHE  23           HZ       PHE  23   8.101   0.355   3.258
  187    H    THR  24           H        THR  24   4.229   1.229  -3.727
  188    HA   THR  24           HA       THR  24   3.319  -0.982  -5.437
  189    HB   THR  24           HB       THR  24   1.826   0.798  -6.547
  190    HG1  THR  24           HG1      THR  24   2.238   2.000  -3.989
  191   1HG2  THR  24          1HG2      THR  24  -0.005   0.369  -4.973
  192   2HG2  THR  24          2HG2      THR  24   0.936  -1.091  -5.279
  193   3HG2  THR  24          3HG2      THR  24   1.158  -0.197  -3.775
  194    H    ASP  25           H        ASP  25   4.093  -1.027  -7.472
  195    HA   ASP  25           HA       ASP  25   6.127   0.848  -8.280
  196   1HB   ASP  25          1HB       ASP  25   6.369  -1.501  -8.887
  197   2HB   ASP  25          2HB       ASP  25   4.830  -1.469  -9.741
  198    H    VAL  26           H        VAL  26   2.797   0.119  -9.040
  199    HA   VAL  26           HA       VAL  26   2.397   1.868 -11.187
  200    HB   VAL  26           HB       VAL  26   0.392   1.148  -9.034
  201   1HG1  VAL  26          1HG1      VAL  26  -0.010   2.042 -11.887
  202   2HG1  VAL  26          2HG1      VAL  26  -1.284   1.564 -10.765
  203   3HG1  VAL  26          3HG1      VAL  26  -0.321   3.007 -10.443
  204   1HG2  VAL  26          1HG2      VAL  26  -0.292  -0.680 -10.519
  205   2HG2  VAL  26          2HG2      VAL  26   1.034  -0.282 -11.613
  206   3HG2  VAL  26          3HG2      VAL  26   1.379  -0.865  -9.985
  207    H    ARG  27           H        ARG  27   2.481   4.007 -11.263
  208    HA   ARG  27           HA       ARG  27   2.830   5.423  -8.739
  209   1HB   ARG  27          1HB       ARG  27   3.763   7.255 -10.159
  210   2HB   ARG  27          2HB       ARG  27   4.659   5.751 -10.220
  211   1HG   ARG  27          1HG       ARG  27   2.666   6.538 -12.324
  212   2HG   ARG  27          2HG       ARG  27   4.366   6.995 -12.393
  213   1HD   ARG  27          1HD       ARG  27   3.190   4.223 -12.448
  214   2HD   ARG  27          2HD       ARG  27   4.093   5.038 -13.722
  215    HE   ARG  27           HE       ARG  27   5.232   3.990 -11.212
  216   1HH1  ARG  27          1HH1      ARG  27   5.605   5.105 -14.510
  217   2HH1  ARG  27          2HH1      ARG  27   7.274   4.625 -14.622
  218   1HH2  ARG  27          1HH2      ARG  27   7.419   3.318 -11.364
  219   2HH2  ARG  27          2HH2      ARG  27   8.302   3.606 -12.827
  220    H    ASP  28           H        ASP  28   0.251   4.660  -9.472
  221    HA   ASP  28           HA       ASP  28  -1.063   7.190 -10.166
  222   1HB   ASP  28          1HB       ASP  28  -1.742   5.165 -11.434
  223   2HB   ASP  28          2HB       ASP  28  -2.240   4.409  -9.925
  224    H    ASP  29           H        ASP  29  -2.814   7.940  -8.833
  225    HA   ASP  29           HA       ASP  29  -2.266   7.560  -6.006
  226   1HB   ASP  29          1HB       ASP  29  -2.546   9.830  -6.823
  227   2HB   ASP  29          2HB       ASP  29  -4.128   9.436  -7.483
  228    H    LYS  30           H        LYS  30  -4.973   7.160  -8.242
  229    HA   LYS  30           HA       LYS  30  -6.850   6.448  -6.220
  230   1HB   LYS  30          1HB       LYS  30  -7.417   7.492  -8.426
  231   2HB   LYS  30          2HB       LYS  30  -7.032   5.961  -9.197
  232   1HG   LYS  30          1HG       LYS  30  -8.819   4.870  -7.957
  233   2HG   LYS  30          2HG       LYS  30  -9.195   6.393  -7.147
  234   1HD   LYS  30          1HD       LYS  30  -9.670   7.404  -9.356
  235   2HD   LYS  30          2HD       LYS  30  -9.395   5.831 -10.105
  236   1HE   LYS  30          1HE       LYS  30 -11.761   6.171  -9.818
  237   2HE   LYS  30          2HE       LYS  30 -11.220   4.897  -8.727
  238   1HZ   LYS  30          1HZ       LYS  30 -12.708   6.362  -7.573
  239   2HZ   LYS  30          2HZ       LYS  30 -11.149   6.570  -6.938
  240   3HZ   LYS  30          3HZ       LYS  30 -11.790   7.723  -8.004
  241    H    LYS  31           H        LYS  31  -4.885   4.650  -8.537
  242    HA   LYS  31           HA       LYS  31  -5.914   2.091  -8.055
  243   1HB   LYS  31          1HB       LYS  31  -3.201   3.039  -8.947
  244   2HB   LYS  31          2HB       LYS  31  -3.571   1.330  -8.773
  245   1HG   LYS  31          1HG       LYS  31  -4.982   3.276 -10.586
  246   2HG   LYS  31          2HG       LYS  31  -3.821   2.039 -11.075
  247   1HD   LYS  31          1HD       LYS  31  -5.343   0.306 -10.188
  248   2HD   LYS  31          2HD       LYS  31  -6.515   1.567  -9.798
  249   1HE   LYS  31          1HE       LYS  31  -6.627   2.177 -12.170
  250   2HE   LYS  31          2HE       LYS  31  -5.472   0.900 -12.549
  251   1HZ   LYS  31          1HZ       LYS  31  -7.097  -0.696 -11.590
  252   2HZ   LYS  31          2HZ       LYS  31  -8.217   0.570 -11.464
  253   3HZ   LYS  31          3HZ       LYS  31  -7.649   0.088 -12.986
  254    H    ALA  32           H        ALA  32  -3.402   3.909  -6.370
  255    HA   ALA  32           HA       ALA  32  -2.467   1.872  -4.693
  256   1HB   ALA  32          1HB       ALA  32  -1.334   4.021  -4.952
  257   2HB   ALA  32          2HB       ALA  32  -2.663   4.826  -4.117
  258   3HB   ALA  32          3HB       ALA  32  -1.653   3.667  -3.255
  259    H    ILE  33           H        ILE  33  -5.022   4.273  -4.190
  260    HA   ILE  33           HA       ILE  33  -5.823   3.417  -1.636
  261    HB   ILE  33           HB       ILE  33  -7.426   4.794  -3.795
  262   1HG1  ILE  33          1HG1      ILE  33  -5.993   5.918  -1.375
  263   2HG1  ILE  33          2HG1      ILE  33  -5.397   6.004  -3.030
  264   1HG2  ILE  33          1HG2      ILE  33  -8.944   5.468  -2.008
  265   2HG2  ILE  33          2HG2      ILE  33  -8.873   3.712  -2.163
  266   3HG2  ILE  33          3HG2      ILE  33  -8.010   4.515  -0.853
  267   1HD1  ILE  33          1HD1      ILE  33  -7.937   7.255  -2.013
  268   2HD1  ILE  33          2HD1      ILE  33  -6.419   8.096  -2.326
  269   3HD1  ILE  33          3HD1      ILE  33  -7.311   7.362  -3.659
  270    H    GLU  34           H        GLU  34  -6.804   2.444  -4.878
  271    HA   GLU  34           HA       GLU  34  -8.924   0.749  -4.117
  272   1HB   GLU  34          1HB       GLU  34  -8.594   1.525  -6.427
  273   2HB   GLU  34          2HB       GLU  34  -7.122   0.570  -6.539
  274   1HG   GLU  34          1HG       GLU  34  -8.393  -1.474  -6.291
  275   2HG   GLU  34          2HG       GLU  34  -9.877  -0.548  -6.078
  276    H    PHE  35           H        PHE  35  -5.471   0.155  -4.636
  277    HA   PHE  35           HA       PHE  35  -5.575  -2.644  -4.272
  278   1HB   PHE  35          1HB       PHE  35  -3.280  -0.714  -3.909
  279   2HB   PHE  35          2HB       PHE  35  -3.111  -2.464  -3.857
  280    HD1  PHE  35           HD1      PHE  35  -1.810  -0.388  -5.759
  281    HD2  PHE  35           HD2      PHE  35  -5.181  -2.965  -6.105
  282    HE1  PHE  35           HE1      PHE  35  -1.530  -0.419  -8.202
  283    HE2  PHE  35           HE2      PHE  35  -4.904  -3.001  -8.550
  284    HZ   PHE  35           HZ       PHE  35  -3.077  -1.728  -9.601
  285    H    ALA  36           H        ALA  36  -5.092   0.020  -2.012
  286    HA   ALA  36           HA       ALA  36  -4.495  -1.482   0.275
  287   1HB   ALA  36          1HB       ALA  36  -4.289   0.957   0.173
  288   2HB   ALA  36          2HB       ALA  36  -6.046   1.102   0.113
  289   3HB   ALA  36          3HB       ALA  36  -5.264   0.445   1.550
  290    H    LYS  37           H        LYS  37  -7.596  -0.581  -1.161
  291    HA   LYS  37           HA       LYS  37  -9.151  -1.791   0.906
  292   1HB   LYS  37          1HB       LYS  37  -9.828  -0.773  -1.843
  293   2HB   LYS  37          2HB       LYS  37 -11.025  -1.556  -0.815
  294   1HG   LYS  37          1HG       LYS  37 -10.475   0.132   0.942
  295   2HG   LYS  37          2HG       LYS  37  -9.505   0.976  -0.262
  296   1HD   LYS  37          1HD       LYS  37 -12.267   0.295  -1.057
  297   2HD   LYS  37          2HD       LYS  37 -12.102   1.516   0.204
  298   1HE   LYS  37          1HE       LYS  37 -12.201   2.545  -2.001
  299   2HE   LYS  37          2HE       LYS  37 -10.635   2.824  -1.244
  300   1HZ   LYS  37          1HZ       LYS  37  -9.715   1.040  -2.592
  301   2HZ   LYS  37          2HZ       LYS  37 -11.222   0.786  -3.328
  302   3HZ   LYS  37          3HZ       LYS  37 -10.393   2.249  -3.566
  303    H    GLN  38           H        GLN  38  -7.731  -2.896  -2.058
  304    HA   GLN  38           HA       GLN  38  -9.146  -5.297  -2.389
  305   1HB   GLN  38          1HB       GLN  38  -6.242  -4.697  -2.988
  306   2HB   GLN  38          2HB       GLN  38  -7.084  -6.147  -3.516
  307   1HG   GLN  38          1HG       GLN  38  -7.780  -3.325  -4.291
  308   2HG   GLN  38          2HG       GLN  38  -6.917  -4.491  -5.290
  309   1HE2  GLN  38          2HE2      GLN  38  -8.582  -6.730  -4.419
  310   2HE2  GLN  38          1HE2      GLN  38 -10.106  -6.530  -5.219
  311    H    TRP  39           H        TRP  39  -6.268  -4.554  -0.462
  312    HA   TRP  39           HA       TRP  39  -5.920  -7.163   0.570
  313   1HB   TRP  39          1HB       TRP  39  -4.131  -5.486   0.618
  314   2HB   TRP  39          2HB       TRP  39  -5.068  -4.503   1.736
  315    HD1  TRP  39           HD1      TRP  39  -3.389  -7.997   1.628
  316    HE1  TRP  39           HE1      TRP  39  -2.627  -8.591   4.019
  317    HE3  TRP  39           HE3      TRP  39  -5.279  -3.942   4.105
  318    HZ2  TRP  39           HZ2      TRP  39  -2.808  -7.479   6.604
  319    HZ3  TRP  39           HZ3      TRP  39  -4.938  -3.783   6.536
  320    HH2  TRP  39           HH2      TRP  39  -3.728  -5.517   7.759
  321    H    LEU  40           H        LEU  40  -7.749  -4.355   1.680
  322    HA   LEU  40           HA       LEU  40  -8.583  -5.400   4.154
  323   1HB   LEU  40          1HB       LEU  40  -9.992  -3.464   2.314
  324   2HB   LEU  40          2HB       LEU  40 -10.452  -3.778   3.977
  325    HG   LEU  40           HG       LEU  40  -7.819  -2.593   3.092
  326   1HD1  LEU  40          1HD1      LEU  40 -10.206  -1.309   4.409
  327   2HD1  LEU  40          2HD1      LEU  40  -8.662  -0.526   4.073
  328   3HD1  LEU  40          3HD1      LEU  40  -9.685  -1.066   2.742
  329   1HD2  LEU  40          1HD2      LEU  40  -7.464  -2.171   5.472
  330   2HD2  LEU  40          2HD2      LEU  40  -8.970  -3.007   5.849
  331   3HD2  LEU  40          3HD2      LEU  40  -7.621  -3.897   5.145
  332    H    SER  41           H        SER  41  -9.912  -5.710   0.898
  333    HA   SER  41           HA       SER  41 -12.221  -7.173   1.615
  334   1HB   SER  41          1HB       SER  41 -11.904  -6.092  -0.600
  335   2HB   SER  41          2HB       SER  41 -10.651  -7.273  -0.978
  336    HG   SER  41           HG       SER  41 -13.120  -8.273  -0.168
  337    H    SER  42           H        SER  42  -8.909  -8.086   0.870
  338    HA   SER  42           HA       SER  42  -9.224 -10.858   0.741
  339   1HB   SER  42          1HB       SER  42  -7.175  -9.666   0.047
  340   2HB   SER  42          2HB       SER  42  -6.828  -9.293   1.734
  341    HG   SER  42           HG       SER  42  -7.039 -11.901   0.619
  342    H    ILE  43           H        ILE  43  -8.538  -8.757   3.540
  343    HA   ILE  43           HA       ILE  43  -8.460 -11.003   5.335
  344    HB   ILE  43           HB       ILE  43  -8.302  -9.319   7.142
  345   1HG1  ILE  43          1HG1      ILE  43  -8.402  -7.324   4.866
  346   2HG1  ILE  43          2HG1      ILE  43  -9.650  -7.544   6.089
  347   1HG2  ILE  43          1HG2      ILE  43  -6.302 -10.176   6.067
  348   2HG2  ILE  43          2HG2      ILE  43  -6.415  -8.932   4.821
  349   3HG2  ILE  43          3HG2      ILE  43  -6.088  -8.479   6.494
  350   1HD1  ILE  43          1HD1      ILE  43  -8.068  -6.840   7.815
  351   2HD1  ILE  43          2HD1      ILE  43  -6.834  -6.603   6.578
  352   3HD1  ILE  43          3HD1      ILE  43  -8.287  -5.604   6.576
  353    H    GLY  44           H        GLY  44 -10.974  -9.172   3.985
  354   1HA   GLY  44          1HA       GLY  44 -13.193 -10.045   4.192
  355   2HA   GLY  44          2HA       GLY  44 -12.812 -10.536   5.832
  356    H    GLU  45           H        GLU  45 -11.694  -7.409   5.199
  357    HA   GLU  45           HA       GLU  45 -13.957  -6.287   6.686
  358   1HB   GLU  45          1HB       GLU  45 -11.274  -5.056   6.022
  359   2HB   GLU  45          2HB       GLU  45 -12.511  -4.329   7.037
  360   1HG   GLU  45          1HG       GLU  45 -10.911  -6.810   7.606
  361   2HG   GLU  45          2HG       GLU  45 -10.825  -5.261   8.442
  362    H    GLU  46           H        GLU  46 -13.072  -6.754   3.592
  363    HA   GLU  46           HA       GLU  46 -13.801  -6.035   1.585
  364   1HB   GLU  46          1HB       GLU  46 -15.713  -4.334   3.184
  365   2HB   GLU  46          2HB       GLU  46 -15.798  -4.599   1.448
  366   1HG   GLU  46          1HG       GLU  46 -15.980  -7.065   1.970
  367   2HG   GLU  46          2HG       GLU  46 -16.226  -6.588   3.650
  368    H    GLY  47           H        GLY  47 -14.240  -3.007   3.399
  369   1HA   GLY  47          1HA       GLY  47 -11.876  -1.769   2.578
  370   2HA   GLY  47          2HA       GLY  47 -13.092  -1.444   1.352
  371    H    ALA  48           H        ALA  48 -11.913  -0.668   4.452
  372    HA   ALA  48           HA       ALA  48 -14.143   0.794   5.427
  373   1HB   ALA  48          1HB       ALA  48 -12.362  -0.007   6.901
  374   2HB   ALA  48          2HB       ALA  48 -11.216   1.071   6.103
  375   3HB   ALA  48          3HB       ALA  48 -12.559   1.742   7.027
  376    H    THR  49           H        THR  49 -13.445   3.293   6.019
  377    HA   THR  49           HA       THR  49 -13.608   4.647   3.520
  378    HB   THR  49           HB       THR  49 -13.063   5.899   6.218
  379    HG1  THR  49           HG1      THR  49 -15.292   4.600   5.237
  380   1HG2  THR  49          1HG2      THR  49 -12.792   7.395   4.295
  381   2HG2  THR  49          2HG2      THR  49 -14.401   6.958   3.722
  382   3HG2  THR  49          3HG2      THR  49 -14.214   7.834   5.241
  383    H    VAL  50           H        VAL  50 -11.730   4.121   2.389
  384    HA   VAL  50           HA       VAL  50  -9.206   5.125   3.498
  385    HB   VAL  50           HB       VAL  50  -9.628   3.342   1.089
  386   1HG1  VAL  50          1HG1      VAL  50  -7.101   4.122   2.542
  387   2HG1  VAL  50          2HG1      VAL  50  -7.213   2.978   1.205
  388   3HG1  VAL  50          3HG1      VAL  50  -7.592   4.681   0.943
  389   1HG2  VAL  50          1HG2      VAL  50  -8.757   1.541   2.494
  390   2HG2  VAL  50          2HG2      VAL  50  -8.694   2.642   3.872
  391   3HG2  VAL  50          3HG2      VAL  50 -10.248   2.208   3.158
  392    H    THR  51           H        THR  51  -8.923   7.181   3.009
  393    HA   THR  51           HA       THR  51  -9.562   8.130   0.301
  394    HB   THR  51           HB       THR  51  -9.333  10.402   1.287
  395    HG1  THR  51           HG1      THR  51  -9.406  10.261   3.761
  396   1HG2  THR  51          1HG2      THR  51 -11.381  10.348   2.645
  397   2HG2  THR  51          2HG2      THR  51 -11.543   9.355   1.198
  398   3HG2  THR  51          3HG2      THR  51 -11.255   8.592   2.761
  399    H    SER  52           H        SER  52  -7.885  10.196  -0.051
  400    HA   SER  52           HA       SER  52  -5.256   8.983  -0.194
  401   1HB   SER  52          1HB       SER  52  -6.302  10.425  -2.028
  402   2HB   SER  52          2HB       SER  52  -6.022  11.807  -0.973
  403    HG   SER  52           HG       SER  52  -4.221  10.275  -2.435
  404    H    GLU  53           H        GLU  53  -7.052  10.751   1.984
  405    HA   GLU  53           HA       GLU  53  -4.826  11.989   3.361
  406   1HB   GLU  53          1HB       GLU  53  -6.957  13.122   3.430
  407   2HB   GLU  53          2HB       GLU  53  -7.761  11.677   4.023
  408   1HG   GLU  53          1HG       GLU  53  -7.424  13.393   5.751
  409   2HG   GLU  53          2HG       GLU  53  -6.655  11.856   6.137
  410    H    GLU  54           H        GLU  54  -6.978   9.213   3.717
  411    HA   GLU  54           HA       GLU  54  -5.711   8.213   6.079
  412   1HB   GLU  54          1HB       GLU  54  -7.518   6.849   4.075
  413   2HB   GLU  54          2HB       GLU  54  -7.016   6.151   5.607
  414   1HG   GLU  54          1HG       GLU  54  -8.586   8.704   5.321
  415   2HG   GLU  54          2HG       GLU  54  -9.287   7.121   5.654
  416    H    CYS  55           H        CYS  55  -5.584   7.338   2.631
  417    HA   CYS  55           HA       CYS  55  -3.189   5.729   3.128
  418   1HB   CYS  55          1HB       CYS  55  -5.081   4.925   1.619
  419   2HB   CYS  55          2HB       CYS  55  -4.598   6.184   0.488
  420    HG   CYS  55           HG       CYS  55  -2.889   3.371   1.371
  421    H    ARG  56           H        ARG  56  -1.507   7.093   3.422
  422    HA   ARG  56           HA       ARG  56  -1.508   9.618   1.944
  423   1HB   ARG  56          1HB       ARG  56  -1.426   9.522   4.460
  424   2HB   ARG  56          2HB       ARG  56   0.179   8.824   4.315
  425   1HG   ARG  56          1HG       ARG  56   1.051  10.811   3.364
  426   2HG   ARG  56          2HG       ARG  56  -0.564  11.497   3.159
  427   1HD   ARG  56          1HD       ARG  56   0.823  10.893   5.767
  428   2HD   ARG  56          2HD       ARG  56   0.511  12.490   5.087
  429    HE   ARG  56           HE       ARG  56  -1.959  11.512   5.241
  430   1HH1  ARG  56          1HH1      ARG  56   0.626  11.527   7.613
  431   2HH1  ARG  56          2HH1      ARG  56  -0.464  11.501   8.972
  432   1HH2  ARG  56          1HH2      ARG  56  -3.374  11.497   7.018
  433   2HH2  ARG  56          2HH2      ARG  56  -2.725  11.472   8.634
  434    H    PHE  57           H        PHE  57   0.044  10.187   0.543
  435    HA   PHE  57           HA       PHE  57   2.066   8.194  -0.122
  436   1HB   PHE  57          1HB       PHE  57   0.801   9.069  -1.992
  437   2HB   PHE  57          2HB       PHE  57   1.188  10.723  -1.532
  438    HD1  PHE  57           HD1      PHE  57   2.900  11.788  -2.629
  439    HD2  PHE  57           HD2      PHE  57   2.909   7.536  -2.431
  440    HE1  PHE  57           HE1      PHE  57   4.898  11.729  -4.063
  441    HE2  PHE  57           HE2      PHE  57   4.905   7.471  -3.865
  442    HZ   PHE  57           HZ       PHE  57   5.903   9.569  -4.682
  443    H    CYS  58           H        CYS  58   3.834   8.330   1.127
  444    HA   CYS  58           HA       CYS  58   4.834  10.869   2.038
  445   1HB   CYS  58          1HB       CYS  58   5.842   8.044   2.283
  446   2HB   CYS  58          2HB       CYS  58   6.796   9.418   2.833
  447    HG   CYS  58           HG       CYS  58   3.908   8.167   4.120
  448    H    HIS  59           H        HIS  59   6.406   8.315   0.075
  449    HA   HIS  59           HA       HIS  59   7.171  10.151  -1.955
  450   1HB   HIS  59          1HB       HIS  59   9.628  10.043  -1.619
  451   2HB   HIS  59          2HB       HIS  59   8.807  10.924  -0.341
  452    HD1  HIS  59           HD1      HIS  59  10.148  10.525   1.700
  453    HD2  HIS  59           HD2      HIS  59   9.614   7.037  -0.502
  454    HE1  HIS  59           HE1      HIS  59  11.197   8.686   3.066
  455    HE2  HIS  59           HE2      HIS  59  10.747   6.565   1.770
  456    H    SER  60           H        SER  60   9.070   9.045  -3.292
  457    HA   SER  60           HA       SER  60   8.445   6.166  -3.471
  458   1HB   SER  60          1HB       SER  60   9.475   7.923  -5.709
  459   2HB   SER  60          2HB       SER  60   8.777   6.307  -5.836
  460    HG   SER  60           HG       SER  60   7.500   8.763  -5.305
  461    H    GLU  61           H        GLU  61  10.109   4.945  -2.766
  462    HA   GLU  61           HA       GLU  61  12.798   6.132  -2.933
  463   1HB   GLU  61          1HB       GLU  61  13.332   4.975  -0.806
  464   2HB   GLU  61          2HB       GLU  61  12.084   6.200  -0.638
  465   1HG   GLU  61          1HG       GLU  61  10.373   4.444  -0.664
  466   2HG   GLU  61          2HG       GLU  61  11.642   3.226  -0.791
  467    H    LYS  62           H        LYS  62  14.393   4.171  -2.205
  468    HA   LYS  62           HA       LYS  62  14.468   2.577  -4.556
  469   1HB   LYS  62          1HB       LYS  62  16.167   2.333  -2.061
  470   2HB   LYS  62          2HB       LYS  62  16.527   1.635  -3.632
  471   1HG   LYS  62          1HG       LYS  62  17.888   3.502  -3.560
  472   2HG   LYS  62          2HG       LYS  62  16.495   4.069  -4.480
  473   1HD   LYS  62          1HD       LYS  62  15.575   5.096  -2.461
  474   2HD   LYS  62          2HD       LYS  62  16.953   4.514  -1.529
  475   1HE   LYS  62          1HE       LYS  62  17.297   6.829  -2.064
  476   2HE   LYS  62          2HE       LYS  62  18.446   5.855  -2.977
  477   1HZ   LYS  62          1HZ       LYS  62  15.892   6.899  -4.082
  478   2HZ   LYS  62          2HZ       LYS  62  17.400   7.645  -4.285
  479   3HZ   LYS  62          3HZ       LYS  62  17.122   6.106  -4.940
  480    H    ALA  63           H        ALA  63  14.172   0.383  -4.804
  481    HA   ALA  63           HA       ALA  63  12.629  -0.875  -2.639
  482   1HB   ALA  63          1HB       ALA  63  12.509  -1.444  -5.595
  483   2HB   ALA  63          2HB       ALA  63  11.485  -2.152  -4.346
  484   3HB   ALA  63          3HB       ALA  63  11.379  -0.428  -4.702
  485    HA   PRO  64           HA       PRO  64  16.014  -3.860  -2.588
  486   1HB   PRO  64          1HB       PRO  64  14.624  -4.985  -0.294
  487   2HB   PRO  64          2HB       PRO  64  16.201  -4.195  -0.354
  488   1HG   PRO  64          1HG       PRO  64  14.027  -3.099   0.867
  489   2HG   PRO  64          2HG       PRO  64  15.335  -2.139   0.155
  490   1HD   PRO  64          1HD       PRO  64  12.627  -2.772  -0.950
  491   2HD   PRO  64          2HD       PRO  64  13.549  -1.255  -1.023
  492    H    ASP  65           H        ASP  65  16.076  -6.169  -2.854
  493    HA   ASP  65           HA       ASP  65  14.205  -7.162  -4.653
  494   1HB   ASP  65          1HB       ASP  65  16.453  -8.050  -4.552
  495   2HB   ASP  65          2HB       ASP  65  16.178  -8.665  -2.926
  496    H    GLU  66           H        GLU  66  14.179  -7.219  -1.214
  497    HA   GLU  66           HA       GLU  66  12.515  -9.279  -0.516
  498   1HB   GLU  66          1HB       GLU  66  12.195  -6.486   0.579
  499   2HB   GLU  66          2HB       GLU  66  11.907  -8.008   1.409
  500   1HG   GLU  66          1HG       GLU  66  14.587  -6.965   0.523
  501   2HG   GLU  66          2HG       GLU  66  13.953  -6.933   2.168
  502    H    VAL  67           H        VAL  67  11.552  -6.060  -1.681
  503    HA   VAL  67           HA       VAL  67   8.760  -6.910  -1.744
  504    HB   VAL  67           HB       VAL  67   8.204  -4.579  -2.193
  505   1HG1  VAL  67          1HG1      VAL  67   8.975  -3.599  -0.082
  506   2HG1  VAL  67          2HG1      VAL  67   8.444  -5.268   0.122
  507   3HG1  VAL  67          3HG1      VAL  67  10.166  -4.891   0.075
  508   1HG2  VAL  67          1HG2      VAL  67   9.947  -2.841  -2.183
  509   2HG2  VAL  67          2HG2      VAL  67  11.183  -4.099  -2.167
  510   3HG2  VAL  67          3HG2      VAL  67  10.106  -3.938  -3.554
  511    H    ILE  68           H        ILE  68  11.434  -6.442  -3.841
  512    HA   ILE  68           HA       ILE  68  10.256  -5.749  -6.254
  513    HB   ILE  68           HB       ILE  68  12.587  -7.621  -5.800
  514   1HG1  ILE  68          1HG1      ILE  68  12.962  -5.408  -4.849
  515   2HG1  ILE  68          2HG1      ILE  68  13.966  -5.634  -6.277
  516   1HG2  ILE  68          1HG2      ILE  68  13.243  -7.108  -8.101
  517   2HG2  ILE  68          2HG2      ILE  68  11.677  -7.919  -8.035
  518   3HG2  ILE  68          3HG2      ILE  68  11.759  -6.179  -8.314
  519   1HD1  ILE  68          1HD1      ILE  68  12.385  -4.312  -7.588
  520   2HD1  ILE  68          2HD1      ILE  68  11.398  -4.077  -6.144
  521   3HD1  ILE  68          3HD1      ILE  68  13.028  -3.409  -6.215
  522    H    GLU  69           H        GLU  69  11.021  -9.055  -5.157
  523    HA   GLU  69           HA       GLU  69   9.747 -10.374  -7.264
  524   1HB   GLU  69          1HB       GLU  69  10.867 -11.100  -4.658
  525   2HB   GLU  69          2HB       GLU  69   9.570 -12.159  -5.192
  526   1HG   GLU  69          1HG       GLU  69  11.987 -11.475  -6.844
  527   2HG   GLU  69          2HG       GLU  69  11.833 -12.920  -5.844
  528    H    ALA  70           H        ALA  70   8.445  -9.071  -4.302
  529    HA   ALA  70           HA       ALA  70   6.009 -10.557  -4.375
  530   1HB   ALA  70          1HB       ALA  70   5.262  -9.048  -2.615
  531   2HB   ALA  70          2HB       ALA  70   6.891  -9.641  -2.291
  532   3HB   ALA  70          3HB       ALA  70   6.654  -8.005  -2.907
  533    H    ILE  71           H        ILE  71   6.815  -7.172  -5.125
  534    HA   ILE  71           HA       ILE  71   4.192  -6.473  -5.944
  535    HB   ILE  71           HB       ILE  71   6.833  -5.139  -6.588
  536   1HG1  ILE  71          1HG1      ILE  71   4.803  -4.512  -4.435
  537   2HG1  ILE  71          2HG1      ILE  71   6.323  -5.357  -4.166
  538   1HG2  ILE  71          1HG2      ILE  71   5.507  -3.125  -7.022
  539   2HG2  ILE  71          2HG2      ILE  71   5.095  -4.430  -8.136
  540   3HG2  ILE  71          3HG2      ILE  71   4.027  -4.054  -6.783
  541   1HD1  ILE  71          1HD1      ILE  71   6.030  -2.532  -5.159
  542   2HD1  ILE  71          2HD1      ILE  71   6.475  -3.021  -3.524
  543   3HD1  ILE  71          3HD1      ILE  71   7.552  -3.376  -4.874
  544    H    LYS  72           H        LYS  72   6.987  -7.723  -7.668
  545    HA   LYS  72           HA       LYS  72   5.930  -7.266 -10.276
  546   1HB   LYS  72          1HB       LYS  72   8.090  -9.110  -9.260
  547   2HB   LYS  72          2HB       LYS  72   7.696  -8.921 -10.967
  548   1HG   LYS  72          1HG       LYS  72   8.220  -6.561 -10.833
  549   2HG   LYS  72          2HG       LYS  72   8.599  -6.725  -9.123
  550   1HD   LYS  72          1HD       LYS  72  10.616  -6.708 -10.538
  551   2HD   LYS  72          2HD       LYS  72  10.437  -8.208  -9.628
  552   1HE   LYS  72          1HE       LYS  72   9.481  -9.276 -11.629
  553   2HE   LYS  72          2HE       LYS  72   9.739  -7.782 -12.529
  554   1HZ   LYS  72          1HZ       LYS  72  12.082  -7.992 -12.253
  555   2HZ   LYS  72          2HZ       LYS  72  11.904  -9.313 -11.198
  556   3HZ   LYS  72          3HZ       LYS  72  11.498  -9.475 -12.834
  557    H    GLN  73           H        GLN  73   5.470  -9.672  -7.890
  558    HA   GLN  73           HA       GLN  73   4.421 -11.625  -9.747
  559   1HB   GLN  73          1HB       GLN  73   5.682 -12.410  -7.820
  560   2HB   GLN  73          2HB       GLN  73   4.532 -11.647  -6.730
  561   1HG   GLN  73          1HG       GLN  73   2.826 -13.171  -7.303
  562   2HG   GLN  73          2HG       GLN  73   3.735 -13.781  -8.684
  563   1HE2  GLN  73          2HE2      GLN  73   2.602 -15.170  -6.355
  564   2HE2  GLN  73          1HE2      GLN  73   3.926 -16.015  -5.622
  565    H    ASN  74           H        ASN  74   3.036  -9.808  -6.963
  566    HA   ASN  74           HA       ASN  74   0.397 -10.538  -8.003
  567   1HB   ASN  74          1HB       ASN  74  -0.522 -10.137  -5.877
  568   2HB   ASN  74          2HB       ASN  74   1.021 -10.915  -5.559
  569   1HD2  ASN  74          2HD2      ASN  74   2.592  -9.819  -4.472
  570   2HD2  ASN  74          1HD2      ASN  74   2.342  -8.255  -3.769
  571    H    GLY  75           H        GLY  75   2.287  -7.655  -7.157
  572   1HA   GLY  75          1HA       GLY  75   1.772  -5.891  -8.958
  573   2HA   GLY  75          2HA       GLY  75   0.137  -6.018  -8.330
  574    H    TYR  76           H        TYR  76   1.086  -6.335  -5.545
  575    HA   TYR  76           HA       TYR  76   2.337  -3.758  -5.004
  576   1HB   TYR  76          1HB       TYR  76   0.442  -3.333  -3.281
  577   2HB   TYR  76          2HB       TYR  76   0.150  -2.952  -4.972
  578    HD1  TYR  76           HD1      TYR  76  -1.406  -4.260  -6.292
  579    HD2  TYR  76           HD2      TYR  76  -0.706  -5.209  -2.202
  580    HE1  TYR  76           HE1      TYR  76  -3.410  -5.681  -6.287
  581    HE2  TYR  76           HE2      TYR  76  -2.713  -6.637  -2.190
  582    HH   TYR  76           HH       TYR  76  -4.315  -7.560  -5.071
  583    H    PHE  77           H        PHE  77   2.685  -3.465  -2.590
  584    HA   PHE  77           HA       PHE  77   2.936  -6.057  -1.227
  585   1HB   PHE  77          1HB       PHE  77   5.141  -5.372  -2.157
  586   2HB   PHE  77          2HB       PHE  77   5.048  -3.889  -1.215
  587    HD1  PHE  77           HD1      PHE  77   5.390  -7.547  -1.023
  588    HD2  PHE  77           HD2      PHE  77   5.552  -3.872   1.113
  589    HE1  PHE  77           HE1      PHE  77   6.441  -8.702   0.877
  590    HE2  PHE  77           HE2      PHE  77   6.603  -5.020   3.018
  591    HZ   PHE  77           HZ       PHE  77   7.051  -7.438   2.901
  592    H    ILE  78           H        ILE  78   1.848  -6.017   0.602
  593    HA   ILE  78           HA       ILE  78   1.280  -3.467   1.908
  594    HB   ILE  78           HB       ILE  78   0.210  -6.226   2.534
  595   1HG1  ILE  78          1HG1      ILE  78  -0.529  -5.459   0.331
  596   2HG1  ILE  78          2HG1      ILE  78  -1.871  -5.447   1.470
  597   1HG2  ILE  78          1HG2      ILE  78   0.182  -4.742   4.469
  598   2HG2  ILE  78          2HG2      ILE  78  -0.673  -3.520   3.529
  599   3HG2  ILE  78          3HG2      ILE  78  -1.455  -5.059   3.892
  600   1HD1  ILE  78          1HD1      ILE  78  -1.636  -3.036   1.726
  601   2HD1  ILE  78          2HD1      ILE  78  -0.279  -3.046   0.599
  602   3HD1  ILE  78          3HD1      ILE  78  -1.893  -3.483   0.040
  603    H    TYR  79           H        TYR  79   2.956  -2.853   3.148
  604    HA   TYR  79           HA       TYR  79   4.547  -4.824   4.547
  605   1HB   TYR  79          1HB       TYR  79   5.708  -2.973   3.503
  606   2HB   TYR  79          2HB       TYR  79   4.745  -1.811   4.408
  607    HD1  TYR  79           HD1      TYR  79   5.573  -0.956   6.409
  608    HD2  TYR  79           HD2      TYR  79   7.140  -4.623   4.923
  609    HE1  TYR  79           HE1      TYR  79   7.246  -0.966   8.210
  610    HE2  TYR  79           HE2      TYR  79   8.816  -4.639   6.718
  611    HH   TYR  79           HH       TYR  79   8.637  -2.603   9.420
  612    H    LYS  80           H        LYS  80   3.776  -5.637   6.375
  613    HA   LYS  80           HA       LYS  80   2.142  -4.202   8.216
  614   1HB   LYS  80          1HB       LYS  80   3.699  -6.776   8.392
  615   2HB   LYS  80          2HB       LYS  80   2.855  -6.117   9.785
  616   1HG   LYS  80          1HG       LYS  80   1.498  -6.720   7.169
  617   2HG   LYS  80          2HG       LYS  80   1.617  -7.875   8.500
  618   1HD   LYS  80          1HD       LYS  80   0.505  -6.204   9.969
  619   2HD   LYS  80          2HD       LYS  80   0.283  -5.169   8.558
  620   1HE   LYS  80          1HE       LYS  80  -1.725  -6.506   9.134
  621   2HE   LYS  80          2HE       LYS  80  -1.120  -6.809   7.506
  622   1HZ   LYS  80          1HZ       LYS  80  -0.333  -8.538   9.774
  623   2HZ   LYS  80          2HZ       LYS  80  -1.780  -8.804   8.923
  624   3HZ   LYS  80          3HZ       LYS  80  -0.295  -8.874   8.112
  625    H    MET  81           H        MET  81   3.050  -2.326   8.919
  626    HA   MET  81           HA       MET  81   5.744  -1.900   9.470
  627   1HB   MET  81          1HB       MET  81   4.189  -0.058   9.173
  628   2HB   MET  81          2HB       MET  81   3.323  -0.516  10.631
  629   1HG   MET  81          1HG       MET  81   5.154   0.105  12.012
  630   2HG   MET  81          2HG       MET  81   6.211   0.314  10.618
  631   1HE   MET  81          1HE       MET  81   6.096   2.297   8.943
  632   2HE   MET  81          2HE       MET  81   4.799   3.491   8.914
  633   3HE   MET  81          3HE       MET  81   4.453   1.800   8.542
  634    H    GLU  82           H        GLU  82   3.122  -2.423  11.821
  635    HA   GLU  82           HA       GLU  82   4.503  -4.389  13.280
  636   1HB   GLU  82          1HB       GLU  82   5.835  -2.320  13.935
  637   2HB   GLU  82          2HB       GLU  82   4.384  -1.746  14.743
  638   1HG   GLU  82          1HG       GLU  82   5.288  -4.466  15.447
  639   2HG   GLU  82          2HG       GLU  82   6.320  -3.135  15.965
  640    H    GLY  83           H        GLY  83   2.276  -1.667  13.668
  641   1HA   GLY  83          1HA       GLY  83   0.632  -2.705  15.637
  642   2HA   GLY  83          2HA       GLY  83   0.132  -1.527  14.437
  643    H    CYS  84           H        CYS  84  -0.282  -4.622  15.620
  644    HA   CYS  84           HA       CYS  84  -2.269  -5.154  13.542
  645   1HB   CYS  84          1HB       CYS  84  -0.267  -7.213  14.514
  646   2HB   CYS  84          2HB       CYS  84  -1.610  -7.526  13.420
  647    HG   CYS  84           HG       CYS  84   0.174  -5.080  12.191
  648    H    ASN  85           H        ASN  85  -0.856  -6.359  16.580
  649    HA   ASN  85           HA       ASN  85  -3.516  -6.317  17.762
  650   1HB   ASN  85          1HB       ASN  85  -2.943  -8.579  18.882
  651   2HB   ASN  85          2HB       ASN  85  -3.536  -8.583  17.230
  652   1HD2  ASN  85          2HD2      ASN  85  -0.260  -7.834  18.352
  653   2HD2  ASN  85          1HD2      ASN  85   0.504  -9.166  17.536
  Start of MODEL   19
    1    H    MET   1           H        MET   1  14.691   0.311 -11.339
    2    HA   MET   1           HA       MET   1  12.384   0.815 -10.758
    3   1HB   MET   1          1HB       MET   1  13.237  -1.513 -10.844
    4   2HB   MET   1          2HB       MET   1  13.635  -1.413  -9.134
    5   1HG   MET   1          1HG       MET   1  11.554  -2.608  -9.489
    6   2HG   MET   1          2HG       MET   1  11.283  -1.114  -8.590
    7   1HE   MET   1          1HE       MET   1   7.994  -1.437 -10.685
    8   2HE   MET   1          2HE       MET   1   8.684  -1.250  -9.072
    9   3HE   MET   1          3HE       MET   1   8.920  -2.752  -9.964
   10    H    GLN   2           H        GLN   2  11.310   2.191  -9.521
   11    HA   GLN   2           HA       GLN   2  12.081   2.417  -6.682
   12   1HB   GLN   2          1HB       GLN   2  10.700   4.475  -8.414
   13   2HB   GLN   2          2HB       GLN   2  11.166   4.684  -6.732
   14   1HG   GLN   2          1HG       GLN   2  13.512   4.500  -7.348
   15   2HG   GLN   2          2HG       GLN   2  13.055   4.259  -9.035
   16   1HE2  GLN   2          2HE2      GLN   2  13.359   6.532  -6.443
   17   2HE2  GLN   2          1HE2      GLN   2  13.102   7.955  -7.395
   18    H    ILE   3           H        ILE   3  10.478   2.409  -5.130
   19    HA   ILE   3           HA       ILE   3   7.832   1.534  -6.083
   20    HB   ILE   3           HB       ILE   3   7.508   0.542  -3.838
   21   1HG1  ILE   3          1HG1      ILE   3  10.451   1.114  -3.426
   22   2HG1  ILE   3          2HG1      ILE   3   9.156   2.043  -2.682
   23   1HG2  ILE   3          1HG2      ILE   3   8.254  -0.844  -5.682
   24   2HG2  ILE   3          2HG2      ILE   3   9.934  -0.436  -5.333
   25   3HG2  ILE   3          3HG2      ILE   3   8.996  -1.378  -4.173
   26   1HD1  ILE   3          1HD1      ILE   3   8.395   0.043  -1.515
   27   2HD1  ILE   3          2HD1      ILE   3   9.695  -0.886  -2.263
   28   3HD1  ILE   3          3HD1      ILE   3  10.075   0.419  -1.139
   29    H    HIS   4           H        HIS   4   5.987   2.383  -5.151
   30    HA   HIS   4           HA       HIS   4   6.289   5.033  -3.983
   31   1HB   HIS   4          1HB       HIS   4   3.993   3.469  -5.122
   32   2HB   HIS   4          2HB       HIS   4   3.688   4.873  -4.108
   33    HD1  HIS   4           HD1      HIS   4   2.714   6.316  -5.940
   34    HD2  HIS   4           HD2      HIS   4   6.518   4.882  -6.822
   35    HE1  HIS   4           HE1      HIS   4   3.468   7.596  -7.966
   36    HE2  HIS   4           HE2      HIS   4   5.850   6.865  -8.347
   37    H    VAL   5           H        VAL   5   6.279   5.335  -1.865
   38    HA   VAL   5           HA       VAL   5   5.313   3.180  -0.136
   39    HB   VAL   5           HB       VAL   5   6.849   5.677   0.614
   40   1HG1  VAL   5          1HG1      VAL   5   6.269   3.163   2.178
   41   2HG1  VAL   5          2HG1      VAL   5   7.301   4.490   2.712
   42   3HG1  VAL   5          3HG1      VAL   5   5.576   4.759   2.469
   43   1HG2  VAL   5          1HG2      VAL   5   7.848   2.866   0.162
   44   2HG2  VAL   5          2HG2      VAL   5   8.174   4.266  -0.860
   45   3HG2  VAL   5          3HG2      VAL   5   8.807   4.208   0.786
   46    H    TYR   6           H        TYR   6   3.184   3.333   0.267
   47    HA   TYR   6           HA       TYR   6   2.089   5.990   0.901
   48   1HB   TYR   6          1HB       TYR   6   0.706   3.483  -0.064
   49   2HB   TYR   6          2HB       TYR   6  -0.153   4.909   0.502
   50    HD1  TYR   6           HD1      TYR   6   1.794   3.454  -2.216
   51    HD2  TYR   6           HD2      TYR   6  -0.137   6.976  -0.815
   52    HE1  TYR   6           HE1      TYR   6   1.911   4.412  -4.475
   53    HE2  TYR   6           HE2      TYR   6  -0.022   7.944  -3.072
   54    HH   TYR   6           HH       TYR   6   1.087   7.745  -5.111
   55    H    ASP   7           H        ASP   7   2.321   6.265   3.035
   56    HA   ASP   7           HA       ASP   7   1.871   4.217   4.983
   57   1HB   ASP   7          1HB       ASP   7   3.296   6.156   5.485
   58   2HB   ASP   7          2HB       ASP   7   1.926   7.236   5.263
   59    H    THR   8           H        THR   8  -0.086   3.347   5.228
   60    HA   THR   8           HA       THR   8  -2.407   5.025   4.579
   61    HB   THR   8           HB       THR   8  -2.287   2.009   4.612
   62    HG1  THR   8           HG1      THR   8  -0.878   3.170   3.035
   63   1HG2  THR   8          1HG2      THR   8  -4.541   2.966   4.806
   64   2HG2  THR   8          2HG2      THR   8  -4.251   3.944   3.367
   65   3HG2  THR   8          3HG2      THR   8  -4.314   2.185   3.241
   66    H    TYR   9           H        TYR   9  -3.584   5.703   6.199
   67    HA   TYR   9           HA       TYR   9  -3.608   4.340   8.760
   68   1HB   TYR   9          1HB       TYR   9  -4.742   6.903   7.696
   69   2HB   TYR   9          2HB       TYR   9  -5.393   6.223   9.179
   70    HD1  TYR   9           HD1      TYR   9  -1.961   6.811   7.758
   71    HD2  TYR   9           HD2      TYR   9  -4.601   7.200  11.071
   72    HE1  TYR   9           HE1      TYR   9  -0.179   7.915   9.047
   73    HE2  TYR   9           HE2      TYR   9  -2.828   8.294  12.366
   74    HH   TYR   9           HH       TYR   9   0.041   9.447  10.962
   75    H    VAL  10           H        VAL  10  -4.750   2.432   8.611
   76    HA   VAL  10           HA       VAL  10  -7.516   2.680   7.632
   77    HB   VAL  10           HB       VAL  10  -5.840   0.192   8.029
   78   1HG1  VAL  10          1HG1      VAL  10  -8.714   0.433   7.127
   79   2HG1  VAL  10          2HG1      VAL  10  -7.757  -1.049   7.132
   80   3HG1  VAL  10          3HG1      VAL  10  -8.161  -0.254   8.654
   81   1HG2  VAL  10          1HG2      VAL  10  -6.109  -0.046   5.600
   82   2HG2  VAL  10          2HG2      VAL  10  -6.995   1.478   5.555
   83   3HG2  VAL  10          3HG2      VAL  10  -5.294   1.460   6.022
   84    H    LYS  11           H        LYS  11  -8.864   3.154   9.188
   85    HA   LYS  11           HA       LYS  11  -8.278   2.478  11.935
   86   1HB   LYS  11          1HB       LYS  11 -10.714   3.855  10.791
   87   2HB   LYS  11          2HB       LYS  11 -10.241   3.802  12.482
   88   1HG   LYS  11          1HG       LYS  11  -8.230   5.104  11.947
   89   2HG   LYS  11          2HG       LYS  11  -8.749   5.186  10.262
   90   1HD   LYS  11          1HD       LYS  11 -10.849   6.282  11.030
   91   2HD   LYS  11          2HD       LYS  11 -10.181   6.318  12.662
   92   1HE   LYS  11          1HE       LYS  11  -8.295   7.668  11.838
   93   2HE   LYS  11          2HE       LYS  11  -9.011   7.660  10.227
   94   1HZ   LYS  11          1HZ       LYS  11 -10.108   8.910  12.683
   95   2HZ   LYS  11          2HZ       LYS  11  -9.609   9.687  11.259
   96   3HZ   LYS  11          3HZ       LYS  11 -11.007   8.722  11.256
   97    H    ALA  12           H        ALA  12  -8.594   0.342  12.353
   98    HA   ALA  12           HA       ALA  12 -10.924  -1.070  11.475
   99   1HB   ALA  12          1HB       ALA  12 -10.217  -2.806  13.057
  100   2HB   ALA  12          2HB       ALA  12  -8.872  -2.272  12.049
  101   3HB   ALA  12          3HB       ALA  12  -9.001  -1.711  13.715
  102    H    LYS  13           H        LYS  13 -12.749  -1.631  12.778
  103    HA   LYS  13           HA       LYS  13 -13.753   0.646  14.104
  104   1HB   LYS  13          1HB       LYS  13 -15.049  -1.161  12.842
  105   2HB   LYS  13          2HB       LYS  13 -14.949  -2.108  14.321
  106   1HG   LYS  13          1HG       LYS  13 -16.139  -0.385  15.539
  107   2HG   LYS  13          2HG       LYS  13 -16.183   0.630  14.096
  108   1HD   LYS  13          1HD       LYS  13 -17.495  -2.068  14.420
  109   2HD   LYS  13          2HD       LYS  13 -18.313  -0.507  14.429
  110   1HE   LYS  13          1HE       LYS  13 -16.795  -1.713  12.119
  111   2HE   LYS  13          2HE       LYS  13 -18.547  -1.611  12.268
  112   1HZ   LYS  13          1HZ       LYS  13 -18.226   0.873  12.374
  113   2HZ   LYS  13          2HZ       LYS  13 -16.620   0.612  11.908
  114   3HZ   LYS  13          3HZ       LYS  13 -17.883   0.149  10.879
  115    H    ASP  14           H        ASP  14 -12.480  -2.411  15.314
  116    HA   ASP  14           HA       ASP  14 -11.976  -1.117  17.874
  117   1HB   ASP  14          1HB       ASP  14 -14.248  -2.414  17.866
  118   2HB   ASP  14          2HB       ASP  14 -13.229  -3.848  17.927
  119    H    GLY  15           H        GLY  15 -10.476  -2.135  15.533
  120   1HA   GLY  15          1HA       GLY  15  -8.901  -4.244  16.873
  121   2HA   GLY  15          2HA       GLY  15  -9.181  -4.220  15.139
  122    H    HIS  16           H        HIS  16  -8.559  -1.288  16.898
  123    HA   HIS  16           HA       HIS  16  -6.772   0.098  17.091
  124   1HB   HIS  16          1HB       HIS  16  -5.441  -1.823  17.782
  125   2HB   HIS  16          2HB       HIS  16  -5.175  -2.275  16.106
  126    HD1  HIS  16           HD1      HIS  16  -4.279   0.481  18.551
  127    HD2  HIS  16           HD2      HIS  16  -2.951  -1.168  14.970
  128    HE1  HIS  16           HE1      HIS  16  -2.061   1.573  18.080
  129    HE2  HIS  16           HE2      HIS  16  -1.196   0.434  16.003
  130    H    VAL  17           H        VAL  17  -5.761   1.631  15.824
  131    HA   VAL  17           HA       VAL  17  -6.515   1.714  13.065
  132    HB   VAL  17           HB       VAL  17  -4.592   3.511  14.557
  133   1HG1  VAL  17          1HG1      VAL  17  -6.032   3.919  11.934
  134   2HG1  VAL  17          2HG1      VAL  17  -5.032   5.117  12.758
  135   3HG1  VAL  17          3HG1      VAL  17  -4.303   3.635  12.136
  136   1HG2  VAL  17          1HG2      VAL  17  -7.541   3.827  14.006
  137   2HG2  VAL  17          2HG2      VAL  17  -6.799   3.524  15.577
  138   3HG2  VAL  17          3HG2      VAL  17  -6.500   5.046  14.738
  139    H    MET  18           H        MET  18  -5.545   0.542  11.576
  140    HA   MET  18           HA       MET  18  -2.965  -0.635  12.081
  141   1HB   MET  18          1HB       MET  18  -4.689  -0.831   9.605
  142   2HB   MET  18          2HB       MET  18  -3.359  -1.893  10.046
  143   1HG   MET  18          1HG       MET  18  -4.626  -2.648  12.003
  144   2HG   MET  18          2HG       MET  18  -5.965  -1.608  11.523
  145   1HE   MET  18          1HE       MET  18  -4.530  -5.302   9.168
  146   2HE   MET  18          2HE       MET  18  -3.889  -4.815  10.739
  147   3HE   MET  18          3HE       MET  18  -3.571  -3.830   9.311
  148    H    HIS  19           H        HIS  19  -1.148   0.401  11.656
  149    HA   HIS  19           HA       HIS  19  -1.068   2.299   9.410
  150   1HB   HIS  19          1HB       HIS  19   1.000   1.858  11.580
  151   2HB   HIS  19          2HB       HIS  19   1.014   3.130  10.366
  152    HD1  HIS  19           HD1      HIS  19  -0.712   2.080  13.524
  153    HD2  HIS  19           HD2      HIS  19  -0.507   5.366  10.979
  154    HE1  HIS  19           HE1      HIS  19  -1.845   3.963  14.750
  155    HE2  HIS  19           HE2      HIS  19  -1.458   5.991  13.307
  156    H    PHE  20           H        PHE  20  -0.337   1.481   7.547
  157    HA   PHE  20           HA       PHE  20   2.006  -0.233   7.628
  158   1HB   PHE  20          1HB       PHE  20   1.010  -1.844   6.014
  159   2HB   PHE  20          2HB       PHE  20   0.266  -1.885   7.603
  160    HD1  PHE  20           HD1      PHE  20  -2.011  -1.119   7.928
  161    HD2  PHE  20           HD2      PHE  20  -0.207  -1.100   4.076
  162    HE1  PHE  20           HE1      PHE  20  -4.228  -0.875   6.894
  163    HE2  PHE  20           HE2      PHE  20  -2.421  -0.851   3.036
  164    HZ   PHE  20           HZ       PHE  20  -4.435  -0.739   4.445
  165    H    ASP  21           H        ASP  21   3.212  -0.273   5.732
  166    HA   ASP  21           HA       ASP  21   2.734   2.049   4.012
  167   1HB   ASP  21          1HB       ASP  21   5.181   0.290   4.334
  168   2HB   ASP  21          2HB       ASP  21   5.072   1.653   3.232
  169    H    VAL  22           H        VAL  22   1.589   1.630   2.240
  170    HA   VAL  22           HA       VAL  22   1.700  -0.977   0.975
  171    HB   VAL  22           HB       VAL  22   0.371   1.502  -0.137
  172   1HG1  VAL  22          1HG1      VAL  22  -1.038  -0.109  -1.323
  173   2HG1  VAL  22          2HG1      VAL  22   0.667  -0.319  -1.722
  174   3HG1  VAL  22          3HG1      VAL  22  -0.123  -1.436  -0.608
  175   1HG2  VAL  22          1HG2      VAL  22  -0.486   1.114   2.109
  176   2HG2  VAL  22          2HG2      VAL  22  -1.706   0.716   0.898
  177   3HG2  VAL  22          3HG2      VAL  22  -0.812  -0.572   1.707
  178    H    PHE  23           H        PHE  23   3.615  -1.362   0.028
  179    HA   PHE  23           HA       PHE  23   4.969   0.711  -1.480
  180   1HB   PHE  23          1HB       PHE  23   5.635  -2.235  -1.234
  181   2HB   PHE  23          2HB       PHE  23   6.681  -0.984  -1.896
  182    HD1  PHE  23           HD1      PHE  23   6.883   1.113  -0.135
  183    HD2  PHE  23           HD2      PHE  23   6.227  -2.978   0.833
  184    HE1  PHE  23           HE1      PHE  23   7.846   1.490   2.096
  185    HE2  PHE  23           HE2      PHE  23   7.187  -2.608   3.066
  186    HZ   PHE  23           HZ       PHE  23   7.998  -0.372   3.701
  187    H    THR  24           H        THR  24   4.170   1.204  -3.421
  188    HA   THR  24           HA       THR  24   2.942  -0.982  -4.978
  189    HB   THR  24           HB       THR  24   1.993   1.858  -5.133
  190    HG1  THR  24           HG1      THR  24   1.953   0.935  -2.898
  191   1HG2  THR  24          1HG2      THR  24  -0.109   0.790  -5.795
  192   2HG2  THR  24          2HG2      THR  24   1.219   0.298  -6.848
  193   3HG2  THR  24          3HG2      THR  24   0.635  -0.796  -5.593
  194    H    ASP  25           H        ASP  25   3.263  -1.011  -7.165
  195    HA   ASP  25           HA       ASP  25   5.433   0.547  -8.254
  196   1HB   ASP  25          1HB       ASP  25   5.344  -1.676  -9.040
  197   2HB   ASP  25          2HB       ASP  25   3.611  -1.595  -9.333
  198    H    VAL  26           H        VAL  26   1.953   0.385  -8.600
  199    HA   VAL  26           HA       VAL  26   1.704   2.030 -10.869
  200    HB   VAL  26           HB       VAL  26  -0.403   1.676  -8.745
  201   1HG1  VAL  26          1HG1      VAL  26  -0.567   2.058 -11.728
  202   2HG1  VAL  26          2HG1      VAL  26  -1.939   1.824 -10.645
  203   3HG1  VAL  26          3HG1      VAL  26  -0.936   3.268 -10.497
  204   1HG2  VAL  26          1HG2      VAL  26  -1.102  -0.357  -9.942
  205   2HG2  VAL  26          2HG2      VAL  26   0.335  -0.235 -10.957
  206   3HG2  VAL  26          3HG2      VAL  26   0.502  -0.520  -9.225
  207    H    ARG  27           H        ARG  27   1.255   4.193 -11.112
  208    HA   ARG  27           HA       ARG  27   1.876   5.885  -8.807
  209   1HB   ARG  27          1HB       ARG  27   1.767   6.515 -11.760
  210   2HB   ARG  27          2HB       ARG  27   2.155   7.685 -10.507
  211   1HG   ARG  27          1HG       ARG  27   4.133   6.415  -9.904
  212   2HG   ARG  27          2HG       ARG  27   3.733   5.195 -11.115
  213   1HD   ARG  27          1HD       ARG  27   4.243   8.100 -11.731
  214   2HD   ARG  27          2HD       ARG  27   5.464   6.834 -11.846
  215    HE   ARG  27           HE       ARG  27   3.035   6.362 -13.365
  216   1HH1  ARG  27          1HH1      ARG  27   6.255   7.748 -13.386
  217   2HH1  ARG  27          2HH1      ARG  27   6.468   7.561 -15.102
  218   1HH2  ARG  27          1HH2      ARG  27   3.313   6.104 -15.617
  219   2HH2  ARG  27          2HH2      ARG  27   4.798   6.605 -16.373
  220    H    ASP  28           H        ASP  28  -0.720   4.576  -9.343
  221    HA   ASP  28           HA       ASP  28  -2.460   6.921  -9.665
  222   1HB   ASP  28          1HB       ASP  28  -3.028   3.962  -9.906
  223   2HB   ASP  28          2HB       ASP  28  -4.298   5.176  -9.858
  224    H    ASP  29           H        ASP  29  -3.256   7.803  -7.874
  225    HA   ASP  29           HA       ASP  29  -2.938   6.722  -5.297
  226   1HB   ASP  29          1HB       ASP  29  -4.344   8.525  -4.509
  227   2HB   ASP  29          2HB       ASP  29  -3.316   9.150  -5.793
  228    H    LYS  30           H        LYS  30  -5.641   6.683  -7.552
  229    HA   LYS  30           HA       LYS  30  -7.549   5.408  -5.967
  230   1HB   LYS  30          1HB       LYS  30  -8.190   6.336  -8.086
  231   2HB   LYS  30          2HB       LYS  30  -7.055   5.304  -8.945
  232   1HG   LYS  30          1HG       LYS  30  -8.377   3.336  -8.265
  233   2HG   LYS  30          2HG       LYS  30  -9.542   4.417  -7.498
  234   1HD   LYS  30          1HD       LYS  30 -10.033   5.450  -9.632
  235   2HD   LYS  30          2HD       LYS  30  -8.798   4.467 -10.420
  236   1HE   LYS  30          1HE       LYS  30 -11.256   3.394  -9.041
  237   2HE   LYS  30          2HE       LYS  30 -11.086   3.612 -10.782
  238   1HZ   LYS  30          1HZ       LYS  30  -9.612   1.724  -9.034
  239   2HZ   LYS  30          2HZ       LYS  30 -10.615   1.366 -10.343
  240   3HZ   LYS  30          3HZ       LYS  30  -9.104   2.087 -10.610
  241    H    LYS  31           H        LYS  31  -4.847   4.128  -7.800
  242    HA   LYS  31           HA       LYS  31  -5.722   1.408  -7.632
  243   1HB   LYS  31          1HB       LYS  31  -4.192   2.500  -9.409
  244   2HB   LYS  31          2HB       LYS  31  -2.904   2.257  -8.237
  245   1HG   LYS  31          1HG       LYS  31  -2.950   0.439  -9.822
  246   2HG   LYS  31          2HG       LYS  31  -3.395  -0.145  -8.216
  247   1HD   LYS  31          1HD       LYS  31  -5.761  -0.032  -8.833
  248   2HD   LYS  31          2HD       LYS  31  -5.314   0.547 -10.438
  249   1HE   LYS  31          1HE       LYS  31  -4.102  -1.540 -10.847
  250   2HE   LYS  31          2HE       LYS  31  -4.568  -2.120  -9.248
  251   1HZ   LYS  31          1HZ       LYS  31  -6.023  -3.029 -10.910
  252   2HZ   LYS  31          2HZ       LYS  31  -6.903  -1.953  -9.935
  253   3HZ   LYS  31          3HZ       LYS  31  -6.406  -1.484 -11.491
  254    H    ALA  32           H        ALA  32  -3.369   3.420  -5.919
  255    HA   ALA  32           HA       ALA  32  -2.286   1.422  -4.265
  256   1HB   ALA  32          1HB       ALA  32  -1.608   3.254  -2.793
  257   2HB   ALA  32          2HB       ALA  32  -1.298   3.651  -4.482
  258   3HB   ALA  32          3HB       ALA  32  -2.687   4.352  -3.653
  259    H    ILE  33           H        ILE  33  -4.978   3.675  -3.721
  260    HA   ILE  33           HA       ILE  33  -5.854   2.675  -1.259
  261    HB   ILE  33           HB       ILE  33  -7.430   3.945  -3.506
  262   1HG1  ILE  33          1HG1      ILE  33  -6.374   5.108  -0.920
  263   2HG1  ILE  33          2HG1      ILE  33  -5.646   5.342  -2.506
  264   1HG2  ILE  33          1HG2      ILE  33  -9.172   4.390  -1.844
  265   2HG2  ILE  33          2HG2      ILE  33  -8.924   2.660  -2.088
  266   3HG2  ILE  33          3HG2      ILE  33  -8.270   3.451  -0.655
  267   1HD1  ILE  33          1HD1      ILE  33  -6.970   7.266  -1.833
  268   2HD1  ILE  33          2HD1      ILE  33  -7.653   6.493  -3.263
  269   3HD1  ILE  33          3HD1      ILE  33  -8.397   6.241  -1.685
  270    H    GLU  34           H        GLU  34  -6.660   1.761  -4.567
  271    HA   GLU  34           HA       GLU  34  -8.710  -0.059  -4.025
  272   1HB   GLU  34          1HB       GLU  34  -8.158   0.900  -6.251
  273   2HB   GLU  34          2HB       GLU  34  -6.735  -0.129  -6.307
  274   1HG   GLU  34          1HG       GLU  34  -8.108  -2.103  -6.324
  275   2HG   GLU  34          2HG       GLU  34  -9.565  -1.128  -6.123
  276    H    PHE  35           H        PHE  35  -5.209  -0.595  -4.418
  277    HA   PHE  35           HA       PHE  35  -5.263  -3.387  -4.087
  278   1HB   PHE  35          1HB       PHE  35  -3.112  -1.343  -3.572
  279   2HB   PHE  35          2HB       PHE  35  -2.848  -3.063  -3.305
  280    HD1  PHE  35           HD1      PHE  35  -4.340  -4.192  -5.608
  281    HD2  PHE  35           HD2      PHE  35  -1.706  -0.861  -5.352
  282    HE1  PHE  35           HE1      PHE  35  -3.737  -4.491  -7.973
  283    HE2  PHE  35           HE2      PHE  35  -1.104  -1.150  -7.718
  284    HZ   PHE  35           HZ       PHE  35  -2.119  -2.969  -9.032
  285    H    ALA  36           H        ALA  36  -4.973  -0.764  -1.741
  286    HA   ALA  36           HA       ALA  36  -4.571  -2.369   0.537
  287   1HB   ALA  36          1HB       ALA  36  -5.239  -0.408   1.822
  288   2HB   ALA  36          2HB       ALA  36  -4.142   0.039   0.515
  289   3HB   ALA  36          3HB       ALA  36  -5.872   0.347   0.359
  290    H    LYS  37           H        LYS  37  -7.534  -1.115  -0.972
  291    HA   LYS  37           HA       LYS  37  -9.259  -2.189   1.019
  292   1HB   LYS  37          1HB       LYS  37  -9.844  -1.267  -1.793
  293   2HB   LYS  37          2HB       LYS  37 -11.076  -1.724  -0.625
  294   1HG   LYS  37          1HG       LYS  37 -10.170   0.052   0.886
  295   2HG   LYS  37          2HG       LYS  37  -9.155   0.580  -0.454
  296   1HD   LYS  37          1HD       LYS  37 -12.169   0.460  -0.441
  297   2HD   LYS  37          2HD       LYS  37 -11.186   1.920  -0.323
  298   1HE   LYS  37          1HE       LYS  37 -10.251   1.438  -2.549
  299   2HE   LYS  37          2HE       LYS  37 -11.292   0.021  -2.664
  300   1HZ   LYS  37          1HZ       LYS  37 -13.212   1.533  -2.420
  301   2HZ   LYS  37          2HZ       LYS  37 -12.156   2.856  -2.489
  302   3HZ   LYS  37          3HZ       LYS  37 -12.309   1.821  -3.826
  303    H    GLN  38           H        GLN  38  -8.065  -3.410  -2.070
  304    HA   GLN  38           HA       GLN  38  -9.653  -5.728  -2.189
  305   1HB   GLN  38          1HB       GLN  38  -6.865  -5.162  -3.194
  306   2HB   GLN  38          2HB       GLN  38  -7.674  -6.697  -3.477
  307   1HG   GLN  38          1HG       GLN  38  -9.466  -5.545  -4.662
  308   2HG   GLN  38          2HG       GLN  38  -8.675  -3.999  -4.364
  309   1HE2  GLN  38          2HE2      GLN  38  -6.851  -3.457  -5.521
  310   2HE2  GLN  38          1HE2      GLN  38  -6.356  -4.316  -6.937
  311    H    TRP  39           H        TRP  39  -6.654  -5.019  -0.495
  312    HA   TRP  39           HA       TRP  39  -6.285  -7.606   0.617
  313   1HB   TRP  39          1HB       TRP  39  -4.469  -5.965   0.487
  314   2HB   TRP  39          2HB       TRP  39  -5.340  -4.891   1.573
  315    HD1  TRP  39           HD1      TRP  39  -3.803  -8.461   1.679
  316    HE1  TRP  39           HE1      TRP  39  -2.864  -8.844   4.051
  317    HE3  TRP  39           HE3      TRP  39  -5.267  -4.065   3.841
  318    HZ2  TRP  39           HZ2      TRP  39  -2.764  -7.456   6.507
  319    HZ3  TRP  39           HZ3      TRP  39  -4.706  -3.670   6.205
  320    HH2  TRP  39           HH2      TRP  39  -3.481  -5.333   7.508
  321    H    LEU  40           H        LEU  40  -7.840  -4.640   1.788
  322    HA   LEU  40           HA       LEU  40  -8.643  -5.556   4.304
  323   1HB   LEU  40          1HB       LEU  40  -9.979  -3.575   2.459
  324   2HB   LEU  40          2HB       LEU  40 -10.443  -3.827   4.129
  325    HG   LEU  40           HG       LEU  40  -7.747  -2.830   3.200
  326   1HD1  LEU  40          1HD1      LEU  40 -10.048  -1.375   4.498
  327   2HD1  LEU  40          2HD1      LEU  40  -8.458  -0.693   4.154
  328   3HD1  LEU  40          3HD1      LEU  40  -9.509  -1.192   2.829
  329   1HD2  LEU  40          1HD2      LEU  40  -7.360  -2.377   5.578
  330   2HD2  LEU  40          2HD2      LEU  40  -8.902  -3.140   5.970
  331   3HD2  LEU  40          3HD2      LEU  40  -7.596  -4.098   5.272
  332    H    SER  41           H        SER  41 -10.234  -5.832   1.152
  333    HA   SER  41           HA       SER  41 -12.618  -7.005   2.061
  334   1HB   SER  41          1HB       SER  41 -11.201  -7.353  -0.594
  335   2HB   SER  41          2HB       SER  41 -12.867  -7.828  -0.266
  336    HG   SER  41           HG       SER  41 -12.009  -5.179   0.210
  337    H    SER  42           H        SER  42  -9.469  -8.373   1.325
  338    HA   SER  42           HA       SER  42 -10.314 -11.087   1.374
  339   1HB   SER  42          1HB       SER  42  -8.222 -10.219   0.256
  340   2HB   SER  42          2HB       SER  42  -7.515 -10.053   1.863
  341    HG   SER  42           HG       SER  42  -7.037 -12.090   1.743
  342    H    ILE  43           H        ILE  43  -8.964  -8.883   3.804
  343    HA   ILE  43           HA       ILE  43  -8.824 -10.973   5.784
  344    HB   ILE  43           HB       ILE  43  -8.182  -9.227   7.375
  345   1HG1  ILE  43          1HG1      ILE  43  -8.538  -7.310   5.060
  346   2HG1  ILE  43          2HG1      ILE  43  -9.596  -7.409   6.465
  347   1HG2  ILE  43          1HG2      ILE  43  -6.732  -9.064   4.738
  348   2HG2  ILE  43          2HG2      ILE  43  -6.077  -8.579   6.302
  349   3HG2  ILE  43          3HG2      ILE  43  -6.478 -10.270   5.999
  350   1HD1  ILE  43          1HD1      ILE  43  -6.682  -6.659   6.499
  351   2HD1  ILE  43          2HD1      ILE  43  -8.045  -5.550   6.647
  352   3HD1  ILE  43          3HD1      ILE  43  -7.742  -6.749   7.905
  353    H    GLY  44           H        GLY  44 -11.313  -9.073   4.574
  354   1HA   GLY  44          1HA       GLY  44 -13.547  -9.678   5.155
  355   2HA   GLY  44          2HA       GLY  44 -12.996 -10.026   6.785
  356    H    GLU  45           H        GLU  45 -11.767  -7.105   5.557
  357    HA   GLU  45           HA       GLU  45 -13.679  -5.607   7.195
  358   1HB   GLU  45          1HB       GLU  45 -10.984  -4.898   6.040
  359   2HB   GLU  45          2HB       GLU  45 -12.037  -3.702   6.783
  360   1HG   GLU  45          1HG       GLU  45 -10.974  -6.161   8.154
  361   2HG   GLU  45          2HG       GLU  45 -10.304  -4.538   8.309
  362    H    GLU  46           H        GLU  46 -13.201  -6.487   4.040
  363    HA   GLU  46           HA       GLU  46 -14.007  -5.864   2.026
  364   1HB   GLU  46          1HB       GLU  46 -15.893  -4.187   3.687
  365   2HB   GLU  46          2HB       GLU  46 -16.048  -4.439   1.955
  366   1HG   GLU  46          1HG       GLU  46 -16.287  -6.858   2.356
  367   2HG   GLU  46          2HG       GLU  46 -16.216  -6.550   4.093
  368    H    GLY  47           H        GLY  47 -14.757  -2.727   3.414
  369   1HA   GLY  47          1HA       GLY  47 -12.330  -1.537   2.391
  370   2HA   GLY  47          2HA       GLY  47 -13.787  -1.114   1.499
  371    H    ALA  48           H        ALA  48 -12.005  -0.710   4.434
  372    HA   ALA  48           HA       ALA  48 -13.982   0.793   5.837
  373   1HB   ALA  48          1HB       ALA  48 -12.144  -0.316   7.004
  374   2HB   ALA  48          2HB       ALA  48 -10.984   0.736   6.192
  375   3HB   ALA  48          3HB       ALA  48 -12.147   1.418   7.329
  376    H    THR  49           H        THR  49 -13.066   3.142   6.587
  377    HA   THR  49           HA       THR  49 -13.325   4.824   4.336
  378    HB   THR  49           HB       THR  49 -12.225   5.579   7.052
  379    HG1  THR  49           HG1      THR  49 -14.943   5.616   6.165
  380   1HG2  THR  49          1HG2      THR  49 -13.653   7.199   4.939
  381   2HG2  THR  49          2HG2      THR  49 -13.142   7.792   6.519
  382   3HG2  THR  49          3HG2      THR  49 -11.936   7.295   5.332
  383    H    VAL  50           H        VAL  50 -11.758   4.467   2.810
  384    HA   VAL  50           HA       VAL  50  -9.042   5.300   3.572
  385    HB   VAL  50           HB       VAL  50  -9.646   3.120   1.559
  386   1HG1  VAL  50          1HG1      VAL  50  -7.216   2.786   1.557
  387   2HG1  VAL  50          2HG1      VAL  50  -7.653   4.406   1.019
  388   3HG1  VAL  50          3HG1      VAL  50  -7.031   4.157   2.651
  389   1HG2  VAL  50          1HG2      VAL  50  -8.490   2.893   4.337
  390   2HG2  VAL  50          2HG2      VAL  50 -10.079   2.327   3.822
  391   3HG2  VAL  50          3HG2      VAL  50  -8.622   1.580   3.167
  392    H    THR  51           H        THR  51  -9.253   7.346   2.791
  393    HA   THR  51           HA       THR  51  -9.529   7.536  -0.138
  394    HB   THR  51           HB       THR  51 -10.382   9.866   0.210
  395    HG1  THR  51           HG1      THR  51 -10.072   9.073   2.881
  396   1HG2  THR  51          1HG2      THR  51 -11.929   8.047  -0.285
  397   2HG2  THR  51          2HG2      THR  51 -12.049   7.665   1.432
  398   3HG2  THR  51          3HG2      THR  51 -12.663   9.203   0.826
  399    H    SER  52           H        SER  52  -8.730  10.140  -0.464
  400    HA   SER  52           HA       SER  52  -5.958   9.961  -0.513
  401   1HB   SER  52          1HB       SER  52  -7.211  11.472  -1.964
  402   2HB   SER  52          2HB       SER  52  -7.706  12.435  -0.574
  403    HG   SER  52           HG       SER  52  -5.767  13.317  -0.465
  404    H    GLU  53           H        GLU  53  -8.032  10.992   2.068
  405    HA   GLU  53           HA       GLU  53  -6.054  12.498   3.462
  406   1HB   GLU  53          1HB       GLU  53  -8.753  11.410   4.241
  407   2HB   GLU  53          2HB       GLU  53  -7.735  12.295   5.361
  408   1HG   GLU  53          1HG       GLU  53  -9.310  13.823   4.474
  409   2HG   GLU  53          2HG       GLU  53  -7.748  14.205   3.756
  410    H    GLU  54           H        GLU  54  -7.340   9.202   3.736
  411    HA   GLU  54           HA       GLU  54  -5.835   8.637   6.106
  412   1HB   GLU  54          1HB       GLU  54  -7.395   6.838   4.251
  413   2HB   GLU  54          2HB       GLU  54  -6.600   6.275   5.712
  414   1HG   GLU  54          1HG       GLU  54  -8.911   6.601   6.190
  415   2HG   GLU  54          2HG       GLU  54  -7.995   7.858   7.018
  416    H    CYS  55           H        CYS  55  -5.351   8.092   2.665
  417    HA   CYS  55           HA       CYS  55  -2.945   6.540   3.251
  418   1HB   CYS  55          1HB       CYS  55  -2.863   6.131   0.804
  419   2HB   CYS  55          2HB       CYS  55  -4.377   5.609   1.529
  420    HG   CYS  55           HG       CYS  55  -5.846   7.795   0.608
  421    H    ARG  56           H        ARG  56  -1.116   7.603   3.557
  422    HA   ARG  56           HA       ARG  56  -0.790  10.236   2.294
  423   1HB   ARG  56          1HB       ARG  56   0.767   8.964   4.550
  424   2HB   ARG  56          2HB       ARG  56   1.025  10.583   3.919
  425   1HG   ARG  56          1HG       ARG  56  -1.254  11.191   4.626
  426   2HG   ARG  56          2HG       ARG  56  -1.441   9.579   5.324
  427   1HD   ARG  56          1HD       ARG  56   0.605  11.651   6.111
  428   2HD   ARG  56          2HD       ARG  56  -0.817  11.180   7.042
  429    HE   ARG  56           HE       ARG  56   0.290   8.878   7.054
  430   1HH1  ARG  56          1HH1      ARG  56   2.118  11.876   6.947
  431   2HH1  ARG  56          2HH1      ARG  56   3.486  11.202   7.784
  432   1HH2  ARG  56          1HH2      ARG  56   2.063   8.014   8.149
  433   2HH2  ARG  56          2HH2      ARG  56   3.459   9.009   8.468
  434    H    PHE  57           H        PHE  57   0.526  10.442   0.610
  435    HA   PHE  57           HA       PHE  57   2.276   8.297  -0.174
  436   1HB   PHE  57          1HB       PHE  57   1.149   9.610  -1.901
  437   2HB   PHE  57          2HB       PHE  57   1.919  11.081  -1.314
  438    HD1  PHE  57           HD1      PHE  57   3.761  11.833  -2.447
  439    HD2  PHE  57           HD2      PHE  57   2.883   7.671  -2.491
  440    HE1  PHE  57           HE1      PHE  57   5.660  11.452  -3.963
  441    HE2  PHE  57           HE2      PHE  57   4.778   7.282  -4.008
  442    HZ   PHE  57           HZ       PHE  57   6.170   9.175  -4.746
  443    H    CYS  58           H        CYS  58   4.056   7.986   0.985
  444    HA   CYS  58           HA       CYS  58   5.362  10.093   2.409
  445   1HB   CYS  58          1HB       CYS  58   6.340   7.289   1.824
  446   2HB   CYS  58          2HB       CYS  58   6.983   8.379   3.046
  447    HG   CYS  58           HG       CYS  58   5.102   6.098   3.784
  448    H    HIS  59           H        HIS  59   6.436   7.973  -0.244
  449    HA   HIS  59           HA       HIS  59   7.516   9.933  -1.883
  450   1HB   HIS  59          1HB       HIS  59   9.959   9.637  -1.460
  451   2HB   HIS  59          2HB       HIS  59   9.123  10.448  -0.143
  452    HD1  HIS  59           HD1      HIS  59   9.525   9.526   2.133
  453    HD2  HIS  59           HD2      HIS  59  10.462   6.795  -0.864
  454    HE1  HIS  59           HE1      HIS  59  10.512   7.536   3.308
  455    HE2  HIS  59           HE2      HIS  59  11.226   5.968   1.464
  456    H    SER  60           H        SER  60   9.418   8.871  -3.269
  457    HA   SER  60           HA       SER  60   8.764   6.020  -3.672
  458   1HB   SER  60          1HB       SER  60   9.534   8.025  -5.812
  459   2HB   SER  60          2HB       SER  60   9.089   6.337  -6.067
  460    HG   SER  60           HG       SER  60   7.477   8.531  -5.376
  461    H    GLU  61           H        GLU  61  10.476   4.716  -3.356
  462    HA   GLU  61           HA       GLU  61  13.162   5.812  -3.795
  463   1HB   GLU  61          1HB       GLU  61  13.966   4.852  -1.688
  464   2HB   GLU  61          2HB       GLU  61  12.729   6.069  -1.412
  465   1HG   GLU  61          1HG       GLU  61  11.096   4.412  -0.917
  466   2HG   GLU  61          2HG       GLU  61  12.170   3.116  -1.444
  467    H    LYS  62           H        LYS  62  14.850   4.057  -3.595
  468    HA   LYS  62           HA       LYS  62  14.173   1.890  -5.324
  469   1HB   LYS  62          1HB       LYS  62  16.380   2.959  -5.377
  470   2HB   LYS  62          2HB       LYS  62  16.683   2.441  -3.726
  471   1HG   LYS  62          1HG       LYS  62  16.578   0.093  -4.475
  472   2HG   LYS  62          2HG       LYS  62  16.366   0.660  -6.134
  473   1HD   LYS  62          1HD       LYS  62  18.520   1.756  -6.075
  474   2HD   LYS  62          2HD       LYS  62  18.721   1.334  -4.374
  475   1HE   LYS  62          1HE       LYS  62  18.567  -0.585  -6.694
  476   2HE   LYS  62          2HE       LYS  62  20.014  -0.165  -5.778
  477   1HZ   LYS  62          1HZ       LYS  62  17.671  -1.733  -4.893
  478   2HZ   LYS  62          2HZ       LYS  62  19.298  -2.188  -4.894
  479   3HZ   LYS  62          3HZ       LYS  62  18.739  -1.039  -3.773
  480    H    ALA  63           H        ALA  63  13.559  -0.117  -4.810
  481    HA   ALA  63           HA       ALA  63  13.243  -0.734  -1.967
  482   1HB   ALA  63          1HB       ALA  63  11.608  -2.377  -2.689
  483   2HB   ALA  63          2HB       ALA  63  11.248  -0.797  -3.386
  484   3HB   ALA  63          3HB       ALA  63  12.000  -2.047  -4.377
  485    HA   PRO  64           HA       PRO  64  16.230  -4.067  -1.968
  486   1HB   PRO  64          1HB       PRO  64  14.189  -5.576  -0.432
  487   2HB   PRO  64          2HB       PRO  64  15.861  -5.194  -0.005
  488   1HG   PRO  64          1HG       PRO  64  13.817  -3.944   1.175
  489   2HG   PRO  64          2HG       PRO  64  15.319  -3.086   0.782
  490   1HD   PRO  64          1HD       PRO  64  12.680  -3.034  -0.625
  491   2HD   PRO  64          2HD       PRO  64  13.827  -1.711  -0.327
  492    H    ASP  65           H        ASP  65  16.571  -5.891  -3.155
  493    HA   ASP  65           HA       ASP  65  14.976  -6.304  -5.391
  494   1HB   ASP  65          1HB       ASP  65  17.399  -6.884  -5.148
  495   2HB   ASP  65          2HB       ASP  65  16.916  -8.306  -4.228
  496    H    GLU  66           H        GLU  66  14.826  -7.849  -2.277
  497    HA   GLU  66           HA       GLU  66  13.443 -10.181  -2.932
  498   1HB   GLU  66          1HB       GLU  66  13.205  -8.549  -0.399
  499   2HB   GLU  66          2HB       GLU  66  12.752 -10.238  -0.587
  500   1HG   GLU  66          1HG       GLU  66  15.519  -9.067  -0.720
  501   2HG   GLU  66          2HG       GLU  66  14.861 -10.134   0.520
  502    H    VAL  67           H        VAL  67  12.160  -6.973  -2.031
  503    HA   VAL  67           HA       VAL  67   9.445  -7.917  -2.225
  504    HB   VAL  67           HB       VAL  67   8.742  -5.664  -1.702
  505   1HG1  VAL  67          1HG1      VAL  67   9.451  -7.063   0.148
  506   2HG1  VAL  67          2HG1      VAL  67  11.111  -6.498  -0.038
  507   3HG1  VAL  67          3HG1      VAL  67   9.847  -5.374   0.464
  508   1HG2  VAL  67          1HG2      VAL  67  11.642  -4.882  -1.985
  509   2HG2  VAL  67          2HG2      VAL  67  10.322  -4.406  -3.054
  510   3HG2  VAL  67          3HG2      VAL  67  10.351  -3.841  -1.384
  511    H    ILE  68           H        ILE  68  11.745  -6.789  -4.423
  512    HA   ILE  68           HA       ILE  68  10.147  -5.405  -6.281
  513    HB   ILE  68           HB       ILE  68  12.586  -7.115  -6.803
  514   1HG1  ILE  68          1HG1      ILE  68  13.020  -5.310  -5.212
  515   2HG1  ILE  68          2HG1      ILE  68  13.815  -4.993  -6.748
  516   1HG2  ILE  68          1HG2      ILE  68  11.325  -6.727  -8.845
  517   2HG2  ILE  68          2HG2      ILE  68  11.307  -4.993  -8.521
  518   3HG2  ILE  68          3HG2      ILE  68  12.832  -5.810  -8.860
  519   1HD1  ILE  68          1HD1      ILE  68  11.247  -3.751  -5.793
  520   2HD1  ILE  68          2HD1      ILE  68  12.829  -2.974  -5.839
  521   3HD1  ILE  68          3HD1      ILE  68  12.029  -3.433  -7.343
  522    H    GLU  69           H        GLU  69  10.715  -8.813  -5.711
  523    HA   GLU  69           HA       GLU  69   9.473  -9.845  -8.000
  524   1HB   GLU  69          1HB       GLU  69   9.674 -10.996  -5.213
  525   2HB   GLU  69          2HB       GLU  69   9.111 -11.895  -6.616
  526   1HG   GLU  69          1HG       GLU  69  11.849 -10.733  -6.174
  527   2HG   GLU  69          2HG       GLU  69  11.402 -12.438  -6.246
  528    H    ALA  70           H        ALA  70   8.128  -9.001  -4.827
  529    HA   ALA  70           HA       ALA  70   5.475  -9.787  -5.410
  530   1HB   ALA  70          1HB       ALA  70   4.855  -8.497  -3.437
  531   2HB   ALA  70          2HB       ALA  70   6.288  -9.476  -3.125
  532   3HB   ALA  70          3HB       ALA  70   6.450  -7.745  -3.415
  533    H    ILE  71           H        ILE  71   7.212  -6.737  -5.756
  534    HA   ILE  71           HA       ILE  71   4.985  -5.162  -6.519
  535    HB   ILE  71           HB       ILE  71   7.914  -4.759  -7.159
  536   1HG1  ILE  71          1HG1      ILE  71   7.553  -4.842  -4.766
  537   2HG1  ILE  71          2HG1      ILE  71   7.836  -3.173  -5.244
  538   1HG2  ILE  71          1HG2      ILE  71   7.327  -2.406  -7.491
  539   2HG2  ILE  71          2HG2      ILE  71   6.498  -3.454  -8.642
  540   3HG2  ILE  71          3HG2      ILE  71   5.624  -2.801  -7.256
  541   1HD1  ILE  71          1HD1      ILE  71   5.449  -2.731  -5.137
  542   2HD1  ILE  71          2HD1      ILE  71   5.160  -4.406  -4.667
  543   3HD1  ILE  71          3HD1      ILE  71   6.069  -3.336  -3.600
  544    H    LYS  72           H        LYS  72   7.268  -7.134  -8.320
  545    HA   LYS  72           HA       LYS  72   6.294  -6.326 -10.893
  546   1HB   LYS  72          1HB       LYS  72   8.566  -7.054 -10.727
  547   2HB   LYS  72          2HB       LYS  72   8.092  -8.565  -9.967
  548   1HG   LYS  72          1HG       LYS  72   7.165  -9.381 -12.007
  549   2HG   LYS  72          2HG       LYS  72   7.373  -7.813 -12.787
  550   1HD   LYS  72          1HD       LYS  72   9.090  -9.445 -13.467
  551   2HD   LYS  72          2HD       LYS  72   9.778  -8.031 -12.673
  552   1HE   LYS  72          1HE       LYS  72   9.157 -10.485 -11.080
  553   2HE   LYS  72          2HE       LYS  72  10.621 -10.423 -12.059
  554   1HZ   LYS  72          1HZ       LYS  72  11.224  -8.362 -10.868
  555   2HZ   LYS  72          2HZ       LYS  72   9.879  -8.568  -9.865
  556   3HZ   LYS  72          3HZ       LYS  72  11.129  -9.714  -9.841
  557    H    GLN  73           H        GLN  73   5.535  -8.832  -8.600
  558    HA   GLN  73           HA       GLN  73   4.008 -10.401 -10.482
  559   1HB   GLN  73          1HB       GLN  73   5.265 -11.475  -8.673
  560   2HB   GLN  73          2HB       GLN  73   4.295 -10.623  -7.483
  561   1HG   GLN  73          1HG       GLN  73   2.304 -11.810  -8.265
  562   2HG   GLN  73          2HG       GLN  73   3.294 -12.677  -9.441
  563   1HE2  GLN  73          2HE2      GLN  73   1.694 -13.703  -7.226
  564   2HE2  GLN  73          1HE2      GLN  73   2.786 -14.601  -6.228
  565    H    ASN  74           H        ASN  74   3.138  -8.815  -7.394
  566    HA   ASN  74           HA       ASN  74   0.342  -8.897  -8.235
  567   1HB   ASN  74          1HB       ASN  74   1.644  -8.327  -5.569
  568   2HB   ASN  74          2HB       ASN  74  -0.087  -8.165  -5.848
  569   1HD2  ASN  74          2HD2      ASN  74   1.366  -9.950  -4.057
  570   2HD2  ASN  74          1HD2      ASN  74   0.894 -11.556  -4.493
  571    H    GLY  75           H        GLY  75   2.921  -6.646  -7.776
  572   1HA   GLY  75          1HA       GLY  75   2.872  -4.525  -8.864
  573   2HA   GLY  75          2HA       GLY  75   1.123  -4.512  -8.695
  574    H    TYR  76           H        TYR  76   2.036  -5.570  -5.818
  575    HA   TYR  76           HA       TYR  76   2.863  -3.091  -4.593
  576   1HB   TYR  76          1HB       TYR  76   0.866  -2.752  -3.265
  577   2HB   TYR  76          2HB       TYR  76   0.413  -2.761  -4.966
  578    HD1  TYR  76           HD1      TYR  76  -0.460  -5.041  -5.903
  579    HD2  TYR  76           HD2      TYR  76  -0.297  -4.081  -1.761
  580    HE1  TYR  76           HE1      TYR  76  -2.145  -6.769  -5.442
  581    HE2  TYR  76           HE2      TYR  76  -1.982  -5.807  -1.291
  582    HH   TYR  76           HH       TYR  76  -3.755  -7.014  -2.457
  583    H    PHE  77           H        PHE  77   3.200  -3.341  -2.293
  584    HA   PHE  77           HA       PHE  77   3.071  -6.084  -1.259
  585   1HB   PHE  77          1HB       PHE  77   5.378  -5.685  -2.069
  586   2HB   PHE  77          2HB       PHE  77   5.487  -4.267  -1.033
  587    HD1  PHE  77           HD1      PHE  77   6.100  -4.463   1.226
  588    HD2  PHE  77           HD2      PHE  77   5.111  -7.947  -1.010
  589    HE1  PHE  77           HE1      PHE  77   6.926  -5.873   3.065
  590    HE2  PHE  77           HE2      PHE  77   5.935  -9.362   0.825
  591    HZ   PHE  77           HZ       PHE  77   6.844  -8.327   2.866
  592    H    ILE  78           H        ILE  78   2.078  -6.107   0.646
  593    HA   ILE  78           HA       ILE  78   1.627  -3.577   2.032
  594    HB   ILE  78           HB       ILE  78   0.382  -6.293   2.508
  595   1HG1  ILE  78          1HG1      ILE  78  -0.264  -5.307   0.345
  596   2HG1  ILE  78          2HG1      ILE  78  -1.622  -5.355   1.464
  597   1HG2  ILE  78          1HG2      ILE  78  -0.313  -3.599   3.676
  598   2HG2  ILE  78          2HG2      ILE  78  -1.234  -5.085   3.907
  599   3HG2  ILE  78          3HG2      ILE  78   0.408  -4.958   4.538
  600   1HD1  ILE  78          1HD1      ILE  78   0.049  -2.938   0.817
  601   2HD1  ILE  78          2HD1      ILE  78  -1.576  -3.276   0.221
  602   3HD1  ILE  78          3HD1      ILE  78  -1.311  -2.982   1.939
  603    H    TYR  79           H        TYR  79   3.247  -3.080   3.393
  604    HA   TYR  79           HA       TYR  79   4.102  -5.176   5.275
  605   1HB   TYR  79          1HB       TYR  79   6.012  -4.291   4.096
  606   2HB   TYR  79          2HB       TYR  79   5.509  -2.635   4.426
  607    HD1  TYR  79           HD1      TYR  79   6.635  -5.762   6.102
  608    HD2  TYR  79           HD2      TYR  79   6.267  -1.527   6.358
  609    HE1  TYR  79           HE1      TYR  79   7.955  -5.777   8.175
  610    HE2  TYR  79           HE2      TYR  79   7.589  -1.534   8.430
  611    HH   TYR  79           HH       TYR  79   8.174  -3.072  10.234
  612    H    LYS  80           H        LYS  80   3.129  -5.067   7.170
  613    HA   LYS  80           HA       LYS  80   1.844  -2.630   8.029
  614   1HB   LYS  80          1HB       LYS  80   2.078  -5.368   9.285
  615   2HB   LYS  80          2HB       LYS  80   1.236  -4.025  10.049
  616   1HG   LYS  80          1HG       LYS  80  -0.294  -3.895   8.150
  617   2HG   LYS  80          2HG       LYS  80   0.550  -5.235   7.377
  618   1HD   LYS  80          1HD       LYS  80  -0.733  -5.453  10.093
  619   2HD   LYS  80          2HD       LYS  80  -1.589  -5.817   8.595
  620   1HE   LYS  80          1HE       LYS  80   0.092  -7.518   8.058
  621   2HE   LYS  80          2HE       LYS  80   0.932  -7.159   9.568
  622   1HZ   LYS  80          1HZ       LYS  80  -0.501  -9.115   9.746
  623   2HZ   LYS  80          2HZ       LYS  80  -1.009  -7.883  10.796
  624   3HZ   LYS  80          3HZ       LYS  80  -1.856  -8.173   9.356
  625    H    MET  81           H        MET  81   2.558  -1.208   9.479
  626    HA   MET  81           HA       MET  81   5.353  -1.256  10.142
  627   1HB   MET  81          1HB       MET  81   4.165   0.811   9.486
  628   2HB   MET  81          2HB       MET  81   3.178   0.693  10.934
  629   1HG   MET  81          1HG       MET  81   5.302   0.848  12.265
  630   2HG   MET  81          2HG       MET  81   6.126   1.237  10.753
  631   1HE   MET  81          1HE       MET  81   3.559   2.828   9.388
  632   2HE   MET  81          2HE       MET  81   5.247   3.291   9.164
  633   3HE   MET  81          3HE       MET  81   4.069   4.486   9.708
  634    H    GLU  82           H        GLU  82   2.355  -1.088  12.037
  635    HA   GLU  82           HA       GLU  82   3.666  -2.576  14.163
  636   1HB   GLU  82          1HB       GLU  82   2.576  -0.971  15.835
  637   2HB   GLU  82          2HB       GLU  82   4.028  -0.428  15.012
  638   1HG   GLU  82          1HG       GLU  82   2.720   1.437  14.880
  639   2HG   GLU  82          2HG       GLU  82   2.337   0.656  13.349
  640    H    GLY  83           H        GLY  83   1.965  -3.182  15.893
  641   1HA   GLY  83          1HA       GLY  83  -0.058  -4.242  16.336
  642   2HA   GLY  83          2HA       GLY  83  -0.680  -3.631  14.807
  643    H    CYS  84           H        CYS  84   2.318  -5.036  14.414
  644    HA   CYS  84           HA       CYS  84   1.159  -7.625  13.640
  645   1HB   CYS  84          1HB       CYS  84   2.872  -7.526  11.733
  646   2HB   CYS  84          2HB       CYS  84   1.455  -6.488  11.592
  647    HG   CYS  84           HG       CYS  84   3.911  -5.241  10.702
  648    H    ASN  85           H        ASN  85   1.940  -8.785  15.353
  649    HA   ASN  85           HA       ASN  85   4.869  -9.023  15.514
  650   1HB   ASN  85          1HB       ASN  85   2.943  -8.494  17.728
  651   2HB   ASN  85          2HB       ASN  85   4.267  -9.605  18.052
  652   1HD2  ASN  85          2HD2      ASN  85   4.671  -6.981  15.806
  653   2HD2  ASN  85          1HD2      ASN  85   5.686  -6.009  16.821
  Start of MODEL   20
    1    H    MET   1           H        MET   1  12.072   2.314 -12.089
    2    HA   MET   1           HA       MET   1  10.076   1.165 -11.303
    3   1HB   MET   1          1HB       MET   1  10.767  -1.052 -12.246
    4   2HB   MET   1          2HB       MET   1  11.962  -1.174 -10.963
    5   1HG   MET   1          1HG       MET   1  10.248  -1.219  -9.290
    6   2HG   MET   1          2HG       MET   1   9.005  -0.903 -10.498
    7   1HE   MET   1          1HE       MET   1   8.638  -3.253  -8.480
    8   2HE   MET   1          2HE       MET   1   8.123  -4.552  -9.554
    9   3HE   MET   1          3HE       MET   1   7.522  -2.914  -9.803
   10    H    GLN   2           H        GLN   2   9.757   1.943  -9.345
   11    HA   GLN   2           HA       GLN   2  11.815   1.771  -7.279
   12   1HB   GLN   2          1HB       GLN   2  11.975   3.946  -8.808
   13   2HB   GLN   2          2HB       GLN   2  10.670   4.484  -7.758
   14   1HG   GLN   2          1HG       GLN   2  12.718   5.266  -6.843
   15   2HG   GLN   2          2HG       GLN   2  12.123   3.970  -5.805
   16   1HE2  GLN   2          2HE2      GLN   2  14.592   4.978  -7.995
   17   2HE2  GLN   2          1HE2      GLN   2  15.647   3.626  -7.759
   18    H    ILE   3           H        ILE   3  10.955   1.830  -5.231
   19    HA   ILE   3           HA       ILE   3   8.193   1.171  -5.078
   20    HB   ILE   3           HB       ILE   3   8.596   1.203  -2.566
   21   1HG1  ILE   3          1HG1      ILE   3  11.467   1.517  -3.468
   22   2HG1  ILE   3          2HG1      ILE   3  10.534   2.739  -2.613
   23   1HG2  ILE   3          1HG2      ILE   3   8.581  -0.838  -3.852
   24   2HG2  ILE   3          2HG2      ILE   3  10.265  -0.591  -4.313
   25   3HG2  ILE   3          3HG2      ILE   3   9.849  -0.905  -2.630
   26   1HD1  ILE   3          1HD1      ILE   3  12.036   1.566  -1.115
   27   2HD1  ILE   3          2HD1      ILE   3  10.352   1.253  -0.687
   28   3HD1  ILE   3          3HD1      ILE   3  11.289   0.029  -1.546
   29    H    HIS   4           H        HIS   4   6.551   2.470  -4.958
   30    HA   HIS   4           HA       HIS   4   6.847   5.150  -3.837
   31   1HB   HIS   4          1HB       HIS   4   4.459   3.780  -5.112
   32   2HB   HIS   4          2HB       HIS   4   4.485   5.448  -4.555
   33    HD1  HIS   4           HD1      HIS   4   3.981   4.481  -7.550
   34    HD2  HIS   4           HD2      HIS   4   7.532   6.002  -6.004
   35    HE1  HIS   4           HE1      HIS   4   5.246   5.405  -9.522
   36    HE2  HIS   4           HE2      HIS   4   7.352   6.398  -8.552
   37    H    VAL   5           H        VAL   5   6.632   5.352  -1.708
   38    HA   VAL   5           HA       VAL   5   5.425   3.199  -0.181
   39    HB   VAL   5           HB       VAL   5   6.720   5.723   0.857
   40   1HG1  VAL   5          1HG1      VAL   5   6.154   3.074   2.184
   41   2HG1  VAL   5          2HG1      VAL   5   7.008   4.430   2.917
   42   3HG1  VAL   5          3HG1      VAL   5   5.307   4.592   2.482
   43   1HG2  VAL   5          1HG2      VAL   5   8.742   4.363   1.178
   44   2HG2  VAL   5          2HG2      VAL   5   7.959   3.021   0.343
   45   3HG2  VAL   5          3HG2      VAL   5   8.310   4.515  -0.525
   46    H    TYR   6           H        TYR   6   3.274   3.262  -0.061
   47    HA   TYR   6           HA       TYR   6   1.996   5.826   0.604
   48   1HB   TYR   6          1HB       TYR   6   0.844   3.275  -0.536
   49   2HB   TYR   6          2HB       TYR   6  -0.147   4.612   0.028
   50    HD1  TYR   6           HD1      TYR   6  -0.433   6.578  -1.295
   51    HD2  TYR   6           HD2      TYR   6   2.271   3.542  -2.543
   52    HE1  TYR   6           HE1      TYR   6  -0.304   7.617  -3.520
   53    HE2  TYR   6           HE2      TYR   6   2.414   4.575  -4.769
   54    HH   TYR   6           HH       TYR   6   1.084   7.694  -5.433
   55    H    ASP   7           H        ASP   7   2.445   5.847   2.826
   56    HA   ASP   7           HA       ASP   7   1.717   3.713   4.568
   57   1HB   ASP   7          1HB       ASP   7   3.295   5.308   5.403
   58   2HB   ASP   7          2HB       ASP   7   2.220   6.656   5.051
   59    H    THR   8           H        THR   8  -0.287   3.005   4.652
   60    HA   THR   8           HA       THR   8  -2.473   4.927   4.229
   61    HB   THR   8           HB       THR   8  -2.507   1.928   3.828
   62    HG1  THR   8           HG1      THR   8  -1.157   3.274   2.355
   63   1HG2  THR   8          1HG2      THR   8  -4.604   2.359   2.624
   64   2HG2  THR   8          2HG2      THR   8  -4.714   2.874   4.306
   65   3HG2  THR   8          3HG2      THR   8  -4.484   4.070   3.031
   66    H    TYR   9           H        TYR   9  -3.681   5.411   5.907
   67    HA   TYR   9           HA       TYR   9  -3.578   3.827   8.334
   68   1HB   TYR   9          1HB       TYR   9  -5.151   6.342   7.721
   69   2HB   TYR   9          2HB       TYR   9  -4.925   5.625   9.314
   70    HD1  TYR   9           HD1      TYR   9  -3.660   7.947   6.933
   71    HD2  TYR   9           HD2      TYR   9  -2.502   5.449  10.175
   72    HE1  TYR   9           HE1      TYR   9  -1.619   9.289   7.231
   73    HE2  TYR   9           HE2      TYR   9  -0.462   6.782  10.484
   74    HH   TYR   9           HH       TYR   9   0.996   8.266   9.013
   75    H    VAL  10           H        VAL  10  -5.008   2.294   8.843
   76    HA   VAL  10           HA       VAL  10  -7.666   2.414   7.577
   77    HB   VAL  10           HB       VAL  10  -6.162  -0.073   8.418
   78   1HG1  VAL  10          1HG1      VAL  10  -8.019  -1.287   7.389
   79   2HG1  VAL  10          2HG1      VAL  10  -8.568  -0.285   8.732
   80   3HG1  VAL  10          3HG1      VAL  10  -8.842   0.240   7.071
   81   1HG2  VAL  10          1HG2      VAL  10  -6.089  -0.584   6.018
   82   2HG2  VAL  10          2HG2      VAL  10  -6.828   0.981   5.670
   83   3HG2  VAL  10          3HG2      VAL  10  -5.223   0.906   6.398
   84    H    LYS  11           H        LYS  11  -9.088   3.061   9.038
   85    HA   LYS  11           HA       LYS  11  -8.601   2.751  11.851
   86   1HB   LYS  11          1HB       LYS  11 -11.150   3.702  10.548
   87   2HB   LYS  11          2HB       LYS  11 -10.607   4.011  12.190
   88   1HG   LYS  11          1HG       LYS  11  -8.665   5.268  11.167
   89   2HG   LYS  11          2HG       LYS  11  -9.534   5.160   9.633
   90   1HD   LYS  11          1HD       LYS  11 -11.522   6.153  10.900
   91   2HD   LYS  11          2HD       LYS  11 -10.356   6.560  12.159
   92   1HE   LYS  11          1HE       LYS  11 -10.402   7.514   9.308
   93   2HE   LYS  11          2HE       LYS  11 -10.612   8.473  10.770
   94   1HZ   LYS  11          1HZ       LYS  11  -8.447   8.889  10.144
   95   2HZ   LYS  11          2HZ       LYS  11  -8.252   7.688  11.321
   96   3HZ   LYS  11          3HZ       LYS  11  -8.143   7.288   9.669
   97    H    ALA  12           H        ALA  12  -8.803   0.741  12.647
   98    HA   ALA  12           HA       ALA  12 -10.885  -1.039  11.794
   99   1HB   ALA  12          1HB       ALA  12  -8.738  -1.909  12.592
  100   2HB   ALA  12          2HB       ALA  12  -9.051  -1.219  14.185
  101   3HB   ALA  12          3HB       ALA  12 -10.079  -2.512  13.566
  102    H    LYS  13           H        LYS  13 -12.664  -1.699  13.045
  103    HA   LYS  13           HA       LYS  13 -14.028   0.461  14.238
  104   1HB   LYS  13          1HB       LYS  13 -14.679  -2.490  14.271
  105   2HB   LYS  13          2HB       LYS  13 -15.796  -1.196  14.695
  106   1HG   LYS  13          1HG       LYS  13 -15.739  -0.333  12.461
  107   2HG   LYS  13          2HG       LYS  13 -14.469  -1.469  12.010
  108   1HD   LYS  13          1HD       LYS  13 -16.023  -3.332  12.430
  109   2HD   LYS  13          2HD       LYS  13 -17.295  -2.165  12.800
  110   1HE   LYS  13          1HE       LYS  13 -17.481  -2.975  10.503
  111   2HE   LYS  13          2HE       LYS  13 -17.120  -1.250  10.542
  112   1HZ   LYS  13          1HZ       LYS  13 -15.812  -2.481   8.880
  113   2HZ   LYS  13          2HZ       LYS  13 -14.829  -1.718  10.034
  114   3HZ   LYS  13          3HZ       LYS  13 -15.098  -3.390  10.121
  115    H    ASP  14           H        ASP  14 -12.406  -2.373  15.602
  116    HA   ASP  14           HA       ASP  14 -12.184  -0.923  18.124
  117   1HB   ASP  14          1HB       ASP  14 -14.236  -2.245  18.384
  118   2HB   ASP  14          2HB       ASP  14 -13.350  -3.712  17.980
  119    H    GLY  15           H        GLY  15 -11.000  -3.161  15.842
  120   1HA   GLY  15          1HA       GLY  15  -9.049  -4.384  17.587
  121   2HA   GLY  15          2HA       GLY  15  -9.207  -4.632  15.857
  122    H    HIS  16           H        HIS  16  -8.934  -1.417  17.182
  123    HA   HIS  16           HA       HIS  16  -7.245   0.083  17.377
  124   1HB   HIS  16          1HB       HIS  16  -5.836  -1.457  18.471
  125   2HB   HIS  16          2HB       HIS  16  -5.552  -2.372  17.000
  126    HD1  HIS  16           HD1      HIS  16  -4.873   1.201  18.169
  127    HD2  HIS  16           HD2      HIS  16  -3.096  -1.880  16.012
  128    HE1  HIS  16           HE1      HIS  16  -2.591   2.042  17.540
  129    HE2  HIS  16           HE2      HIS  16  -1.572   0.212  16.144
  130    H    VAL  17           H        VAL  17  -6.429   1.571  16.082
  131    HA   VAL  17           HA       VAL  17  -6.895   1.370  13.283
  132    HB   VAL  17           HB       VAL  17  -5.351   3.480  14.810
  133   1HG1  VAL  17          1HG1      VAL  17  -4.778   3.517  12.451
  134   2HG1  VAL  17          2HG1      VAL  17  -6.486   3.530  12.014
  135   3HG1  VAL  17          3HG1      VAL  17  -5.780   4.912  12.853
  136   1HG2  VAL  17          1HG2      VAL  17  -7.650   3.297  15.578
  137   2HG2  VAL  17          2HG2      VAL  17  -7.426   4.788  14.662
  138   3HG2  VAL  17          3HG2      VAL  17  -8.232   3.406  13.917
  139    H    MET  18           H        MET  18  -5.671   0.281  11.921
  140    HA   MET  18           HA       MET  18  -2.818  -0.077  12.526
  141   1HB   MET  18          1HB       MET  18  -4.616  -1.608  10.634
  142   2HB   MET  18          2HB       MET  18  -2.916  -1.952  10.920
  143   1HG   MET  18          1HG       MET  18  -3.423  -2.474  13.254
  144   2HG   MET  18          2HG       MET  18  -5.129  -2.146  12.950
  145   1HE   MET  18          1HE       MET  18  -5.517  -3.331  10.041
  146   2HE   MET  18          2HE       MET  18  -6.663  -3.634  11.346
  147   3HE   MET  18          3HE       MET  18  -6.040  -4.978  10.388
  148    H    HIS  19           H        HIS  19  -1.259   0.537  11.065
  149    HA   HIS  19           HA       HIS  19  -2.123   1.369   8.424
  150   1HB   HIS  19          1HB       HIS  19  -0.998   3.488   8.442
  151   2HB   HIS  19          2HB       HIS  19  -2.112   3.445   9.797
  152    HD1  HIS  19           HD1      HIS  19   1.312   4.183   8.915
  153    HD2  HIS  19           HD2      HIS  19  -0.713   2.988  12.355
  154    HE1  HIS  19           HE1      HIS  19   2.825   4.769  10.839
  155    HE2  HIS  19           HE2      HIS  19   1.499   4.226  12.908
  156    H    PHE  20           H        PHE  20  -0.629   1.038   6.857
  157    HA   PHE  20           HA       PHE  20   1.896  -0.214   7.656
  158   1HB   PHE  20          1HB       PHE  20   1.358  -2.029   5.929
  159   2HB   PHE  20          2HB       PHE  20   0.500  -2.111   7.464
  160    HD1  PHE  20           HD1      PHE  20  -1.865  -1.776   7.586
  161    HD2  PHE  20           HD2      PHE  20   0.189  -1.329   3.884
  162    HE1  PHE  20           HE1      PHE  20  -4.018  -1.789   6.396
  163    HE2  PHE  20           HE2      PHE  20  -1.962  -1.341   2.690
  164    HZ   PHE  20           HZ       PHE  20  -4.067  -1.568   3.944
  165    H    ASP  21           H        ASP  21   3.238  -0.717   5.651
  166    HA   ASP  21           HA       ASP  21   3.162   1.671   3.961
  167   1HB   ASP  21          1HB       ASP  21   5.334  -0.418   4.268
  168   2HB   ASP  21          2HB       ASP  21   5.457   1.057   3.319
  169    H    VAL  22           H        VAL  22   2.014   1.445   2.153
  170    HA   VAL  22           HA       VAL  22   1.951  -1.094   0.740
  171    HB   VAL  22           HB       VAL  22   0.731   1.554  -0.068
  172   1HG1  VAL  22          1HG1      VAL  22   1.024   0.050  -1.954
  173   2HG1  VAL  22          2HG1      VAL  22   0.220  -1.245  -1.066
  174   3HG1  VAL  22          3HG1      VAL  22  -0.685   0.191  -1.540
  175   1HG2  VAL  22          1HG2      VAL  22  -0.183   0.779   2.058
  176   2HG2  VAL  22          2HG2      VAL  22  -1.380   0.660   0.767
  177   3HG2  VAL  22          3HG2      VAL  22  -0.547  -0.787   1.335
  178    H    PHE  23           H        PHE  23   3.806  -1.543  -0.292
  179    HA   PHE  23           HA       PHE  23   5.227   0.576  -1.722
  180   1HB   PHE  23          1HB       PHE  23   5.935  -2.310  -1.167
  181   2HB   PHE  23          2HB       PHE  23   6.933  -1.225  -2.124
  182    HD1  PHE  23           HD1      PHE  23   7.902   0.811  -1.014
  183    HD2  PHE  23           HD2      PHE  23   6.063  -2.343   1.166
  184    HE1  PHE  23           HE1      PHE  23   9.059   1.549   1.027
  185    HE2  PHE  23           HE2      PHE  23   7.210  -1.606   3.210
  186    HZ   PHE  23           HZ       PHE  23   8.711   0.343   3.145
  187    H    THR  24           H        THR  24   4.527   0.988  -3.722
  188    HA   THR  24           HA       THR  24   4.294  -1.301  -5.532
  189    HB   THR  24           HB       THR  24   1.978  -0.727  -4.918
  190    HG1  THR  24           HG1      THR  24   1.767  -1.385  -6.926
  191   1HG2  THR  24          1HG2      THR  24   1.012   1.425  -5.605
  192   2HG2  THR  24          2HG2      THR  24   2.278   1.645  -4.398
  193   3HG2  THR  24          3HG2      THR  24   2.611   1.985  -6.095
  194    H    ASP  25           H        ASP  25   4.590  -0.719  -7.793
  195    HA   ASP  25           HA       ASP  25   6.357   1.595  -8.060
  196   1HB   ASP  25          1HB       ASP  25   7.186  -0.549  -8.921
  197   2HB   ASP  25          2HB       ASP  25   5.792  -0.670  -9.991
  198    H    VAL  26           H        VAL  26   3.164   0.681  -8.652
  199    HA   VAL  26           HA       VAL  26   2.583   2.099 -11.015
  200    HB   VAL  26           HB       VAL  26   0.736   1.536  -8.683
  201   1HG1  VAL  26          1HG1      VAL  26   0.118   2.160 -11.569
  202   2HG1  VAL  26          2HG1      VAL  26  -1.064   1.721 -10.334
  203   3HG1  VAL  26          3HG1      VAL  26  -0.157   3.229 -10.193
  204   1HG2  VAL  26          1HG2      VAL  26   1.278  -0.089 -11.168
  205   2HG2  VAL  26          2HG2      VAL  26   1.747  -0.514  -9.522
  206   3HG2  VAL  26          3HG2      VAL  26   0.041  -0.440  -9.962
  207    H    ARG  27           H        ARG  27   2.322   4.211 -11.414
  208    HA   ARG  27           HA       ARG  27   2.462   6.062  -9.144
  209   1HB   ARG  27          1HB       ARG  27   4.056   6.347 -11.052
  210   2HB   ARG  27          2HB       ARG  27   2.680   6.674 -12.098
  211   1HG   ARG  27          1HG       ARG  27   2.107   8.597 -10.628
  212   2HG   ARG  27          2HG       ARG  27   3.607   8.305  -9.747
  213   1HD   ARG  27          1HD       ARG  27   3.367   8.956 -12.683
  214   2HD   ARG  27          2HD       ARG  27   3.877  10.068 -11.416
  215    HE   ARG  27           HE       ARG  27   5.468   7.656 -11.653
  216   1HH1  ARG  27          1HH1      ARG  27   5.089  11.021 -12.569
  217   2HH1  ARG  27          2HH1      ARG  27   6.749  11.205 -13.051
  218   1HH2  ARG  27          1HH2      ARG  27   7.653   7.908 -12.292
  219   2HH2  ARG  27          2HH2      ARG  27   8.194   9.450 -12.906
  220    H    ASP  28           H        ASP  28   0.310   5.665  -8.487
  221    HA   ASP  28           HA       ASP  28  -1.607   7.429  -9.615
  222   1HB   ASP  28          1HB       ASP  28  -1.774   5.529 -11.231
  223   2HB   ASP  28          2HB       ASP  28  -2.221   4.476  -9.891
  224    H    ASP  29           H        ASP  29  -3.033   8.000  -8.073
  225    HA   ASP  29           HA       ASP  29  -2.609   6.879  -5.441
  226   1HB   ASP  29          1HB       ASP  29  -4.420   9.132  -6.342
  227   2HB   ASP  29          2HB       ASP  29  -4.067   8.714  -4.670
  228    H    LYS  30           H        LYS  30  -5.080   6.864  -7.900
  229    HA   LYS  30           HA       LYS  30  -7.222   5.962  -6.260
  230   1HB   LYS  30          1HB       LYS  30  -7.542   7.050  -8.468
  231   2HB   LYS  30          2HB       LYS  30  -6.829   5.643  -9.243
  232   1HG   LYS  30          1HG       LYS  30  -8.662   4.262  -8.318
  233   2HG   LYS  30          2HG       LYS  30  -9.402   5.736  -7.687
  234   1HD   LYS  30          1HD       LYS  30  -9.434   6.627 -10.016
  235   2HD   LYS  30          2HD       LYS  30  -8.874   5.050 -10.574
  236   1HE   LYS  30          1HE       LYS  30 -11.255   5.154 -10.835
  237   2HE   LYS  30          2HE       LYS  30 -10.882   4.032  -9.526
  238   1HZ   LYS  30          1HZ       LYS  30 -11.793   6.844  -9.232
  239   2HZ   LYS  30          2HZ       LYS  30 -12.698   5.452  -8.898
  240   3HZ   LYS  30          3HZ       LYS  30 -11.350   5.834  -7.944
  241    H    LYS  31           H        LYS  31  -4.908   4.364  -8.398
  242    HA   LYS  31           HA       LYS  31  -5.884   1.736  -8.048
  243   1HB   LYS  31          1HB       LYS  31  -4.182   2.764  -9.766
  244   2HB   LYS  31          2HB       LYS  31  -2.988   2.305  -8.560
  245   1HG   LYS  31          1HG       LYS  31  -3.156   0.572 -10.206
  246   2HG   LYS  31          2HG       LYS  31  -3.818  -0.019  -8.680
  247   1HD   LYS  31          1HD       LYS  31  -6.071   0.327  -9.462
  248   2HD   LYS  31          2HD       LYS  31  -5.482   1.104 -10.933
  249   1HE   LYS  31          1HE       LYS  31  -6.160  -1.173 -11.406
  250   2HE   LYS  31          2HE       LYS  31  -4.417  -1.004 -11.605
  251   1HZ   LYS  31          1HZ       LYS  31  -4.212  -1.910  -9.307
  252   2HZ   LYS  31          2HZ       LYS  31  -5.868  -2.263  -9.342
  253   3HZ   LYS  31          3HZ       LYS  31  -4.808  -3.011 -10.442
  254    H    ALA  32           H        ALA  32  -3.604   3.706  -6.251
  255    HA   ALA  32           HA       ALA  32  -2.592   1.680  -4.555
  256   1HB   ALA  32          1HB       ALA  32  -1.849   3.511  -3.119
  257   2HB   ALA  32          2HB       ALA  32  -1.492   3.851  -4.813
  258   3HB   ALA  32          3HB       ALA  32  -2.859   4.640  -4.024
  259    H    ILE  33           H        ILE  33  -5.248   4.005  -4.185
  260    HA   ILE  33           HA       ILE  33  -6.197   3.189  -1.689
  261    HB   ILE  33           HB       ILE  33  -7.678   4.303  -4.078
  262   1HG1  ILE  33          1HG1      ILE  33  -6.747   5.588  -1.498
  263   2HG1  ILE  33          2HG1      ILE  33  -5.972   5.771  -3.068
  264   1HG2  ILE  33          1HG2      ILE  33  -9.526   4.816  -2.569
  265   2HG2  ILE  33          2HG2      ILE  33  -9.250   3.077  -2.675
  266   3HG2  ILE  33          3HG2      ILE  33  -8.698   3.973  -1.259
  267   1HD1  ILE  33          1HD1      ILE  33  -7.985   6.862  -3.926
  268   2HD1  ILE  33          2HD1      ILE  33  -8.746   6.687  -2.346
  269   3HD1  ILE  33          3HD1      ILE  33  -7.320   7.708  -2.530
  270    H    GLU  34           H        GLU  34  -6.875   1.975  -4.927
  271    HA   GLU  34           HA       GLU  34  -8.809   0.062  -4.306
  272   1HB   GLU  34          1HB       GLU  34  -8.240   0.730  -6.599
  273   2HB   GLU  34          2HB       GLU  34  -6.664  -0.031  -6.436
  274   1HG   GLU  34          1HG       GLU  34  -7.912  -2.194  -6.011
  275   2HG   GLU  34          2HG       GLU  34  -9.356  -1.344  -6.562
  276    H    PHE  35           H        PHE  35  -5.268  -0.214  -4.413
  277    HA   PHE  35           HA       PHE  35  -5.073  -2.954  -3.882
  278   1HB   PHE  35          1HB       PHE  35  -3.154  -0.716  -3.208
  279   2HB   PHE  35          2HB       PHE  35  -2.760  -2.426  -3.081
  280    HD1  PHE  35           HD1      PHE  35  -1.484  -0.150  -4.787
  281    HD2  PHE  35           HD2      PHE  35  -4.270  -3.253  -5.630
  282    HE1  PHE  35           HE1      PHE  35  -0.758  -0.155  -7.136
  283    HE2  PHE  35           HE2      PHE  35  -3.549  -3.264  -7.984
  284    HZ   PHE  35           HZ       PHE  35  -1.789  -1.715  -8.739
  285    H    ALA  36           H        ALA  36  -5.153  -0.185  -1.688
  286    HA   ALA  36           HA       ALA  36  -4.678  -1.556   0.701
  287   1HB   ALA  36          1HB       ALA  36  -4.595   0.880   0.513
  288   2HB   ALA  36          2HB       ALA  36  -6.344   0.924   0.281
  289   3HB   ALA  36          3HB       ALA  36  -5.670   0.373   1.815
  290    H    LYS  37           H        LYS  37  -7.718  -0.852  -0.984
  291    HA   LYS  37           HA       LYS  37  -9.401  -1.932   1.023
  292   1HB   LYS  37          1HB       LYS  37  -9.923  -1.542  -1.926
  293   2HB   LYS  37          2HB       LYS  37 -11.149  -1.931  -0.728
  294   1HG   LYS  37          1HG       LYS  37 -10.593   0.182   0.447
  295   2HG   LYS  37          2HG       LYS  37  -9.498   0.579  -0.879
  296   1HD   LYS  37          1HD       LYS  37 -11.386   0.445  -2.451
  297   2HD   LYS  37          2HD       LYS  37 -12.469   0.108  -1.099
  298   1HE   LYS  37          1HE       LYS  37 -11.842   2.275  -0.101
  299   2HE   LYS  37          2HE       LYS  37 -10.841   2.611  -1.513
  300   1HZ   LYS  37          1HZ       LYS  37 -12.930   3.691  -1.782
  301   2HZ   LYS  37          2HZ       LYS  37 -12.877   2.398  -2.878
  302   3HZ   LYS  37          3HZ       LYS  37 -13.789   2.263  -1.453
  303    H    GLN  38           H        GLN  38  -7.796  -3.330  -1.773
  304    HA   GLN  38           HA       GLN  38  -9.152  -5.768  -1.921
  305   1HB   GLN  38          1HB       GLN  38  -6.258  -5.126  -2.508
  306   2HB   GLN  38          2HB       GLN  38  -7.032  -6.647  -2.930
  307   1HG   GLN  38          1HG       GLN  38  -7.837  -3.926  -3.931
  308   2HG   GLN  38          2HG       GLN  38  -6.915  -5.130  -4.830
  309   1HE2  GLN  38          2HE2      GLN  38  -7.942  -6.956  -5.600
  310   2HE2  GLN  38          1HE2      GLN  38  -9.666  -7.076  -5.692
  311    H    TRP  39           H        TRP  39  -6.297  -4.868  -0.033
  312    HA   TRP  39           HA       TRP  39  -5.930  -7.381   1.193
  313   1HB   TRP  39          1HB       TRP  39  -4.216  -5.571   1.093
  314   2HB   TRP  39          2HB       TRP  39  -5.160  -4.657   2.264
  315    HD1  TRP  39           HD1      TRP  39  -3.289  -8.043   2.036
  316    HE1  TRP  39           HE1      TRP  39  -2.395  -8.611   4.381
  317    HE3  TRP  39           HE3      TRP  39  -5.301  -4.135   4.646
  318    HZ2  TRP  39           HZ2      TRP  39  -2.522  -7.542   6.989
  319    HZ3  TRP  39           HZ3      TRP  39  -4.864  -3.979   7.063
  320    HH2  TRP  39           HH2      TRP  39  -3.502  -5.649   8.209
  321    H    LEU  40           H        LEU  40  -7.771  -4.513   2.095
  322    HA   LEU  40           HA       LEU  40  -8.513  -5.353   4.680
  323   1HB   LEU  40          1HB       LEU  40  -9.914  -3.465   2.789
  324   2HB   LEU  40          2HB       LEU  40 -10.281  -3.637   4.496
  325    HG   LEU  40           HG       LEU  40  -7.665  -2.661   3.347
  326   1HD1  LEU  40          1HD1      LEU  40  -8.302  -0.513   4.293
  327   2HD1  LEU  40          2HD1      LEU  40  -9.484  -1.054   3.100
  328   3HD1  LEU  40          3HD1      LEU  40  -9.841  -1.192   4.821
  329   1HD2  LEU  40          1HD2      LEU  40  -7.347  -3.899   5.425
  330   2HD2  LEU  40          2HD2      LEU  40  -7.071  -2.173   5.664
  331   3HD2  LEU  40          3HD2      LEU  40  -8.578  -2.908   6.211
  332    H    SER  41           H        SER  41 -10.176  -5.653   1.546
  333    HA   SER  41           HA       SER  41 -12.473  -6.949   2.518
  334   1HB   SER  41          1HB       SER  41 -11.144  -7.304  -0.182
  335   2HB   SER  41          2HB       SER  41 -12.828  -7.661   0.208
  336    HG   SER  41           HG       SER  41 -12.942  -5.346   0.806
  337    H    SER  42           H        SER  42  -9.282  -8.117   1.696
  338    HA   SER  42           HA       SER  42  -9.942 -10.878   1.676
  339   1HB   SER  42          1HB       SER  42  -7.955  -9.815   0.545
  340   2HB   SER  42          2HB       SER  42  -7.220  -9.651   2.140
  341    HG   SER  42           HG       SER  42  -7.583 -11.893   0.558
  342    H    ILE  43           H        ILE  43  -8.504  -8.737   4.150
  343    HA   ILE  43           HA       ILE  43  -8.079 -10.866   5.998
  344    HB   ILE  43           HB       ILE  43  -7.614  -9.124   7.670
  345   1HG1  ILE  43          1HG1      ILE  43  -8.286  -7.168   5.461
  346   2HG1  ILE  43          2HG1      ILE  43  -9.288  -7.470   6.875
  347   1HG2  ILE  43          1HG2      ILE  43  -5.840  -9.881   6.217
  348   2HG2  ILE  43          2HG2      ILE  43  -6.310  -8.709   4.986
  349   3HG2  ILE  43          3HG2      ILE  43  -5.659  -8.154   6.529
  350   1HD1  ILE  43          1HD1      ILE  43  -6.493  -6.357   6.900
  351   2HD1  ILE  43          2HD1      ILE  43  -7.984  -5.440   7.124
  352   3HD1  ILE  43          3HD1      ILE  43  -7.506  -6.648   8.316
  353    H    GLY  44           H        GLY  44 -10.815  -8.850   5.295
  354   1HA   GLY  44          1HA       GLY  44 -12.889 -10.070   6.080
  355   2HA   GLY  44          2HA       GLY  44 -12.163  -9.967   7.675
  356    H    GLU  45           H        GLU  45 -11.176  -7.177   6.667
  357    HA   GLU  45           HA       GLU  45 -13.131  -5.639   7.955
  358   1HB   GLU  45          1HB       GLU  45 -10.948  -4.876   6.018
  359   2HB   GLU  45          2HB       GLU  45 -11.993  -3.689   6.788
  360   1HG   GLU  45          1HG       GLU  45 -10.171  -5.618   8.208
  361   2HG   GLU  45          2HG       GLU  45  -9.878  -3.896   7.960
  362    H    GLU  46           H        GLU  46 -12.677  -6.519   4.614
  363    HA   GLU  46           HA       GLU  46 -14.061  -6.533   2.829
  364   1HB   GLU  46          1HB       GLU  46 -15.807  -7.293   4.385
  365   2HB   GLU  46          2HB       GLU  46 -16.194  -5.621   4.771
  366   1HG   GLU  46          1HG       GLU  46 -17.801  -6.535   3.216
  367   2HG   GLU  46          2HG       GLU  46 -16.870  -5.246   2.455
  368    H    GLY  47           H        GLY  47 -15.367  -3.765   4.654
  369   1HA   GLY  47          1HA       GLY  47 -14.418  -2.015   2.486
  370   2HA   GLY  47          2HA       GLY  47 -16.107  -1.975   2.970
  371    H    ALA  48           H        ALA  48 -13.029  -0.739   3.510
  372    HA   ALA  48           HA       ALA  48 -14.000   0.679   5.899
  373   1HB   ALA  48          1HB       ALA  48 -11.731   0.856   6.697
  374   2HB   ALA  48          2HB       ALA  48 -12.099  -0.841   6.391
  375   3HB   ALA  48          3HB       ALA  48 -11.119   0.071   5.243
  376    H    THR  49           H        THR  49 -13.274   2.897   6.076
  377    HA   THR  49           HA       THR  49 -13.551   4.284   3.622
  378    HB   THR  49           HB       THR  49 -12.650   5.431   6.269
  379    HG1  THR  49           HG1      THR  49 -14.803   5.577   6.796
  380   1HG2  THR  49          1HG2      THR  49 -12.427   6.958   4.373
  381   2HG2  THR  49          2HG2      THR  49 -14.103   6.652   3.916
  382   3HG2  THR  49          3HG2      THR  49 -13.740   7.474   5.432
  383    H    VAL  50           H        VAL  50 -11.944   4.151   2.160
  384    HA   VAL  50           HA       VAL  50  -9.253   4.948   3.069
  385    HB   VAL  50           HB       VAL  50  -9.856   3.159   0.705
  386   1HG1  VAL  50          1HG1      VAL  50  -7.438   2.773   0.682
  387   2HG1  VAL  50          2HG1      VAL  50  -7.825   4.476   0.441
  388   3HG1  VAL  50          3HG1      VAL  50  -7.244   3.917   2.009
  389   1HG2  VAL  50          1HG2      VAL  50 -10.361   1.989   2.782
  390   2HG2  VAL  50          2HG2      VAL  50  -8.902   1.336   2.038
  391   3HG2  VAL  50          3HG2      VAL  50  -8.776   2.419   3.423
  392    H    THR  51           H        THR  51  -9.228   7.052   2.583
  393    HA   THR  51           HA       THR  51  -9.889   7.842  -0.180
  394    HB   THR  51           HB       THR  51 -10.398  10.103   0.745
  395    HG1  THR  51           HG1      THR  51 -10.898   9.715   3.234
  396   1HG2  THR  51          1HG2      THR  51 -12.567   9.520   1.734
  397   2HG2  THR  51          2HG2      THR  51 -12.219   8.529   0.319
  398   3HG2  THR  51          3HG2      THR  51 -12.026   7.853   1.937
  399    H    SER  52           H        SER  52  -8.822  10.344  -0.229
  400    HA   SER  52           HA       SER  52  -6.013   9.924  -0.354
  401   1HB   SER  52          1HB       SER  52  -7.464  12.582  -0.368
  402   2HB   SER  52          2HB       SER  52  -5.884  12.222  -1.064
  403    HG   SER  52           HG       SER  52  -6.805  11.228  -2.730
  404    H    GLU  53           H        GLU  53  -8.049  10.487   2.207
  405    HA   GLU  53           HA       GLU  53  -6.281  12.090   3.823
  406   1HB   GLU  53          1HB       GLU  53  -8.834  12.013   3.965
  407   2HB   GLU  53          2HB       GLU  53  -8.637  10.456   4.756
  408   1HG   GLU  53          1HG       GLU  53  -8.869  11.945   6.511
  409   2HG   GLU  53          2HG       GLU  53  -7.126  11.701   6.402
  410    H    GLU  54           H        GLU  54  -7.245   8.711   3.549
  411    HA   GLU  54           HA       GLU  54  -5.573   7.953   5.800
  412   1HB   GLU  54          1HB       GLU  54  -7.278   6.194   4.031
  413   2HB   GLU  54          2HB       GLU  54  -6.559   5.754   5.573
  414   1HG   GLU  54          1HG       GLU  54  -8.738   7.780   5.123
  415   2HG   GLU  54          2HG       GLU  54  -8.910   6.183   5.850
  416    H    CYS  55           H        CYS  55  -5.777   7.367   2.306
  417    HA   CYS  55           HA       CYS  55  -3.219   5.951   2.406
  418   1HB   CYS  55          1HB       CYS  55  -5.192   5.057   1.075
  419   2HB   CYS  55          2HB       CYS  55  -4.967   6.420  -0.017
  420    HG   CYS  55           HG       CYS  55  -2.710   3.913   0.572
  421    H    ARG  56           H        ARG  56  -1.482   7.212   2.343
  422    HA   ARG  56           HA       ARG  56  -1.566   9.629   0.655
  423   1HB   ARG  56          1HB       ARG  56  -0.219   9.336   3.346
  424   2HB   ARG  56          2HB       ARG  56  -0.208  10.777   2.339
  425   1HG   ARG  56          1HG       ARG  56  -2.565  11.085   2.651
  426   2HG   ARG  56          2HG       ARG  56  -2.694   9.545   3.504
  427   1HD   ARG  56          1HD       ARG  56  -2.681  11.390   5.081
  428   2HD   ARG  56          2HD       ARG  56  -1.228  10.409   5.267
  429    HE   ARG  56           HE       ARG  56  -1.233  12.949   3.755
  430   1HH1  ARG  56          1HH1      ARG  56   0.200  10.777   6.107
  431   2HH1  ARG  56          2HH1      ARG  56   1.513  11.847   6.480
  432   1HH2  ARG  56          1HH2      ARG  56   0.481  14.350   4.241
  433   2HH2  ARG  56          2HH2      ARG  56   1.689  13.883   5.402
  434    H    PHE  57           H        PHE  57   0.328  10.177  -0.425
  435    HA   PHE  57           HA       PHE  57   2.314   8.059  -0.660
  436   1HB   PHE  57          1HB       PHE  57   1.505   9.157  -2.709
  437   2HB   PHE  57          2HB       PHE  57   2.065  10.713  -2.107
  438    HD1  PHE  57           HD1      PHE  57   4.365  11.334  -2.231
  439    HD2  PHE  57           HD2      PHE  57   3.125   7.436  -3.396
  440    HE1  PHE  57           HE1      PHE  57   6.560  10.952  -3.269
  441    HE2  PHE  57           HE2      PHE  57   5.321   7.047  -4.436
  442    HZ   PHE  57           HZ       PHE  57   7.041   8.806  -4.370
  443    H    CYS  58           H        CYS  58   3.931   8.018   0.747
  444    HA   CYS  58           HA       CYS  58   4.613  10.453   2.185
  445   1HB   CYS  58          1HB       CYS  58   5.468   7.587   2.612
  446   2HB   CYS  58          2HB       CYS  58   5.926   8.940   3.645
  447    HG   CYS  58           HG       CYS  58   3.357   9.492   4.511
  448    H    HIS  59           H        HIS  59   6.280   7.987   0.210
  449    HA   HIS  59           HA       HIS  59   8.166   9.873  -0.766
  450   1HB   HIS  59          1HB       HIS  59   8.965   9.595   1.571
  451   2HB   HIS  59          2HB       HIS  59   9.237   7.896   1.268
  452    HD1  HIS  59           HD1      HIS  59  10.415  11.269  -0.071
  453    HD2  HIS  59           HD2      HIS  59  11.794   7.390   0.537
  454    HE1  HIS  59           HE1      HIS  59  12.846  11.305  -0.705
  455    HE2  HIS  59           HE2      HIS  59  13.706   9.012  -0.109
  456    H    SER  60           H        SER  60   9.999   8.725  -1.842
  457    HA   SER  60           HA       SER  60   9.444   5.991  -2.693
  458   1HB   SER  60          1HB       SER  60   8.305   7.571  -4.327
  459   2HB   SER  60          2HB       SER  60   9.907   8.193  -4.723
  460    HG   SER  60           HG       SER  60   9.440   5.423  -4.832
  461    H    GLU  61           H        GLU  61  11.400   4.897  -3.303
  462    HA   GLU  61           HA       GLU  61  13.882   6.318  -3.258
  463   1HB   GLU  61          1HB       GLU  61  14.673   5.418  -1.080
  464   2HB   GLU  61          2HB       GLU  61  13.372   6.589  -0.920
  465   1HG   GLU  61          1HG       GLU  61  11.781   4.675  -0.712
  466   2HG   GLU  61          2HG       GLU  61  13.177   3.598  -0.665
  467    H    LYS  62           H        LYS  62  15.709   4.628  -2.673
  468    HA   LYS  62           HA       LYS  62  15.777   2.807  -4.757
  469   1HB   LYS  62          1HB       LYS  62  17.779   3.650  -3.653
  470   2HB   LYS  62          2HB       LYS  62  17.352   2.798  -2.177
  471   1HG   LYS  62          1HG       LYS  62  17.619   0.660  -3.336
  472   2HG   LYS  62          2HG       LYS  62  18.060   1.522  -4.814
  473   1HD   LYS  62          1HD       LYS  62  20.000   2.474  -3.708
  474   2HD   LYS  62          2HD       LYS  62  19.542   1.697  -2.191
  475   1HE   LYS  62          1HE       LYS  62  19.829  -0.495  -3.216
  476   2HE   LYS  62          2HE       LYS  62  20.257   0.268  -4.749
  477   1HZ   LYS  62          1HZ       LYS  62  22.205  -0.459  -3.473
  478   2HZ   LYS  62          2HZ       LYS  62  22.203   1.219  -3.727
  479   3HZ   LYS  62          3HZ       LYS  62  21.770   0.589  -2.211
  480    H    ALA  63           H        ALA  63  14.513   1.129  -5.046
  481    HA   ALA  63           HA       ALA  63  13.203  -0.194  -2.859
  482   1HB   ALA  63          1HB       ALA  63  12.077  -1.480  -4.580
  483   2HB   ALA  63          2HB       ALA  63  12.059   0.239  -4.983
  484   3HB   ALA  63          3HB       ALA  63  13.183  -0.847  -5.801
  485    HA   PRO  64           HA       PRO  64  16.186  -3.530  -2.307
  486   1HB   PRO  64          1HB       PRO  64  13.789  -4.797  -1.099
  487   2HB   PRO  64          2HB       PRO  64  15.404  -4.573  -0.419
  488   1HG   PRO  64          1HG       PRO  64  13.339  -3.099   0.418
  489   2HG   PRO  64          2HG       PRO  64  14.962  -2.400   0.252
  490   1HD   PRO  64          1HD       PRO  64  12.587  -2.130  -1.543
  491   2HD   PRO  64          2HD       PRO  64  13.799  -0.916  -1.087
  492    H    ASP  65           H        ASP  65  16.496  -5.477  -3.377
  493    HA   ASP  65           HA       ASP  65  15.125  -5.757  -5.818
  494   1HB   ASP  65          1HB       ASP  65  17.460  -6.455  -5.499
  495   2HB   ASP  65          2HB       ASP  65  16.933  -7.744  -4.423
  496    H    GLU  66           H        GLU  66  14.815  -7.493  -2.764
  497    HA   GLU  66           HA       GLU  66  13.278  -9.632  -3.802
  498   1HB   GLU  66          1HB       GLU  66  14.545  -9.877  -1.760
  499   2HB   GLU  66          2HB       GLU  66  13.602  -8.618  -0.978
  500   1HG   GLU  66          1HG       GLU  66  11.681  -9.978  -0.890
  501   2HG   GLU  66          2HG       GLU  66  12.379 -11.161  -1.993
  502    H    VAL  67           H        VAL  67  12.379  -6.487  -2.480
  503    HA   VAL  67           HA       VAL  67   9.619  -7.189  -2.154
  504    HB   VAL  67           HB       VAL  67   9.178  -4.884  -1.672
  505   1HG1  VAL  67          1HG1      VAL  67  11.830  -5.725  -0.521
  506   2HG1  VAL  67          2HG1      VAL  67  10.782  -4.470   0.144
  507   3HG1  VAL  67          3HG1      VAL  67  10.232  -6.146   0.096
  508   1HG2  VAL  67          1HG2      VAL  67  10.455  -3.841  -3.464
  509   2HG2  VAL  67          2HG2      VAL  67  10.844  -3.119  -1.902
  510   3HG2  VAL  67          3HG2      VAL  67  11.960  -4.266  -2.648
  511    H    ILE  68           H        ILE  68  11.566  -6.240  -4.782
  512    HA   ILE  68           HA       ILE  68   9.669  -5.049  -6.482
  513    HB   ILE  68           HB       ILE  68  12.092  -6.729  -7.154
  514   1HG1  ILE  68          1HG1      ILE  68  12.656  -4.722  -5.899
  515   2HG1  ILE  68          2HG1      ILE  68  13.175  -4.547  -7.572
  516   1HG2  ILE  68          1HG2      ILE  68  10.554  -6.684  -9.036
  517   2HG2  ILE  68          2HG2      ILE  68  10.486  -4.923  -8.954
  518   3HG2  ILE  68          3HG2      ILE  68  11.997  -5.729  -9.381
  519   1HD1  ILE  68          1HD1      ILE  68  11.229  -3.156  -8.032
  520   2HD1  ILE  68          2HD1      ILE  68  10.697  -3.345  -6.360
  521   3HD1  ILE  68          3HD1      ILE  68  12.202  -2.495  -6.717
  522    H    GLU  69           H        GLU  69  10.511  -8.388  -5.809
  523    HA   GLU  69           HA       GLU  69   9.056  -9.659  -7.832
  524   1HB   GLU  69          1HB       GLU  69  10.751 -10.702  -6.290
  525   2HB   GLU  69          2HB       GLU  69   9.524 -10.695  -5.031
  526   1HG   GLU  69          1HG       GLU  69   9.638 -12.872  -6.025
  527   2HG   GLU  69          2HG       GLU  69   8.102 -12.118  -6.454
  528    H    ALA  70           H        ALA  70   8.120  -8.692  -4.562
  529    HA   ALA  70           HA       ALA  70   5.554  -9.854  -4.583
  530   1HB   ALA  70          1HB       ALA  70   6.702  -9.178  -2.534
  531   2HB   ALA  70          2HB       ALA  70   6.535  -7.485  -3.000
  532   3HB   ALA  70          3HB       ALA  70   5.100  -8.449  -2.649
  533    H    ILE  71           H        ILE  71   6.732  -6.664  -5.520
  534    HA   ILE  71           HA       ILE  71   4.195  -5.505  -6.017
  535    HB   ILE  71           HB       ILE  71   6.854  -4.776  -7.267
  536   1HG1  ILE  71          1HG1      ILE  71   5.491  -3.659  -4.804
  537   2HG1  ILE  71          2HG1      ILE  71   6.884  -4.735  -4.788
  538   1HG2  ILE  71          1HG2      ILE  71   5.834  -2.571  -7.609
  539   2HG2  ILE  71          2HG2      ILE  71   4.967  -3.835  -8.479
  540   3HG2  ILE  71          3HG2      ILE  71   4.306  -3.185  -6.979
  541   1HD1  ILE  71          1HD1      ILE  71   8.198  -3.033  -5.958
  542   2HD1  ILE  71          2HD1      ILE  71   6.803  -1.954  -5.932
  543   3HD1  ILE  71          3HD1      ILE  71   7.565  -2.448  -4.420
  544    H    LYS  72           H        LYS  72   6.350  -7.501  -7.933
  545    HA   LYS  72           HA       LYS  72   5.016  -7.177 -10.411
  546   1HB   LYS  72          1HB       LYS  72   6.638  -9.482  -9.337
  547   2HB   LYS  72          2HB       LYS  72   6.059  -9.379 -10.990
  548   1HG   LYS  72          1HG       LYS  72   7.411  -7.393 -11.358
  549   2HG   LYS  72          2HG       LYS  72   7.967  -7.452  -9.681
  550   1HD   LYS  72          1HD       LYS  72   8.981  -9.624 -10.072
  551   2HD   LYS  72          2HD       LYS  72   8.374  -9.629 -11.728
  552   1HE   LYS  72          1HE       LYS  72   9.754  -7.696 -12.253
  553   2HE   LYS  72          2HE       LYS  72  10.331  -7.640 -10.586
  554   1HZ   LYS  72          1HZ       LYS  72  11.336  -9.800 -10.878
  555   2HZ   LYS  72          2HZ       LYS  72  10.742  -9.907 -12.465
  556   3HZ   LYS  72          3HZ       LYS  72  11.907  -8.737 -12.072
  557    H    GLN  73           H        GLN  73   4.815  -9.683  -7.930
  558    HA   GLN  73           HA       GLN  73   2.908 -11.237  -9.340
  559   1HB   GLN  73          1HB       GLN  73   3.615 -11.369  -6.406
  560   2HB   GLN  73          2HB       GLN  73   2.838 -12.631  -7.354
  561   1HG   GLN  73          1HG       GLN  73   5.652 -11.607  -7.669
  562   2HG   GLN  73          2HG       GLN  73   5.156 -13.173  -7.030
  563   1HE2  GLN  73          2HE2      GLN  73   6.905 -12.529  -9.289
  564   2HE2  GLN  73          1HE2      GLN  73   6.187 -13.300 -10.668
  565    H    ASN  74           H        ASN  74   2.590  -9.120  -6.481
  566    HA   ASN  74           HA       ASN  74  -0.298  -9.599  -6.544
  567   1HB   ASN  74          1HB       ASN  74   1.409  -8.218  -4.463
  568   2HB   ASN  74          2HB       ASN  74  -0.330  -8.445  -4.344
  569   1HD2  ASN  74          2HD2      ASN  74   2.765  -9.897  -4.024
  570   2HD2  ASN  74          1HD2      ASN  74   2.227 -11.421  -3.416
  571    H    GLY  75           H        GLY  75   1.984  -7.255  -7.482
  572   1HA   GLY  75          1HA       GLY  75   1.498  -5.299  -8.699
  573   2HA   GLY  75          2HA       GLY  75  -0.159  -5.371  -8.110
  574    H    TYR  76           H        TYR  76   1.292  -5.940  -5.412
  575    HA   TYR  76           HA       TYR  76   2.407  -3.412  -4.685
  576   1HB   TYR  76          1HB       TYR  76   0.642  -2.824  -3.037
  577   2HB   TYR  76          2HB       TYR  76   0.068  -2.741  -4.699
  578    HD1  TYR  76           HD1      TYR  76  -1.350  -4.658  -5.580
  579    HD2  TYR  76           HD2      TYR  76  -0.438  -4.197  -1.452
  580    HE1  TYR  76           HE1      TYR  76  -3.232  -6.131  -5.009
  581    HE2  TYR  76           HE2      TYR  76  -2.317  -5.672  -0.867
  582    HH   TYR  76           HH       TYR  76  -3.938  -7.585  -3.159
  583    H    PHE  77           H        PHE  77   3.525  -3.539  -2.792
  584    HA   PHE  77           HA       PHE  77   3.441  -6.133  -1.413
  585   1HB   PHE  77          1HB       PHE  77   5.624  -5.619  -2.338
  586   2HB   PHE  77          2HB       PHE  77   5.624  -4.042  -1.560
  587    HD1  PHE  77           HD1      PHE  77   5.301  -7.649  -0.651
  588    HD2  PHE  77           HD2      PHE  77   6.815  -3.809   0.382
  589    HE1  PHE  77           HE1      PHE  77   6.418  -8.621   1.315
  590    HE2  PHE  77           HE2      PHE  77   7.934  -4.773   2.347
  591    HZ   PHE  77           HZ       PHE  77   7.737  -7.183   2.817
  592    H    ILE  78           H        ILE  78   2.340  -6.140   0.411
  593    HA   ILE  78           HA       ILE  78   1.909  -3.655   1.869
  594    HB   ILE  78           HB       ILE  78   0.809  -6.430   2.363
  595   1HG1  ILE  78          1HG1      ILE  78  -0.048  -5.404   0.308
  596   2HG1  ILE  78          2HG1      ILE  78  -1.308  -5.503   1.532
  597   1HG2  ILE  78          1HG2      ILE  78   0.951  -5.180   4.442
  598   2HG2  ILE  78          2HG2      ILE  78   0.119  -3.813   3.699
  599   3HG2  ILE  78          3HG2      ILE  78  -0.731  -5.341   3.936
  600   1HD1  ILE  78          1HD1      ILE  78  -0.972  -3.133   2.048
  601   2HD1  ILE  78          2HD1      ILE  78   0.265  -3.047   0.793
  602   3HD1  ILE  78          3HD1      ILE  78  -1.409  -3.394   0.359
  603    H    TYR  79           H        TYR  79   3.520  -3.083   3.172
  604    HA   TYR  79           HA       TYR  79   4.927  -5.142   4.702
  605   1HB   TYR  79          1HB       TYR  79   6.159  -3.282   3.482
  606   2HB   TYR  79          2HB       TYR  79   5.479  -2.174   4.666
  607    HD1  TYR  79           HD1      TYR  79   6.441  -1.952   6.824
  608    HD2  TYR  79           HD2      TYR  79   7.701  -5.098   4.252
  609    HE1  TYR  79           HE1      TYR  79   8.314  -2.438   8.344
  610    HE2  TYR  79           HE2      TYR  79   9.575  -5.593   5.762
  611    HH   TYR  79           HH       TYR  79   9.803  -4.312   8.906
  612    H    LYS  80           H        LYS  80   3.856  -5.734   6.471
  613    HA   LYS  80           HA       LYS  80   1.962  -4.094   7.795
  614   1HB   LYS  80          1HB       LYS  80   3.288  -6.695   8.529
  615   2HB   LYS  80          2HB       LYS  80   2.151  -5.896   9.603
  616   1HG   LYS  80          1HG       LYS  80   0.424  -6.034   7.880
  617   2HG   LYS  80          2HG       LYS  80   1.568  -6.840   6.804
  618   1HD   LYS  80          1HD       LYS  80   1.690  -8.740   8.198
  619   2HD   LYS  80          2HD       LYS  80   0.894  -7.906   9.533
  620   1HE   LYS  80          1HE       LYS  80  -1.167  -7.790   8.199
  621   2HE   LYS  80          2HE       LYS  80  -0.364  -8.679   6.904
  622   1HZ   LYS  80          1HZ       LYS  80  -0.601  -9.761   9.654
  623   2HZ   LYS  80          2HZ       LYS  80  -1.801 -10.007   8.477
  624   3HZ   LYS  80          3HZ       LYS  80  -0.231 -10.597   8.219
  625    H    MET  81           H        MET  81   2.764  -2.216   8.551
  626    HA   MET  81           HA       MET  81   5.141  -2.022  10.104
  627   1HB   MET  81          1HB       MET  81   4.029  -0.145   8.795
  628   2HB   MET  81          2HB       MET  81   2.832  -0.072  10.081
  629   1HG   MET  81          1HG       MET  81   4.675   0.369  11.686
  630   2HG   MET  81          2HG       MET  81   5.786   0.445  10.321
  631   1HE   MET  81          1HE       MET  81   5.452   2.259   8.295
  632   2HE   MET  81          2HE       MET  81   4.217   3.516   8.338
  633   3HE   MET  81          3HE       MET  81   3.747   1.825   8.171
  634    H    GLU  82           H        GLU  82   5.176  -1.380  12.398
  635    HA   GLU  82           HA       GLU  82   3.968  -3.161  14.094
  636   1HB   GLU  82          1HB       GLU  82   4.563  -1.574  15.923
  637   2HB   GLU  82          2HB       GLU  82   5.877  -1.906  14.803
  638   1HG   GLU  82          1HG       GLU  82   5.390   0.222  13.655
  639   2HG   GLU  82          2HG       GLU  82   4.152   0.559  14.865
  640    H    GLY  83           H        GLY  83   2.066  -3.388  15.055
  641   1HA   GLY  83          1HA       GLY  83   0.117  -2.344  16.122
  642   2HA   GLY  83          2HA       GLY  83   0.124  -1.177  14.806
  643    H    CYS  84           H        CYS  84   0.861  -3.506  12.989
  644    HA   CYS  84           HA       CYS  84  -1.886  -4.412  12.536
  645   1HB   CYS  84          1HB       CYS  84   0.510  -4.749  10.723
  646   2HB   CYS  84          2HB       CYS  84  -1.188  -4.930  10.294
  647    HG   CYS  84           HG       CYS  84   0.648  -2.116  10.651
  648    H    ASN  85           H        ASN  85  -2.428  -6.590  12.496
  649    HA   ASN  85           HA       ASN  85  -0.422  -8.429  13.582
  650   1HB   ASN  85          1HB       ASN  85  -2.691  -8.243  14.664
  651   2HB   ASN  85          2HB       ASN  85  -3.387  -8.906  13.191
  652   1HD2  ASN  85          2HD2      ASN  85  -3.457  -9.962  15.880
  653   2HD2  ASN  85          1HD2      ASN  85  -2.744 -11.534  15.812