*HEADER    MEMBRANE PROTEIN                        15-DEC-06   2JN0              
*TITLE     SOLUTION NMR STRUCTURE OF THE YGDR PROTEIN FROM ESCHERICHIA           
*TITLE    2 COLI. NORTHEAST STRUCTURAL GENOMICS TARGET ER382A.                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL LIPOPROTEIN YGDR;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: HYPOTHETICAL LIPOPROTEIN YGDR, RESIDUES 2-53;              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: YGDR;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+ MAGIC;                          
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: ER382A-21.2                                
*KEYWDS    SOLUTION NMR STRUCTURE, HYPOTHETICAL LIPOPROTEIN, PSI-2               
*KEYWDS   2 TARGET, STRUCTURAL GENOMICS, PROTEIN STRUCTURE INITIATIVE,           
*KEYWDS   3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG                       
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    P.ROSSI, C.X.CHEN, M.JIANG, K.CUNNINGHAM, L.MA, R.XIAO,               
*AUTHOR   2 J.C.LIU, M.BARAN, G.V.T.SWAPNA, T.B.ACTON, B.ROST,                   
*AUTHOR   3 G.T.MONTELIONE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM             
*AUTHOR   4 (NESG)                                                               
*REVDAT   1   01-MAY-07 2JN0    0                                                


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 assign (segid  A and resid   6 and name HA   ) (segid  A and resid   7 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HB   ) (segid  A and resid   7 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HB   ) (segid  A and resid  16 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid   7 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid   8 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid  14 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid  15 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid  15 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HG## ) (segid  A and resid  50 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HN   ) (segid  A and resid  15 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid   7 and name HN   ) (segid  A and resid  17 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HA   ) (segid  A and resid   8 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid   7 and name HA   ) (segid  A and resid  50 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HA   ) (segid  A and resid  50 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HA   ) (segid  A and resid  50 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HB#  ) (segid  A and resid  15 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HB#  ) (segid  A and resid  15 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HB#  ) (segid  A and resid  50 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HB#  ) (segid  A and resid  50 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HG#  ) (segid  A and resid   8 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HG#  ) (segid  A and resid  15 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HG#  ) (segid  A and resid  15 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HG2  ) (segid  A and resid  17 and name HG2# )  4.00  2.20  1.00
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 assign (segid  A and resid   7 and name HG#  ) (segid  A and resid  50 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HG#  ) (segid  A and resid  50 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  15 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  15 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  15 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  32 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  32 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  32 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   7 and name HE#  ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HN   ) (segid  A and resid  49 and name HN   )  3.50  1.70  0.50
 assign (segid  A and resid   8 and name HN   ) (segid  A and resid  50 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HA   ) (segid  A and resid   9 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HA   ) (segid  A and resid   9 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HA   ) (segid  A and resid  14 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HA   ) (segid  A and resid  14 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HA   ) (segid  A and resid  15 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HB#  ) (segid  A and resid  14 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HB#  ) (segid  A and resid  48 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HB#  ) (segid  A and resid  49 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   8 and name HB#  ) (segid  A and resid  50 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HN   ) (segid  A and resid  13 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HN   ) (segid  A and resid  14 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  10 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  47 and name HA   )  3.00  1.20  0.50
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  47 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  47 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  48 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HA   ) (segid  A and resid  48 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  10 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  12 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  13 and name HG2  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  13 and name HG1  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  47 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  48 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HB   ) (segid  A and resid  48 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  13 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  15 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  15 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  15 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  46 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  47 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  47 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid   9 and name HG2# ) (segid  A and resid  47 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HN   ) (segid  A and resid  12 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  11 and name HN   ) (segid  A and resid  48 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HA   ) (segid  A and resid  12 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HB#  ) (segid  A and resid  13 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HB#  ) (segid  A and resid  13 and name HG2  )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HB#  ) (segid  A and resid  13 and name HG1  )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HB#  ) (segid  A and resid  13 and name HD2  )  4.00  2.20  1.00
 assign (segid  A and resid  11 and name HB#  ) (segid  A and resid  13 and name HD1  )  4.00  2.20  1.00
 assign (segid  A and resid  12 and name HN   ) (segid  A and resid  13 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  12 and name HA2  ) (segid  A and resid  13 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  12 and name HA1  ) (segid  A and resid  13 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HN   ) (segid  A and resid  14 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HA   ) (segid  A and resid  14 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  13 and name HB2  ) (segid  A and resid  14 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HB1  ) (segid  A and resid  14 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HB#  ) (segid  A and resid  15 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HB#  ) (segid  A and resid  15 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HG2  ) (segid  A and resid  14 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HG1  ) (segid  A and resid  14 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HG#  ) (segid  A and resid  15 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HD#  ) (segid  A and resid  15 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HD2  ) (segid  A and resid  15 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  13 and name HD1  ) (segid  A and resid  15 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  14 and name HA   ) (segid  A and resid  15 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  14 and name HB#  ) (segid  A and resid  15 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  14 and name HB#  ) (segid  A and resid  16 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  14 and name HG#  ) (segid  A and resid  16 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HN   ) (segid  A and resid  16 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HA   ) (segid  A and resid  16 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  15 and name HA   ) (segid  A and resid  16 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HB   ) (segid  A and resid  17 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG1# ) (segid  A and resid  16 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  16 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  16 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  17 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  17 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  32 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HG2# ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  15 and name HD1# ) (segid  A and resid  32 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HA   ) (segid  A and resid  17 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HB#  ) (segid  A and resid  35 and name HG2  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HB#  ) (segid  A and resid  35 and name HG1  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HB#  ) (segid  A and resid  35 and name HE21 )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HB#  ) (segid  A and resid  35 and name HE22 )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HD## ) (segid  A and resid  35 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HD1# ) (segid  A and resid  35 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HD2# ) (segid  A and resid  35 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HD## ) (segid  A and resid  35 and name HE21 )  4.00  2.20  1.00
 assign (segid  A and resid  16 and name HD## ) (segid  A and resid  35 and name HE22 )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HA   ) (segid  A and resid  18 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  17 and name HA   ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HA   ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HA   ) (segid  A and resid  34 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HB   ) (segid  A and resid  18 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HB   ) (segid  A and resid  20 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HB   ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HB   ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HB   ) (segid  A and resid  33 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HG2# ) (segid  A and resid  32 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HG2# ) (segid  A and resid  32 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HG2# ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HG2# ) (segid  A and resid  33 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  17 and name HG2# ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HA   ) (segid  A and resid  22 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  21 and name HA   ) (segid  A and resid  30 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HA   ) (segid  A and resid  32 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HA   ) (segid  A and resid  32 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HA   ) (segid  A and resid  32 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HB1  ) (segid  A and resid  22 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HB2  ) (segid  A and resid  30 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HB1  ) (segid  A and resid  30 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HB#  ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HG#  ) (segid  A and resid  30 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HG#  ) (segid  A and resid  30 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HG#  ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HG#  ) (segid  A and resid  50 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HG#  ) (segid  A and resid  50 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  21 and name HD#  ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HN   ) (segid  A and resid  30 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HN   ) (segid  A and resid  30 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HN   ) (segid  A and resid  31 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HN   ) (segid  A and resid  31 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HN   ) (segid  A and resid  32 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HA   ) (segid  A and resid  23 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  22 and name HA   ) (segid  A and resid  23 and name HG12 )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HA   ) (segid  A and resid  23 and name HG11 )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB#  ) (segid  A and resid  23 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB2  ) (segid  A and resid  31 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB1  ) (segid  A and resid  31 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB2  ) (segid  A and resid  31 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB2  ) (segid  A and resid  31 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB1  ) (segid  A and resid  31 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  22 and name HB1  ) (segid  A and resid  31 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HN   ) (segid  A and resid  24 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  24 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  24 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  30 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  30 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  30 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HA   ) (segid  A and resid  31 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HB   ) (segid  A and resid  24 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG1# ) (segid  A and resid  30 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG12 ) (segid  A and resid  30 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG12 ) (segid  A and resid  30 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG11 ) (segid  A and resid  30 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG11 ) (segid  A and resid  30 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG12 ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG11 ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  24 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  24 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  25 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  25 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  25 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  30 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  30 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  44 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  44 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HG2# ) (segid  A and resid  44 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  23 and name HD1# ) (segid  A and resid  44 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HN   ) (segid  A and resid  25 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HN   ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HN   ) (segid  A and resid  30 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HN   ) (segid  A and resid  30 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HN   ) (segid  A and resid  31 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HA   ) (segid  A and resid  25 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  24 and name HA   ) (segid  A and resid  25 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HA   ) (segid  A and resid  26 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB#  ) (segid  A and resid  25 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB#  ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB2  ) (segid  A and resid  27 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB1  ) (segid  A and resid  27 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB#  ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB2  ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB1  ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB2  ) (segid  A and resid  29 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB1  ) (segid  A and resid  29 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  24 and name HB#  ) (segid  A and resid  29 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HN   ) (segid  A and resid  26 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  25 and name HN   ) (segid  A and resid  26 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HN   ) (segid  A and resid  26 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HN   ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HA   ) (segid  A and resid  26 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HA   ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HA   ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HA   ) (segid  A and resid  28 and name HA#  )  4.00  2.20  1.00
 assign (segid  A and resid  25 and name HB#  ) (segid  A and resid  26 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HN   ) (segid  A and resid  27 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  26 and name HN   ) (segid  A and resid  27 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HN   ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HA   ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HA   ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HB2  ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HB1  ) (segid  A and resid  27 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HB2  ) (segid  A and resid  27 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  26 and name HB1  ) (segid  A and resid  27 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HN   ) (segid  A and resid  28 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  27 and name HN   ) (segid  A and resid  28 and name HA2  )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HN   ) (segid  A and resid  28 and name HA1  )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HA   ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HB   ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HB   ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HB   ) (segid  A and resid  29 and name HG   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HB   ) (segid  A and resid  29 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HB   ) (segid  A and resid  29 and name HD2# )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HG2# ) (segid  A and resid  28 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HG2# ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  27 and name HG2# ) (segid  A and resid  29 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HN   ) (segid  A and resid  29 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  28 and name HN   ) (segid  A and resid  29 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HN   ) (segid  A and resid  29 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA2  ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA1  ) (segid  A and resid  29 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA#  ) (segid  A and resid  29 and name HD## )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA#  ) (segid  A and resid  44 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA#  ) (segid  A and resid  44 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  28 and name HA#  ) (segid  A and resid  44 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HN   ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HA   ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HA   ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HA   ) (segid  A and resid  44 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  29 and name HA   ) (segid  A and resid  44 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HB2  ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HB1  ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HB#  ) (segid  A and resid  41 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD1# ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD2# ) (segid  A and resid  30 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD1# ) (segid  A and resid  41 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD2# ) (segid  A and resid  41 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  41 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  41 and name HE21 )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  41 and name HE22 )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  43 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  43 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  43 and name HD21 )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  43 and name HD22 )  4.00  2.20  1.00
 assign (segid  A and resid  29 and name HD## ) (segid  A and resid  44 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HN   ) (segid  A and resid  41 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HN   ) (segid  A and resid  42 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  30 and name HN   ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HN   ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HN   ) (segid  A and resid  43 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HA   ) (segid  A and resid  31 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  30 and name HB   ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HB   ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HB   ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG1# ) (segid  A and resid  32 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG## ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG1# ) (segid  A and resid  42 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  42 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG1# ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  44 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  44 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  44 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG1# ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  30 and name HG2# ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HN   ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  32 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  32 and name HD#  )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  41 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  41 and name HG2  )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  41 and name HG1  )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HA   ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB2  ) (segid  A and resid  32 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB1  ) (segid  A and resid  32 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB2  ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB1  ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB2  ) (segid  A and resid  41 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  31 and name HB1  ) (segid  A and resid  41 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  40 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  40 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  41 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HN   ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HA   ) (segid  A and resid  33 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  32 and name HA   ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HB#  ) (segid  A and resid  33 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HD#  ) (segid  A and resid  33 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HD#  ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HD#  ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HD#  ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HD#  ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  40 and name HG2  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  40 and name HG1  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  42 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  42 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  32 and name HE#  ) (segid  A and resid  42 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HN   ) (segid  A and resid  34 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  34 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  39 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  39 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  39 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HA   ) (segid  A and resid  40 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HB2  ) (segid  A and resid  34 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HB1  ) (segid  A and resid  34 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HB#  ) (segid  A and resid  37 and name HA#  )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HB#  ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HD2  ) (segid  A and resid  39 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HD2  ) (segid  A and resid  39 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  33 and name HD2  ) (segid  A and resid  39 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HN   ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HN   ) (segid  A and resid  38 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  34 and name HN   ) (segid  A and resid  38 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HN   ) (segid  A and resid  39 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HN   ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HA   ) (segid  A and resid  35 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  34 and name HA   ) (segid  A and resid  35 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HA   ) (segid  A and resid  35 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HA   ) (segid  A and resid  36 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  34 and name HA   ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  35 and name HN   ) (segid  A and resid  36 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  35 and name HN   ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  35 and name HA   ) (segid  A and resid  36 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  35 and name HA   ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  35 and name HB#  ) (segid  A and resid  36 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HN   ) (segid  A and resid  37 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  36 and name HN   ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HN   ) (segid  A and resid  38 and name HD2# )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HA   ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HA   ) (segid  A and resid  37 and name HA#  )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HA   ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB2  ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB1  ) (segid  A and resid  37 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB2  ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB1  ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB2  ) (segid  A and resid  38 and name HD21 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB2  ) (segid  A and resid  38 and name HD22 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB1  ) (segid  A and resid  38 and name HD21 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HB1  ) (segid  A and resid  38 and name HD22 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HG2  ) (segid  A and resid  38 and name HD21 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HG2  ) (segid  A and resid  38 and name HD22 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HG1  ) (segid  A and resid  38 and name HD21 )  4.00  2.20  1.00
 assign (segid  A and resid  36 and name HG1  ) (segid  A and resid  38 and name HD22 )  4.00  2.20  1.00
 assign (segid  A and resid  37 and name HN   ) (segid  A and resid  38 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  37 and name HA2  ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  37 and name HA1  ) (segid  A and resid  38 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  37 and name HA#  ) (segid  A and resid  38 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HA   ) (segid  A and resid  39 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  38 and name HA   ) (segid  A and resid  39 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HA   ) (segid  A and resid  39 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB2  ) (segid  A and resid  39 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB1  ) (segid  A and resid  39 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB2  ) (segid  A and resid  40 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB1  ) (segid  A and resid  40 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB2  ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HB1  ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HD21 ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  38 and name HD22 ) (segid  A and resid  40 and name HE#  )  4.00  2.20  1.00
 assign (segid  A and resid  39 and name HN   ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  39 and name HA   ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  39 and name HA   ) (segid  A and resid  40 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  39 and name HA   ) (segid  A and resid  40 and name HG#  )  4.00  2.20  1.00
 assign (segid  A and resid  39 and name HB#  ) (segid  A and resid  40 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HN   ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HA   ) (segid  A and resid  41 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  40 and name HA   ) (segid  A and resid  41 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HA   ) (segid  A and resid  41 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HB2  ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HB1  ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HG2  ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HG1  ) (segid  A and resid  41 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  40 and name HE#  ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  41 and name HN   ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  41 and name HA   ) (segid  A and resid  42 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  41 and name HA   ) (segid  A and resid  42 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  41 and name HA   ) (segid  A and resid  42 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  41 and name HB#  ) (segid  A and resid  42 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  41 and name HB#  ) (segid  A and resid  42 and name HA   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HN   ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HA   ) (segid  A and resid  43 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  42 and name HA   ) (segid  A and resid  43 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HB   ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG12 ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG11 ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG12 ) (segid  A and resid  46 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG11 ) (segid  A and resid  46 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG12 ) (segid  A and resid  47 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG12 ) (segid  A and resid  47 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG11 ) (segid  A and resid  47 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG11 ) (segid  A and resid  47 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG2# ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HG2# ) (segid  A and resid  46 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  43 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  43 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  43 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  46 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  46 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  42 and name HD1# ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  43 and name HA   ) (segid  A and resid  44 and name HN   )  3.00  1.20  0.50
 assign (segid  A and resid  43 and name HB2  ) (segid  A and resid  44 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  43 and name HB1  ) (segid  A and resid  44 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  43 and name HB#  ) (segid  A and resid  45 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  43 and name HD2# ) (segid  A and resid  45 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HN   ) (segid  A and resid  45 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HA   ) (segid  A and resid  47 and name HB   )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HA   ) (segid  A and resid  47 and name HG1# )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HA   ) (segid  A and resid  47 and name HG2# )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HB#  ) (segid  A and resid  45 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HB#  ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HB#  ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  44 and name HG#  ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  45 and name HN   ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  45 and name HA   ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  45 and name HB2  ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  45 and name HB1  ) (segid  A and resid  46 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  46 and name HN   ) (segid  A and resid  47 and name HN   )  2.50  0.70  0.40
 assign (segid  A and resid  46 and name HN   ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  46 and name HA   ) (segid  A and resid  47 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  46 and name HA   ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  46 and name HB#  ) (segid  A and resid  47 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  46 and name HB#  ) (segid  A and resid  47 and name HG## )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HA   ) (segid  A and resid  48 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HA   ) (segid  A and resid  48 and name HB#  )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG1# ) (segid  A and resid  48 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG2# ) (segid  A and resid  48 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG## ) (segid  A and resid  48 and name HB2  )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG## ) (segid  A and resid  48 and name HB1  )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG## ) (segid  A and resid  49 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG1# ) (segid  A and resid  50 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  47 and name HG2# ) (segid  A and resid  50 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid  48 and name HN   ) (segid  A and resid  49 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  48 and name HB2  ) (segid  A and resid  49 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  48 and name HB1  ) (segid  A and resid  49 and name HN   )  4.00  2.20  1.00
 assign (segid  A and resid  51 and name HA   ) (segid  A and resid  51 and name HD1# )  4.00  2.20  1.00
 assign (segid  A and resid   6 and name HN   ) (segid  A and resid  17 and name HG1  )  3.00  1.20  0.50
 assign (segid  A and resid  50 and name HA   ) (segid  A and resid   7 and name HA   )  4.00  2.20  1.00
!  -- Angle constraint file built by HYPER -- X-Plor | Cns format 
!  -- from data in file  ER382A.hyp
!  -- Version: 3.2 2002/04/18[Linux] (Compiled on: troberto.quifis.uv.es) 
assign (segid    A and resid   6 and name C   ) (segid    A and resid   7 and name N   )
       (segid    A and resid   7 and name CA  ) (segid    A and resid   7 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid   7 and name N   ) (segid    A and resid   7 and name CA  )
       (segid    A and resid   7 and name C   ) (segid    A and resid   8 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid   7 and name C   ) (segid    A and resid   8 and name N   )
       (segid    A and resid   8 and name CA  ) (segid    A and resid   8 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid   8 and name N   ) (segid    A and resid   8 and name CA  )
       (segid    A and resid   8 and name C   ) (segid    A and resid   9 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid   8 and name C   ) (segid    A and resid   9 and name N   )
       (segid    A and resid   9 and name CA  ) (segid    A and resid   9 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid   9 and name N   ) (segid    A and resid   9 and name CA  )
       (segid    A and resid   9 and name C   ) (segid    A and resid  10 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  10 and name N   ) (segid    A and resid  10 and name CA  )
       (segid    A and resid  10 and name CB  ) (segid    A and resid  10 and name CG  )  1    180.00     10.00   2
assign (segid    A and resid  10 and name CA  ) (segid    A and resid  10 and name CB  )
       (segid    A and resid  10 and name CG  ) (segid    A and resid  10 and name CD  )  1    160.00     10.00   2
assign (segid    A and resid  10 and name CB  ) (segid    A and resid  10 and name CG  )
       (segid    A and resid  10 and name CD  ) (segid    A and resid  10 and name CE  )  1     50.00     10.00   2
assign (segid    A and resid  19 and name N   ) (segid    A and resid  20 and name CA  )
       (segid    A and resid  20 and name C   ) (segid    A and resid  20 and name N   )  1    110.00     50.00   2
assign (segid    A and resid  20 and name C   ) (segid    A and resid  20 and name N   )
       (segid    A and resid  20 and name CA  ) (segid    A and resid  20 and name C   )  1    120.00     50.00   2
assign (segid    A and resid  34 and name N   ) (segid    A and resid  34 and name CA  )
       (segid    A and resid  34 and name CB  ) (segid    A and resid  34 and name CG  )  1    280.00     30.00   2
assign (segid    A and resid  34 and name CA  ) (segid    A and resid  34 and name CB  )
       (segid    A and resid  34 and name CG  ) (segid    A and resid  34 and name OD1 )  1    165.00     30.00   2
assign (segid    A and resid  12 and name C   ) (segid    A and resid  13 and name N   )
       (segid    A and resid  13 and name CA  ) (segid    A and resid  13 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  13 and name N   ) (segid    A and resid  13 and name CA  )
       (segid    A and resid  13 and name C   ) (segid    A and resid  14 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  13 and name C   ) (segid    A and resid  14 and name N   )
       (segid    A and resid  14 and name CA  ) (segid    A and resid  14 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  14 and name N   ) (segid    A and resid  14 and name CA  )
       (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )
       (segid    A and resid  15 and name CA  ) (segid    A and resid  15 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  15 and name N   ) (segid    A and resid  15 and name CA  )
       (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )
       (segid    A and resid  16 and name CA  ) (segid    A and resid  16 and name C   )  1   -125.00     55.00   2
assign (segid    A and resid  16 and name N   ) (segid    A and resid  16 and name CA  )
       (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )  1    120.00     60.00   2
assign (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )
       (segid    A and resid  17 and name CA  ) (segid    A and resid  17 and name C   )  1   -125.00     55.00   2
assign (segid    A and resid  17 and name N   ) (segid    A and resid  17 and name CA  )
       (segid    A and resid  17 and name C   ) (segid    A and resid  18 and name N   )  1    120.00     60.00   2
assign (segid    A and resid  21 and name C   ) (segid    A and resid  22 and name N   )
       (segid    A and resid  22 and name CA  ) (segid    A and resid  22 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  22 and name N   ) (segid    A and resid  22 and name CA  )
       (segid    A and resid  22 and name C   ) (segid    A and resid  23 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  22 and name C   ) (segid    A and resid  23 and name N   )
       (segid    A and resid  23 and name CA  ) (segid    A and resid  23 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  23 and name N   ) (segid    A and resid  23 and name CA  )
       (segid    A and resid  23 and name C   ) (segid    A and resid  24 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  23 and name C   ) (segid    A and resid  24 and name N   )
       (segid    A and resid  24 and name CA  ) (segid    A and resid  24 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  24 and name N   ) (segid    A and resid  24 and name CA  )
       (segid    A and resid  24 and name C   ) (segid    A and resid  25 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  28 and name C   ) (segid    A and resid  29 and name N   )
       (segid    A and resid  29 and name CA  ) (segid    A and resid  29 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  29 and name N   ) (segid    A and resid  29 and name CA  )
       (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )
       (segid    A and resid  30 and name CA  ) (segid    A and resid  30 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  30 and name N   ) (segid    A and resid  30 and name CA  )
       (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )
       (segid    A and resid  31 and name CA  ) (segid    A and resid  31 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  31 and name N   ) (segid    A and resid  31 and name CA  )
       (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )
       (segid    A and resid  32 and name CA  ) (segid    A and resid  32 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  32 and name N   ) (segid    A and resid  32 and name CA  )
       (segid    A and resid  32 and name C   ) (segid    A and resid  33 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  39 and name C   ) (segid    A and resid  40 and name N   )
       (segid    A and resid  40 and name CA  ) (segid    A and resid  40 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  40 and name N   ) (segid    A and resid  40 and name CA  )
       (segid    A and resid  40 and name C   ) (segid    A and resid  41 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  40 and name C   ) (segid    A and resid  41 and name N   )
       (segid    A and resid  41 and name CA  ) (segid    A and resid  41 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  41 and name N   ) (segid    A and resid  41 and name CA  )
       (segid    A and resid  41 and name C   ) (segid    A and resid  42 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  41 and name C   ) (segid    A and resid  42 and name N   )
       (segid    A and resid  42 and name CA  ) (segid    A and resid  42 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  42 and name N   ) (segid    A and resid  42 and name CA  )
       (segid    A and resid  42 and name C   ) (segid    A and resid  43 and name N   )  1    120.00     60.00   2 
! created by  NOESY_Assign Version 2.1.1 Copyright(C) 2005

assign (resid 7    and name O     )(resid 15   and name N     )    2.80  0.4  0.5
assign (resid 7    and name O     )(resid 15   and name HN    )     1.8  0.3  0.5
assign (resid 13   and name O     )(resid 9    and name N     )    2.80  0.4  0.5
assign (resid 13   and name O     )(resid 9    and name HN    )     1.8  0.3  0.5
assign (resid 15   and name O     )(resid 7    and name N     )    2.80  0.4  0.5
assign (resid 15   and name O     )(resid 7    and name HN    )     1.8  0.3  0.5
assign (resid 22   and name O     )(resid 31   and name N     )    2.80  0.4  0.5
assign (resid 22   and name O     )(resid 31   and name HN    )     1.8  0.3  0.5
assign (resid 29   and name O     )(resid 24   and name N     )    2.80  0.4  0.5
assign (resid 29   and name O     )(resid 24   and name HN    )     1.8  0.3  0.5
assign (resid 30   and name O     )(resid 42   and name N     )    2.80  0.4  0.5
assign (resid 30   and name O     )(resid 42   and name HN    )     1.8  0.3  0.5
assign (resid 31   and name O     )(resid 22   and name N     )    2.80  0.4  0.5
assign (resid 31   and name O     )(resid 22   and name HN    )     1.8  0.3  0.5
assign (resid 32   and name O     )(resid 40   and name N     )    2.80  0.4  0.5
assign (resid 32   and name O     )(resid 40   and name HN    )     1.8  0.3  0.5
assign (resid 40   and name O     )(resid 32   and name N     )    2.80  0.4  0.5
assign (resid 40   and name O     )(resid 32   and name HN    )     1.8  0.3  0.5
assign (resid 42   and name O     )(resid 30   and name N     )    2.80  0.4  0.5
assign (resid 42   and name O     )(resid 30   and name HN    )     1.8  0.3  0.5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ASP   4           H        ASP   4   6.729  -1.903   9.094
    2    HA   ASP   4           HA       ASP   4   5.522  -1.636  11.687
    3   1HB   ASP   4          2HB       ASP   4   7.040   0.054  10.332
    4   2HB   ASP   4          1HB       ASP   4   5.483   0.599   9.708
    5    H    TYR   5           H        TYR   5   3.554   0.200  11.472
    6    HA   TYR   5           HA       TYR   5   1.465  -1.433  10.166
    7   1HB   TYR   5          2HB       TYR   5   1.147   0.059  12.772
    8   2HB   TYR   5          1HB       TYR   5   0.063  -1.144  12.077
    9    HD1  TYR   5           HD1      TYR   5   0.958  -3.541  11.845
   10    HD2  TYR   5           HD2      TYR   5   2.829  -0.581  14.261
   11    HE1  TYR   5           HE1      TYR   5   2.135  -5.305  13.095
   12    HE2  TYR   5           HE2      TYR   5   4.006  -2.334  15.514
   13    HH   TYR   5           HH       TYR   5   3.728  -4.708  16.038
   14    H    VAL   6           H        VAL   6   2.921   1.320   9.670
   15    HA   VAL   6           HA       VAL   6   0.424   2.639   8.882
   16    HB   VAL   6           HB       VAL   6   1.644   4.862   9.172
   17   1HG1  VAL   6          1HG1      VAL   6  -0.226   4.171  10.558
   18   2HG1  VAL   6          2HG1      VAL   6   0.981   5.024  11.523
   19   3HG1  VAL   6          3HG1      VAL   6   0.868   3.266  11.606
   20   1HG2  VAL   6          1HG2      VAL   6   3.359   3.156  10.974
   21   2HG2  VAL   6          2HG2      VAL   6   3.364   4.918  10.921
   22   3HG2  VAL   6          3HG2      VAL   6   3.892   3.993   9.515
   23    H    MET   7           H        MET   7   0.309   3.327   6.873
   24    HA   MET   7           HA       MET   7   2.746   3.146   5.229
   25   1HB   MET   7          2HB       MET   7   1.062   1.488   4.620
   26   2HB   MET   7          1HB       MET   7  -0.152   2.747   4.454
   27   1HG   MET   7          2HG       MET   7   0.993   3.674   2.558
   28   2HG   MET   7          1HG       MET   7   2.329   2.543   2.767
   29   1HE   MET   7          1HE       MET   7  -1.465   2.937   1.805
   30   2HE   MET   7          2HE       MET   7  -1.515   1.812   3.164
   31   3HE   MET   7          3HE       MET   7  -1.934   1.257   1.543
   32    H    ALA   8           H        ALA   8   3.496   5.210   5.249
   33    HA   ALA   8           HA       ALA   8   1.740   7.439   4.700
   34   1HB   ALA   8          1HB       ALA   8   3.806   8.771   4.630
   35   2HB   ALA   8          2HB       ALA   8   4.760   7.294   4.756
   36   3HB   ALA   8          3HB       ALA   8   3.721   7.789   6.092
   37    H    THR   9           H        THR   9   1.156   8.091   2.720
   38    HA   THR   9           HA       THR   9   2.316   6.565   0.499
   39    HB   THR   9           HB       THR   9   0.186   7.183  -0.695
   40    HG1  THR   9           HG1      THR   9  -0.770   7.786   1.914
   41   1HG2  THR   9          1HG2      THR   9  -1.150   5.482   0.462
   42   2HG2  THR   9          2HG2      THR   9  -0.063   5.572   1.848
   43   3HG2  THR   9          3HG2      THR   9   0.532   4.972   0.299
   44    H    LYS  10           H        LYS  10   1.743   7.726  -1.655
   45    HA   LYS  10           HA       LYS  10   3.583   9.663  -2.198
   46   1HB   LYS  10          2HB       LYS  10   2.350   8.243  -3.819
   47   2HB   LYS  10          1HB       LYS  10   0.928   9.245  -3.580
   48   1HG   LYS  10          2HG       LYS  10   2.019  11.132  -4.576
   49   2HG   LYS  10          1HG       LYS  10   3.550  10.251  -4.664
   50   1HD   LYS  10          2HD       LYS  10   2.417  10.251  -6.833
   51   2HD   LYS  10          1HD       LYS  10   2.520   8.615  -6.172
   52   1HE   LYS  10          2HE       LYS  10   0.188   9.011  -5.235
   53   2HE   LYS  10          1HE       LYS  10   0.129  10.441  -6.263
   54   1HZ   LYS  10          1HZ       LYS  10   0.545   8.971  -8.183
   55   2HZ   LYS  10          2HZ       LYS  10  -0.908   8.623  -7.380
   56   3HZ   LYS  10          3HZ       LYS  10   0.440   7.623  -7.150
   57    H    ASP  11           H        ASP  11   0.181  10.148  -1.356
   58    HA   ASP  11           HA       ASP  11   0.281  12.976  -1.821
   59   1HB   ASP  11          2HB       ASP  11  -1.819  11.194  -0.587
   60   2HB   ASP  11          1HB       ASP  11  -2.022  12.931  -0.793
   61    H    GLY  12           H        GLY  12   1.512  11.147   0.609
   62   1HA   GLY  12          2HA       GLY  12   2.580  11.968   2.512
   63   2HA   GLY  12          1HA       GLY  12   1.662  13.458   2.361
   64    H    ARG  13           H        ARG  13  -0.648  11.247   2.040
   65    HA   ARG  13           HA       ARG  13  -1.564  11.597   4.730
   66   1HB   ARG  13          2HB       ARG  13  -3.519  10.234   4.009
   67   2HB   ARG  13          1HB       ARG  13  -3.209  11.614   2.964
   68   1HG   ARG  13          2HG       ARG  13  -2.141  10.152   1.342
   69   2HG   ARG  13          1HG       ARG  13  -2.426   8.766   2.389
   70   1HD   ARG  13          2HD       ARG  13  -4.087   8.917   0.588
   71   2HD   ARG  13          1HD       ARG  13  -4.820   9.056   2.185
   72    HE   ARG  13           HE       ARG  13  -4.987  11.459   1.794
   73   1HH1  ARG  13          1HH1      ARG  13  -4.441   9.411  -0.999
   74   2HH1  ARG  13          2HH1      ARG  13  -5.114  10.549  -2.126
   75   1HH2  ARG  13          1HH2      ARG  13  -5.850  12.964   0.315
   76   2HH2  ARG  13          2HH2      ARG  13  -5.933  12.565  -1.378
   77    H    MET  14           H        MET  14  -1.534  10.233   6.383
   78    HA   MET  14           HA       MET  14   0.068   7.813   6.108
   79   1HB   MET  14          2HB       MET  14   0.627   9.337   7.942
   80   2HB   MET  14          1HB       MET  14  -1.009   9.197   8.574
   81   1HG   MET  14          2HG       MET  14  -0.616   6.772   8.911
   82   2HG   MET  14          1HG       MET  14   1.056   7.013   8.410
   83   1HE   MET  14          1HE       MET  14   2.803   8.513   9.769
   84   2HE   MET  14          2HE       MET  14   2.382   9.400  11.234
   85   3HE   MET  14          3HE       MET  14   1.678   9.869   9.687
   86    H    ILE  15           H        ILE  15  -0.943   5.989   5.661
   87    HA   ILE  15           HA       ILE  15  -3.728   5.651   6.466
   88    HB   ILE  15           HB       ILE  15  -1.985   4.001   4.627
   89   1HG1  ILE  15          2HG1      ILE  15  -4.309   5.859   4.054
   90   2HG1  ILE  15          1HG1      ILE  15  -2.614   6.197   3.722
   91   1HG2  ILE  15          1HG2      ILE  15  -3.604   2.571   5.726
   92   2HG2  ILE  15          2HG2      ILE  15  -4.049   2.800   4.034
   93   3HG2  ILE  15          3HG2      ILE  15  -4.907   3.680   5.300
   94   1HD1  ILE  15          1HD1      ILE  15  -3.802   5.548   1.708
   95   2HD1  ILE  15          2HD1      ILE  15  -4.255   4.017   2.456
   96   3HD1  ILE  15          3HD1      ILE  15  -2.561   4.366   2.117
   97    H    LEU  16           H        LEU  16  -4.275   4.497   8.163
   98    HA   LEU  16           HA       LEU  16  -2.329   3.071   9.703
   99   1HB   LEU  16          2HB       LEU  16  -5.337   3.238   9.972
  100   2HB   LEU  16          1HB       LEU  16  -4.287   2.430  11.116
  101    HG   LEU  16           HG       LEU  16  -4.829   4.512  12.076
  102   1HD1  LEU  16          1HD1      LEU  16  -2.685   5.661  12.234
  103   2HD1  LEU  16          2HD1      LEU  16  -2.105   4.780  10.820
  104   3HD1  LEU  16          3HD1      LEU  16  -2.487   3.910  12.307
  105   1HD2  LEU  16          1HD2      LEU  16  -5.690   5.656  10.116
  106   2HD2  LEU  16          2HD2      LEU  16  -4.058   5.809   9.463
  107   3HD2  LEU  16          3HD2      LEU  16  -4.500   6.666  10.940
  108    H    THR  17           H        THR  17  -1.620   1.163   9.102
  109    HA   THR  17           HA       THR  17  -3.426  -0.621   7.613
  110    HB   THR  17           HB       THR  17  -1.163  -1.722   6.943
  111    HG1  THR  17           HG1      THR  17  -0.196   0.082   8.511
  112   1HG2  THR  17          1HG2      THR  17  -1.853   1.012   5.855
  113   2HG2  THR  17          2HG2      THR  17  -2.668  -0.485   5.413
  114   3HG2  THR  17          3HG2      THR  17  -0.965  -0.261   5.016
  115    H    ASP  18           H        ASP  18  -3.424  -2.842   8.092
  116    HA   ASP  18           HA       ASP  18  -2.710  -3.790  10.672
  117   1HB   ASP  18          2HB       ASP  18  -4.339  -5.044   9.462
  118   2HB   ASP  18          1HB       ASP  18  -3.324  -5.129   8.029
  119    H    GLY  19           H        GLY  19  -1.107  -3.261   7.719
  120   1HA   GLY  19          2HA       GLY  19   1.168  -2.681   7.592
  121   2HA   GLY  19          1HA       GLY  19   1.472  -3.640   9.036
  122    H    LYS  20           H        LYS  20   3.299  -4.231   7.269
  123    HA   LYS  20           HA       LYS  20   4.208  -6.234   6.642
  124   1HB   LYS  20          2HB       LYS  20   1.603  -7.484   7.517
  125   2HB   LYS  20          1HB       LYS  20   3.163  -8.279   7.360
  126   1HG   LYS  20          2HG       LYS  20   4.043  -6.840   9.167
  127   2HG   LYS  20          1HG       LYS  20   2.434  -6.144   9.355
  128   1HD   LYS  20          2HD       LYS  20   2.527  -7.784  11.010
  129   2HD   LYS  20          1HD       LYS  20   1.647  -8.567   9.695
  130   1HE   LYS  20          2HE       LYS  20   3.261 -10.113  10.562
  131   2HE   LYS  20          1HE       LYS  20   3.788  -9.594   8.961
  132   1HZ   LYS  20          1HZ       LYS  20   5.646  -9.595  10.458
  133   2HZ   LYS  20          2HZ       LYS  20   4.821  -8.608  11.570
  134   3HZ   LYS  20          3HZ       LYS  20   5.278  -7.988  10.064
  135    HA   PRO  21           HA       PRO  21   1.396  -6.065   2.909
  136   1HB   PRO  21          2HB       PRO  21   2.624  -4.290   1.345
  137   2HB   PRO  21          1HB       PRO  21   1.630  -3.777   2.714
  138   1HG   PRO  21          2HG       PRO  21   4.599  -3.899   2.468
  139   2HG   PRO  21          1HG       PRO  21   3.589  -2.712   3.311
  140   1HD   PRO  21          2HD       PRO  21   4.921  -4.875   4.494
  141   2HD   PRO  21          1HD       PRO  21   3.621  -3.920   5.233
  142    H    GLU  22           H        GLU  22   1.535  -7.119   0.995
  143    HA   GLU  22           HA       GLU  22   4.133  -8.302   0.288
  144   1HB   GLU  22          2HB       GLU  22   1.322  -9.299   0.143
  145   2HB   GLU  22          1HB       GLU  22   2.479  -9.877  -1.046
  146   1HG   GLU  22          2HG       GLU  22   2.736 -10.112   1.944
  147   2HG   GLU  22          1HG       GLU  22   2.318 -11.408   0.823
  148    H    ILE  23           H        ILE  23   5.060  -7.463  -1.451
  149    HA   ILE  23           HA       ILE  23   3.429  -5.969  -3.365
  150    HB   ILE  23           HB       ILE  23   6.443  -6.134  -3.144
  151   1HG1  ILE  23          2HG1      ILE  23   4.517  -3.981  -2.235
  152   2HG1  ILE  23          1HG1      ILE  23   5.476  -5.027  -1.193
  153   1HG2  ILE  23          1HG2      ILE  23   5.736  -5.617  -5.403
  154   2HG2  ILE  23          2HG2      ILE  23   6.428  -4.182  -4.648
  155   3HG2  ILE  23          3HG2      ILE  23   4.679  -4.337  -4.806
  156   1HD1  ILE  23          1HD1      ILE  23   6.441  -2.799  -1.359
  157   2HD1  ILE  23          2HD1      ILE  23   6.570  -2.977  -3.110
  158   3HD1  ILE  23          3HD1      ILE  23   7.521  -4.013  -2.045
  159    H    ASP  24           H        ASP  24   2.915  -6.772  -5.289
  160    HA   ASP  24           HA       ASP  24   4.196  -9.159  -6.317
  161   1HB   ASP  24          2HB       ASP  24   2.080  -7.330  -7.474
  162   2HB   ASP  24          1HB       ASP  24   2.734  -8.715  -8.339
  163    H    ASP  25           H        ASP  25   6.282  -8.766  -6.858
  164    HA   ASP  25           HA       ASP  25   7.101  -6.177  -7.787
  165   1HB   ASP  25          2HB       ASP  25   9.355  -7.030  -7.660
  166   2HB   ASP  25          1HB       ASP  25   8.470  -7.561  -6.234
  167    H    ASP  26           H        ASP  26   5.648  -8.594  -9.394
  168    HA   ASP  26           HA       ASP  26   7.282  -8.495 -11.788
  169   1HB   ASP  26          2HB       ASP  26   5.715 -10.064 -12.738
  170   2HB   ASP  26          1HB       ASP  26   6.086 -10.586 -11.098
  171    H    THR  27           H        THR  27   4.826  -6.680 -10.368
  172    HA   THR  27           HA       THR  27   4.461  -5.211 -12.877
  173    HB   THR  27           HB       THR  27   2.462  -6.542 -12.720
  174    HG1  THR  27           HG1      THR  27   2.304  -4.244 -13.290
  175   1HG2  THR  27          1HG2      THR  27   2.069  -5.378  -9.964
  176   2HG2  THR  27          2HG2      THR  27   2.514  -7.046 -10.327
  177   3HG2  THR  27          3HG2      THR  27   0.937  -6.428 -10.818
  178    H    GLY  28           H        GLY  28   4.346  -5.230  -9.361
  179   1HA   GLY  28          2HA       GLY  28   5.325  -3.412  -8.139
  180   2HA   GLY  28          1HA       GLY  28   4.826  -2.326  -9.428
  181    H    LEU  29           H        LEU  29   2.733  -4.781  -8.051
  182    HA   LEU  29           HA       LEU  29   1.060  -2.622  -6.975
  183   1HB   LEU  29          2HB       LEU  29   0.297  -5.497  -7.518
  184   2HB   LEU  29          1HB       LEU  29  -0.784  -4.218  -7.003
  185    HG   LEU  29           HG       LEU  29   0.607  -4.448  -9.668
  186   1HD1  LEU  29          1HD1      LEU  29  -2.308  -4.481  -8.905
  187   2HD1  LEU  29          2HD1      LEU  29  -1.350  -5.872  -9.414
  188   3HD1  LEU  29          3HD1      LEU  29  -1.668  -4.558 -10.547
  189   1HD2  LEU  29          1HD2      LEU  29  -0.548  -2.392 -10.285
  190   2HD2  LEU  29          2HD2      LEU  29   0.592  -2.124  -8.966
  191   3HD2  LEU  29          3HD2      LEU  29  -1.138  -2.222  -8.631
  192    H    VAL  30           H        VAL  30   0.628  -2.480  -4.839
  193    HA   VAL  30           HA       VAL  30   2.113  -4.368  -3.136
  194    HB   VAL  30           HB       VAL  30   1.278  -1.536  -2.502
  195   1HG1  VAL  30          1HG1      VAL  30   3.082  -3.446  -1.019
  196   2HG1  VAL  30          2HG1      VAL  30   1.483  -2.909  -0.506
  197   3HG1  VAL  30          3HG1      VAL  30   2.813  -1.755  -0.596
  198   1HG2  VAL  30          1HG2      VAL  30   3.709  -1.050  -2.734
  199   2HG2  VAL  30          2HG2      VAL  30   2.923  -1.497  -4.244
  200   3HG2  VAL  30          3HG2      VAL  30   3.926  -2.670  -3.391
  201    H    SER  31           H        SER  31   0.846  -5.836  -2.259
  202    HA   SER  31           HA       SER  31  -1.936  -5.295  -1.676
  203   1HB   SER  31          2HB       SER  31  -0.279  -7.761  -1.128
  204   2HB   SER  31          1HB       SER  31  -2.035  -7.656  -1.054
  205    HG   SER  31           HG       SER  31  -0.336  -7.780  -3.259
  206    H    TYR  32           H        TYR  32  -2.285  -4.063   0.079
  207    HA   TYR  32           HA       TYR  32  -0.768  -4.671   2.543
  208   1HB   TYR  32          2HB       TYR  32  -1.163  -2.420   3.264
  209   2HB   TYR  32          1HB       TYR  32  -0.610  -2.321   1.592
  210    HD1  TYR  32           HD2      TYR  32  -2.464  -2.136  -0.226
  211    HD2  TYR  32           HD1      TYR  32  -3.121  -1.374   3.906
  212    HE1  TYR  32           HE2      TYR  32  -4.493  -0.863  -0.785
  213    HE2  TYR  32           HE1      TYR  32  -5.139  -0.092   3.355
  214    HH   TYR  32           HH       TYR  32  -6.381   0.773   1.737
  215    H    HIS  33           H        HIS  33  -2.166  -4.054   4.567
  216    HA   HIS  33           HA       HIS  33  -4.937  -4.975   4.136
  217   1HB   HIS  33          2HB       HIS  33  -3.255  -5.383   6.625
  218   2HB   HIS  33          1HB       HIS  33  -4.909  -5.929   6.395
  219    HD1  HIS  33           HD1      HIS  33  -2.316  -7.684   7.047
  220    HD2  HIS  33           HD2      HIS  33  -4.260  -7.337   3.377
  221    HE1  HIS  33           HE1      HIS  33  -1.730  -9.772   5.759
  222    HE2  HIS  33           HE2      HIS  33  -2.863  -9.513   3.517
  223    H    ASP  34           H        ASP  34  -6.301  -3.337   4.431
  224    HA   ASP  34           HA       ASP  34  -5.598  -1.005   5.929
  225   1HB   ASP  34          2HB       ASP  34  -7.675  -1.722   4.102
  226   2HB   ASP  34          1HB       ASP  34  -8.407  -1.056   5.560
  227    H    GLN  35           H        GLN  35  -7.376  -0.149   7.475
  228    HA   GLN  35           HA       GLN  35  -7.074  -1.494   9.891
  229   1HB   GLN  35          2HB       GLN  35  -9.243   0.487   9.179
  230   2HB   GLN  35          1HB       GLN  35  -8.664   0.109  10.797
  231   1HG   GLN  35          2HG       GLN  35  -6.520   1.073  10.309
  232   2HG   GLN  35          1HG       GLN  35  -6.977   1.329   8.625
  233   1HE2  GLN  35          1HE2      GLN  35  -8.446   2.954   8.113
  234   2HE2  GLN  35          2HE2      GLN  35  -8.792   4.244   9.221
  235    H    GLN  36           H        GLN  36  -9.571  -1.747   7.472
  236    HA   GLN  36           HA       GLN  36 -11.458  -3.050   9.216
  237   1HB   GLN  36          2HB       GLN  36 -11.545  -2.877   6.200
  238   2HB   GLN  36          1HB       GLN  36 -12.885  -3.222   7.280
  239   1HG   GLN  36          2HG       GLN  36 -13.200  -1.008   6.616
  240   2HG   GLN  36          1HG       GLN  36 -12.511  -0.893   8.234
  241   1HE2  GLN  36          1HE2      GLN  36 -11.732   1.186   7.881
  242   2HE2  GLN  36          2HE2      GLN  36 -10.375   1.502   6.845
  243    H    GLY  37           H        GLY  37  -8.653  -4.092   7.964
  244   1HA   GLY  37          2HA       GLY  37  -7.797  -6.240   7.801
  245   2HA   GLY  37          1HA       GLY  37  -9.412  -6.870   8.108
  246    H    ASN  38           H        ASN  38  -8.537  -4.579   5.614
  247    HA   ASN  38           HA       ASN  38  -9.546  -6.477   3.619
  248   1HB   ASN  38          2HB       ASN  38  -9.272  -3.465   3.548
  249   2HB   ASN  38          1HB       ASN  38  -9.772  -4.435   2.168
  250   1HD2  ASN  38          1HD2      ASN  38 -11.180  -2.345   3.665
  251   2HD2  ASN  38          2HD2      ASN  38 -12.663  -3.073   4.197
  252    H    ALA  39           H        ALA  39  -8.192  -7.391   2.245
  253    HA   ALA  39           HA       ALA  39  -5.457  -6.392   2.040
  254   1HB   ALA  39          1HB       ALA  39  -5.809  -8.800   2.367
  255   2HB   ALA  39          2HB       ALA  39  -4.983  -8.461   0.845
  256   3HB   ALA  39          3HB       ALA  39  -6.699  -8.870   0.846
  257    H    MET  40           H        MET  40  -5.372  -4.671   0.736
  258    HA   MET  40           HA       MET  40  -6.577  -4.928  -1.937
  259   1HB   MET  40          2HB       MET  40  -6.394  -2.463  -0.190
  260   2HB   MET  40          1HB       MET  40  -6.838  -2.426  -1.894
  261   1HG   MET  40          2HG       MET  40  -8.747  -3.873  -1.418
  262   2HG   MET  40          1HG       MET  40  -8.314  -3.885   0.289
  263   1HE   MET  40          1HE       MET  40  -8.891  -2.018   1.962
  264   2HE   MET  40          2HE       MET  40  -9.161  -0.339   1.491
  265   3HE   MET  40          3HE       MET  40  -7.610  -1.110   1.158
  266    H    GLN  41           H        GLN  41  -5.480  -3.630  -3.610
  267    HA   GLN  41           HA       GLN  41  -2.574  -3.648  -3.087
  268   1HB   GLN  41          2HB       GLN  41  -4.146  -4.277  -5.590
  269   2HB   GLN  41          1HB       GLN  41  -2.399  -4.063  -5.572
  270   1HG   GLN  41          2HG       GLN  41  -2.112  -5.945  -4.137
  271   2HG   GLN  41          1HG       GLN  41  -3.851  -6.091  -3.890
  272   1HE2  GLN  41          1HE2      GLN  41  -3.795  -8.225  -4.603
  273   2HE2  GLN  41          2HE2      GLN  41  -3.628  -8.633  -6.274
  274    H    ILE  42           H        ILE  42  -1.580  -1.723  -3.198
  275    HA   ILE  42           HA       ILE  42  -2.842   0.375  -4.842
  276    HB   ILE  42           HB       ILE  42  -1.789   2.067  -3.556
  277   1HG1  ILE  42          2HG1      ILE  42  -0.413   0.045  -1.799
  278   2HG1  ILE  42          1HG1      ILE  42   0.361   0.681  -3.249
  279   1HG2  ILE  42          1HG2      ILE  42  -2.630   1.623  -1.265
  280   2HG2  ILE  42          2HG2      ILE  42  -2.899  -0.056  -1.734
  281   3HG2  ILE  42          3HG2      ILE  42  -3.791   1.237  -2.536
  282   1HD1  ILE  42          1HD1      ILE  42  -0.674   2.357  -0.982
  283   2HD1  ILE  42          2HD1      ILE  42   0.231   2.917  -2.390
  284   3HD1  ILE  42          3HD1      ILE  42   1.005   1.870  -1.200
  285    H    ASN  43           H        ASN  43  -0.950   2.066  -5.417
  286    HA   ASN  43           HA       ASN  43   0.719   0.581  -7.259
  287   1HB   ASN  43          2HB       ASN  43  -0.624   2.701  -7.787
  288   2HB   ASN  43          1HB       ASN  43   0.609   3.573  -6.893
  289   1HD2  ASN  43          1HD2      ASN  43  -0.202   3.637  -9.732
  290   2HD2  ASN  43          2HD2      ASN  43   1.252   3.358 -10.634
  291    H    ARG  44           H        ARG  44   2.908   0.377  -7.128
  292    HA   ARG  44           HA       ARG  44   4.271   0.669  -4.715
  293   1HB   ARG  44          2HB       ARG  44   6.363   0.513  -6.193
  294   2HB   ARG  44          1HB       ARG  44   5.231  -0.832  -6.231
  295   1HG   ARG  44          2HG       ARG  44   4.631  -0.447  -8.378
  296   2HG   ARG  44          1HG       ARG  44   4.826   1.301  -8.238
  297   1HD   ARG  44          2HD       ARG  44   7.247  -0.414  -8.077
  298   2HD   ARG  44          1HD       ARG  44   6.496  -0.169  -9.656
  299    HE   ARG  44           HE       ARG  44   6.670   2.333  -8.934
  300   1HH1  ARG  44          1HH1      ARG  44   9.039  -0.187  -8.325
  301   2HH1  ARG  44          2HH1      ARG  44  10.392   0.900  -8.401
  302   1HH2  ARG  44          1HH2      ARG  44   8.445   3.755  -8.982
  303   2HH2  ARG  44          2HH2      ARG  44  10.053   3.135  -8.762
  304    H    ASP  45           H        ASP  45   3.954   2.912  -7.413
  305    HA   ASP  45           HA       ASP  45   5.942   4.734  -6.480
  306   1HB   ASP  45          2HB       ASP  45   3.736   4.915  -8.508
  307   2HB   ASP  45          1HB       ASP  45   4.668   6.342  -8.063
  308    H    ASP  46           H        ASP  46   2.723   4.094  -5.599
  309    HA   ASP  46           HA       ASP  46   2.267   6.689  -4.392
  310   1HB   ASP  46          2HB       ASP  46   0.650   4.171  -4.646
  311   2HB   ASP  46          1HB       ASP  46   0.190   5.403  -3.474
  312    H    VAL  47           H        VAL  47   3.797   3.796  -3.572
  313    HA   VAL  47           HA       VAL  47   3.420   4.046  -0.716
  314    HB   VAL  47           HB       VAL  47   5.555   2.436  -2.121
  315   1HG1  VAL  47          1HG1      VAL  47   4.214   2.114   0.555
  316   2HG1  VAL  47          2HG1      VAL  47   5.845   2.727   0.281
  317   3HG1  VAL  47          3HG1      VAL  47   5.453   1.053  -0.113
  318   1HG2  VAL  47          1HG2      VAL  47   2.765   1.557  -1.417
  319   2HG2  VAL  47          2HG2      VAL  47   4.044   0.542  -2.073
  320   3HG2  VAL  47          3HG2      VAL  47   3.370   1.847  -3.047
  321    H    SER  48           H        SER  48   4.437   5.551   0.443
  322    HA   SER  48           HA       SER  48   6.862   6.740  -0.695
  323   1HB   SER  48          2HB       SER  48   5.038   8.318  -0.451
  324   2HB   SER  48          1HB       SER  48   4.830   7.881   1.242
  325    HG   SER  48           HG       SER  48   6.062   9.857   0.795
  326    H    GLN  49           H        GLN  49   5.547   6.434   2.629
  327    HA   GLN  49           HA       GLN  49   8.232   5.533   3.431
  328   1HB   GLN  49          2HB       GLN  49   6.473   7.581   4.763
  329   2HB   GLN  49          1HB       GLN  49   7.787   6.776   5.608
  330   1HG   GLN  49          2HG       GLN  49   8.060   8.459   3.129
  331   2HG   GLN  49          1HG       GLN  49   8.446   8.964   4.773
  332   1HE2  GLN  49          1HE2      GLN  49  10.252   8.073   5.806
  333   2HE2  GLN  49          2HE2      GLN  49  11.525   7.312   4.907
  334    H    ILE  50           H        ILE  50   8.017   3.488   3.966
  335    HA   ILE  50           HA       ILE  50   5.841   2.690   5.780
  336    HB   ILE  50           HB       ILE  50   7.832   0.947   4.300
  337   1HG1  ILE  50          2HG1      ILE  50   6.240   2.033   2.769
  338   2HG1  ILE  50          1HG1      ILE  50   5.953   0.300   2.868
  339   1HG2  ILE  50          1HG2      ILE  50   6.389  -0.918   4.984
  340   2HG2  ILE  50          2HG2      ILE  50   5.406   0.201   5.928
  341   3HG2  ILE  50          3HG2      ILE  50   7.091  -0.078   6.366
  342   1HD1  ILE  50          1HD1      ILE  50   4.375   2.437   4.276
  343   2HD1  ILE  50          2HD1      ILE  50   4.087   0.701   4.387
  344   3HD1  ILE  50          3HD1      ILE  50   3.873   1.532   2.847
  345    H    ILE  51           H        ILE  51   9.290   2.204   5.256
  346    HA   ILE  51           HA       ILE  51  10.189   3.059   7.749
  347    HB   ILE  51           HB       ILE  51   8.996   0.926   8.471
  348   1HG1  ILE  51          2HG1      ILE  51  11.987   0.985   8.926
  349   2HG1  ILE  51          1HG1      ILE  51  10.817   1.976   9.789
  350   1HG2  ILE  51          1HG2      ILE  51  11.229  -0.387   6.926
  351   2HG2  ILE  51          2HG2      ILE  51   9.511  -0.448   6.533
  352   3HG2  ILE  51          3HG2      ILE  51  10.106  -1.212   8.007
  353   1HD1  ILE  51          1HD1      ILE  51  11.506   0.079  11.126
  354   2HD1  ILE  51          2HD1      ILE  51  10.990  -1.028   9.854
  355   3HD1  ILE  51          3HD1      ILE  51   9.798  -0.050  10.707
  356    H    GLU  52           H        GLU  52  12.611   2.128   7.977
  357    HA   GLU  52           HA       GLU  52  13.880   2.599   5.482
  358   1HB   GLU  52          2HB       GLU  52  14.937   3.194   7.621
  359   2HB   GLU  52          1HB       GLU  52  15.051   1.490   8.041
  360   1HG   GLU  52          2HG       GLU  52  16.655   1.078   6.381
  361   2HG   GLU  52          1HG       GLU  52  16.331   2.612   5.573
  362    H    ARG  53           H        ARG  53  13.808   1.239   3.874
  363    HA   ARG  53           HA       ARG  53  13.448  -1.614   4.399
  364   1HB   ARG  53          2HB       ARG  53  13.187  -0.054   1.816
  365   2HB   ARG  53          1HB       ARG  53  12.747  -1.743   2.050
  366   1HG   ARG  53          2HG       ARG  53  11.040  -1.095   3.651
  367   2HG   ARG  53          1HG       ARG  53  11.494   0.597   3.471
  368   1HD   ARG  53          2HD       ARG  53  10.389  -1.180   1.301
  369   2HD   ARG  53          1HD       ARG  53   9.484   0.040   2.190
  370    HE   ARG  53           HE       ARG  53  11.065   0.464  -0.098
  371   1HH1  ARG  53          1HH1      ARG  53  10.569   1.978   3.036
  372   2HH1  ARG  53          2HH1      ARG  53  10.753   3.585   2.419
  373   1HH2  ARG  53          1HH2      ARG  53  11.300   2.595  -0.890
  374   2HH2  ARG  53          2HH2      ARG  53  11.156   3.943   0.206
  Start of MODEL    2
    1    H    ASP   4           H        ASP   4   0.665   1.169  15.316
    2    HA   ASP   4           HA       ASP   4   2.549  -0.959  16.095
    3   1HB   ASP   4          2HB       ASP   4   0.131  -1.132  14.280
    4   2HB   ASP   4          1HB       ASP   4   1.160  -2.476  14.764
    5    H    TYR   5           H        TYR   5   1.018  -0.233  12.996
    6    HA   TYR   5           HA       TYR   5   3.640   0.368  11.822
    7   1HB   TYR   5          2HB       TYR   5   1.622  -1.583  10.673
    8   2HB   TYR   5          1HB       TYR   5   3.084  -1.040   9.856
    9    HD1  TYR   5           HD2      TYR   5   5.298  -1.775  10.664
   10    HD2  TYR   5           HD1      TYR   5   1.703  -3.261  12.388
   11    HE1  TYR   5           HE2      TYR   5   6.561  -3.617  11.695
   12    HE2  TYR   5           HE1      TYR   5   2.954  -5.106  13.424
   13    HH   TYR   5           HH       TYR   5   5.062  -6.330  13.078
   14    H    VAL   6           H        VAL   6   3.154   1.075   9.392
   15    HA   VAL   6           HA       VAL   6   0.688   2.318   8.839
   16    HB   VAL   6           HB       VAL   6   1.344   3.819  10.680
   17   1HG1  VAL   6          1HG1      VAL   6   3.740   4.491   8.978
   18   2HG1  VAL   6          2HG1      VAL   6   3.766   3.608  10.505
   19   3HG1  VAL   6          3HG1      VAL   6   3.271   5.302  10.472
   20   1HG2  VAL   6          1HG2      VAL   6   1.449   5.120   7.961
   21   2HG2  VAL   6          2HG2      VAL   6   1.120   5.954   9.479
   22   3HG2  VAL   6          3HG2      VAL   6  -0.003   4.732   8.884
   23    H    MET   7           H        MET   7   0.602   2.908   6.735
   24    HA   MET   7           HA       MET   7   3.164   3.169   5.310
   25   1HB   MET   7          2HB       MET   7   2.025   1.092   4.658
   26   2HB   MET   7          1HB       MET   7   0.577   2.005   4.253
   27   1HG   MET   7          2HG       MET   7   1.870   3.205   2.518
   28   2HG   MET   7          1HG       MET   7   3.257   2.185   2.894
   29   1HE   MET   7          1HE       MET   7  -0.345   2.370   1.422
   30   2HE   MET   7          2HE       MET   7  -0.575   1.215   2.736
   31   3HE   MET   7          3HE       MET   7  -0.697   0.682   1.056
   32    H    ALA   8           H        ALA   8   3.403   5.280   5.069
   33    HA   ALA   8           HA       ALA   8   1.099   6.922   4.336
   34   1HB   ALA   8          1HB       ALA   8   2.583   8.833   4.691
   35   2HB   ALA   8          2HB       ALA   8   3.932   7.738   4.995
   36   3HB   ALA   8          3HB       ALA   8   2.559   7.778   6.102
   37    H    THR   9           H        THR   9   0.689   7.331   2.285
   38    HA   THR   9           HA       THR   9   2.569   6.413   0.285
   39    HB   THR   9           HB       THR   9   0.719   6.904  -1.311
   40    HG1  THR   9           HG1      THR   9  -1.208   7.644  -0.565
   41   1HG2  THR   9          1HG2      THR   9  -0.018   5.180   1.055
   42   2HG2  THR   9          2HG2      THR   9   0.961   4.683  -0.325
   43   3HG2  THR   9          3HG2      THR   9  -0.741   5.086  -0.551
   44    H    LYS  10           H        LYS  10   2.660   7.771  -1.783
   45    HA   LYS  10           HA       LYS  10   3.986  10.197  -1.236
   46   1HB   LYS  10          2HB       LYS  10   4.303   8.729  -3.260
   47   2HB   LYS  10          1HB       LYS  10   2.780   9.350  -3.877
   48   1HG   LYS  10          2HG       LYS  10   3.670  11.562  -4.023
   49   2HG   LYS  10          1HG       LYS  10   5.157  11.068  -3.216
   50   1HD   LYS  10          2HD       LYS  10   5.535  11.257  -5.597
   51   2HD   LYS  10          1HD       LYS  10   5.660   9.571  -5.105
   52   1HE   LYS  10          2HE       LYS  10   3.134  10.747  -6.246
   53   2HE   LYS  10          1HE       LYS  10   4.397  10.067  -7.261
   54   1HZ   LYS  10          1HZ       LYS  10   4.114   7.955  -5.995
   55   2HZ   LYS  10          2HZ       LYS  10   2.763   8.407  -6.912
   56   3HZ   LYS  10          3HZ       LYS  10   2.756   8.639  -5.234
   57    H    ASP  11           H        ASP  11   0.689   9.400  -1.904
   58    HA   ASP  11           HA       ASP  11  -0.430  11.840  -2.586
   59   1HB   ASP  11          2HB       ASP  11  -1.701   9.756  -2.554
   60   2HB   ASP  11          1HB       ASP  11  -1.546   9.663  -0.803
   61    H    GLY  12           H        GLY  12   0.740  10.694   0.501
   62   1HA   GLY  12          2HA       GLY  12   1.512  12.218   2.159
   63   2HA   GLY  12          1HA       GLY  12   0.343  13.395   1.577
   64    H    ARG  13           H        ARG  13  -0.841  10.215   1.883
   65    HA   ARG  13           HA       ARG  13  -2.270  11.020   4.316
   66   1HB   ARG  13          2HB       ARG  13  -3.952   9.345   3.694
   67   2HB   ARG  13          1HB       ARG  13  -3.727  10.543   2.429
   68   1HG   ARG  13          2HG       ARG  13  -2.367   8.985   1.163
   69   2HG   ARG  13          1HG       ARG  13  -2.530   7.780   2.441
   70   1HD   ARG  13          2HD       ARG  13  -4.752   8.937   0.764
   71   2HD   ARG  13          1HD       ARG  13  -4.076   7.316   0.631
   72    HE   ARG  13           HE       ARG  13  -4.943   7.532   3.236
   73   1HH1  ARG  13          1HH1      ARG  13  -6.417   7.888   0.082
   74   2HH1  ARG  13          2HH1      ARG  13  -7.966   7.283   0.586
   75   1HH2  ARG  13          1HH2      ARG  13  -6.973   6.791   3.930
   76   2HH2  ARG  13          2HH2      ARG  13  -8.297   6.679   2.804
   77    H    MET  14           H        MET  14  -2.385   9.676   6.084
   78    HA   MET  14           HA       MET  14  -0.295   7.620   6.188
   79   1HB   MET  14          2HB       MET  14  -1.785   9.095   8.363
   80   2HB   MET  14          1HB       MET  14  -0.714   7.740   8.685
   81   1HG   MET  14          2HG       MET  14   0.503   9.725   9.099
   82   2HG   MET  14          1HG       MET  14   1.123   9.031   7.603
   83   1HE   MET  14          1HE       MET  14   2.333  11.292   6.996
   84   2HE   MET  14          2HE       MET  14   1.753  12.008   8.500
   85   3HE   MET  14          3HE       MET  14   1.535  12.864   6.972
   86    H    ILE  15           H        ILE  15  -1.090   5.722   5.518
   87    HA   ILE  15           HA       ILE  15  -3.759   4.897   6.387
   88    HB   ILE  15           HB       ILE  15  -1.861   3.453   4.525
   89   1HG1  ILE  15          2HG1      ILE  15  -4.228   5.217   3.851
   90   2HG1  ILE  15          1HG1      ILE  15  -2.539   5.666   3.636
   91   1HG2  ILE  15          1HG2      ILE  15  -3.500   1.993   5.561
   92   2HG2  ILE  15          2HG2      ILE  15  -3.878   2.214   3.852
   93   3HG2  ILE  15          3HG2      ILE  15  -4.802   3.081   5.081
   94   1HD1  ILE  15          1HD1      ILE  15  -3.541   4.977   1.539
   95   2HD1  ILE  15          2HD1      ILE  15  -3.962   3.415   2.236
   96   3HD1  ILE  15          3HD1      ILE  15  -2.268   3.856   2.020
   97    H    LEU  16           H        LEU  16  -3.878   3.883   8.289
   98    HA   LEU  16           HA       LEU  16  -1.630   2.605   9.503
   99   1HB   LEU  16          2HB       LEU  16  -4.565   2.559  10.227
  100   2HB   LEU  16          1HB       LEU  16  -3.313   1.789  11.179
  101    HG   LEU  16           HG       LEU  16  -3.780   3.812  12.271
  102   1HD1  LEU  16          1HD1      LEU  16  -1.409   3.373  12.100
  103   2HD1  LEU  16          2HD1      LEU  16  -1.716   5.110  12.072
  104   3HD1  LEU  16          3HD1      LEU  16  -1.332   4.258  10.576
  105   1HD2  LEU  16          1HD2      LEU  16  -5.029   4.876  10.442
  106   2HD2  LEU  16          2HD2      LEU  16  -3.503   5.269   9.647
  107   3HD2  LEU  16          3HD2      LEU  16  -3.891   5.980  11.214
  108    H    THR  17           H        THR  17  -0.863   0.940   8.353
  109    HA   THR  17           HA       THR  17  -2.735  -1.034   7.274
  110    HB   THR  17           HB       THR  17  -0.664  -1.789   5.992
  111    HG1  THR  17           HG1      THR  17   0.885  -0.716   7.321
  112   1HG2  THR  17          1HG2      THR  17  -1.667   1.026   5.543
  113   2HG2  THR  17          2HG2      THR  17  -2.441  -0.451   4.962
  114   3HG2  THR  17          3HG2      THR  17  -0.856   0.018   4.346
  115    H    ASP  18           H        ASP  18  -2.167  -3.286   7.370
  116    HA   ASP  18           HA       ASP  18  -1.137  -4.301   9.794
  117   1HB   ASP  18          2HB       ASP  18  -2.611  -5.420   7.934
  118   2HB   ASP  18          1HB       ASP  18  -1.065  -5.842   7.207
  119    H    GLY  19           H        GLY  19   0.905  -5.559  10.019
  120   1HA   GLY  19          2HA       GLY  19   3.087  -4.034   8.823
  121   2HA   GLY  19          1HA       GLY  19   3.240  -5.257  10.083
  122    H    LYS  20           H        LYS  20   2.791  -4.800   6.571
  123    HA   LYS  20           HA       LYS  20   3.781  -7.210   5.695
  124   1HB   LYS  20          2HB       LYS  20   1.697  -7.755   7.424
  125   2HB   LYS  20          1HB       LYS  20   0.938  -7.861   5.841
  126   1HG   LYS  20          2HG       LYS  20   3.338  -9.408   6.797
  127   2HG   LYS  20          1HG       LYS  20   1.716 -10.039   6.509
  128   1HD   LYS  20          2HD       LYS  20   1.937  -9.533   4.131
  129   2HD   LYS  20          1HD       LYS  20   3.543  -8.862   4.418
  130   1HE   LYS  20          2HE       LYS  20   4.219 -11.101   5.315
  131   2HE   LYS  20          1HE       LYS  20   2.664 -11.722   4.766
  132   1HZ   LYS  20          1HZ       LYS  20   4.702 -10.456   3.024
  133   2HZ   LYS  20          2HZ       LYS  20   3.234 -11.142   2.513
  134   3HZ   LYS  20          3HZ       LYS  20   4.451 -12.124   3.174
  135    HA   PRO  21           HA       PRO  21   1.391  -4.741   2.455
  136   1HB   PRO  21          2HB       PRO  21   3.910  -3.542   1.627
  137   2HB   PRO  21          1HB       PRO  21   2.397  -2.744   2.064
  138   1HG   PRO  21          2HG       PRO  21   4.645  -2.610   3.582
  139   2HG   PRO  21          1HG       PRO  21   3.011  -2.503   4.254
  140   1HD   PRO  21          2HD       PRO  21   4.888  -4.833   4.206
  141   2HD   PRO  21          1HD       PRO  21   3.796  -4.286   5.497
  142    H    GLU  22           H        GLU  22   1.122  -6.386   1.084
  143    HA   GLU  22           HA       GLU  22   3.284  -8.113   0.327
  144   1HB   GLU  22          2HB       GLU  22   0.686  -8.582   0.627
  145   2HB   GLU  22          1HB       GLU  22   0.652  -8.165  -1.081
  146   1HG   GLU  22          2HG       GLU  22   0.832 -10.550  -0.817
  147   2HG   GLU  22          1HG       GLU  22   2.316  -9.909  -1.526
  148    H    ILE  23           H        ILE  23   4.765  -7.233  -0.961
  149    HA   ILE  23           HA       ILE  23   3.921  -5.435  -3.103
  150    HB   ILE  23           HB       ILE  23   6.728  -6.105  -2.202
  151   1HG1  ILE  23          2HG1      ILE  23   4.972  -3.736  -1.501
  152   2HG1  ILE  23          1HG1      ILE  23   5.410  -5.041  -0.407
  153   1HG2  ILE  23          1HG2      ILE  23   5.671  -3.879  -3.947
  154   2HG2  ILE  23          2HG2      ILE  23   6.616  -5.267  -4.486
  155   3HG2  ILE  23          3HG2      ILE  23   7.345  -4.068  -3.420
  156   1HD1  ILE  23          1HD1      ILE  23   7.321  -3.083  -1.655
  157   2HD1  ILE  23          2HD1      ILE  23   7.750  -4.384  -0.544
  158   3HD1  ILE  23          3HD1      ILE  23   6.736  -3.051   0.008
  159    H    ASP  24           H        ASP  24   3.288  -6.502  -4.852
  160    HA   ASP  24           HA       ASP  24   4.702  -8.850  -5.795
  161   1HB   ASP  24          2HB       ASP  24   2.250  -8.636  -6.105
  162   2HB   ASP  24          1HB       ASP  24   2.516  -7.229  -7.130
  163    H    ASP  25           H        ASP  25   6.634  -8.565  -6.695
  164    HA   ASP  25           HA       ASP  25   7.499  -5.974  -7.563
  165   1HB   ASP  25          2HB       ASP  25   8.956  -7.645  -6.393
  166   2HB   ASP  25          1HB       ASP  25   8.941  -8.615  -7.862
  167    H    ASP  26           H        ASP  26   5.871  -8.472  -9.059
  168    HA   ASP  26           HA       ASP  26   6.962  -8.143 -11.695
  169   1HB   ASP  26          2HB       ASP  26   6.067 -10.301 -11.086
  170   2HB   ASP  26          1HB       ASP  26   4.504  -9.591 -10.697
  171    H    THR  27           H        THR  27   3.769  -7.467 -10.266
  172    HA   THR  27           HA       THR  27   3.058  -5.783 -12.511
  173    HB   THR  27           HB       THR  27   0.948  -5.400 -11.199
  174    HG1  THR  27           HG1      THR  27   2.052  -7.373  -9.447
  175   1HG2  THR  27          1HG2      THR  27   1.092  -7.203 -12.845
  176   2HG2  THR  27          2HG2      THR  27   0.094  -7.683 -11.472
  177   3HG2  THR  27          3HG2      THR  27   1.745  -8.283 -11.612
  178    H    GLY  28           H        GLY  28   4.273  -5.405  -9.274
  179   1HA   GLY  28          2HA       GLY  28   5.339  -3.471  -8.466
  180   2HA   GLY  28          1HA       GLY  28   4.549  -2.533  -9.725
  181    H    LEU  29           H        LEU  29   2.515  -4.689  -8.064
  182    HA   LEU  29           HA       LEU  29   1.191  -2.420  -6.796
  183   1HB   LEU  29          2HB       LEU  29   0.322  -5.138  -7.648
  184   2HB   LEU  29          1HB       LEU  29  -0.550  -4.359  -6.343
  185    HG   LEU  29           HG       LEU  29  -1.014  -2.436  -7.844
  186   1HD1  LEU  29          1HD1      LEU  29   0.247  -4.192  -9.944
  187   2HD1  LEU  29          2HD1      LEU  29   0.831  -2.623  -9.387
  188   3HD1  LEU  29          3HD1      LEU  29  -0.693  -2.735 -10.264
  189   1HD2  LEU  29          1HD2      LEU  29  -2.643  -4.212  -7.534
  190   2HD2  LEU  29          2HD2      LEU  29  -1.921  -5.124  -8.858
  191   3HD2  LEU  29          3HD2      LEU  29  -2.707  -3.578  -9.177
  192    H    VAL  30           H        VAL  30   0.707  -2.290  -4.674
  193    HA   VAL  30           HA       VAL  30   1.998  -4.243  -2.881
  194    HB   VAL  30           HB       VAL  30   1.431  -1.311  -2.388
  195   1HG1  VAL  30          1HG1      VAL  30   1.196  -2.602  -0.348
  196   2HG1  VAL  30          2HG1      VAL  30   2.661  -1.621  -0.292
  197   3HG1  VAL  30          3HG1      VAL  30   2.769  -3.352  -0.618
  198   1HG2  VAL  30          1HG2      VAL  30   3.866  -1.059  -2.340
  199   2HG2  VAL  30          2HG2      VAL  30   3.298  -1.635  -3.908
  200   3HG2  VAL  30          3HG2      VAL  30   4.047  -2.760  -2.773
  201    H    SER  31           H        SER  31   0.459  -5.575  -2.165
  202    HA   SER  31           HA       SER  31  -2.243  -4.625  -1.672
  203   1HB   SER  31          2HB       SER  31  -1.113  -7.374  -1.137
  204   2HB   SER  31          1HB       SER  31  -2.806  -6.934  -1.341
  205    HG   SER  31           HG       SER  31  -1.144  -7.759  -3.191
  206    H    TYR  32           H        TYR  32  -2.751  -3.734   0.210
  207    HA   TYR  32           HA       TYR  32  -1.197  -4.510   2.589
  208   1HB   TYR  32          2HB       TYR  32  -1.658  -2.227   3.462
  209   2HB   TYR  32          1HB       TYR  32  -0.689  -2.220   1.994
  210    HD1  TYR  32           HD1      TYR  32  -1.833  -1.678  -0.200
  211    HD2  TYR  32           HD2      TYR  32  -3.710  -1.050   3.564
  212    HE1  TYR  32           HE1      TYR  32  -3.429  -0.141  -1.254
  213    HE2  TYR  32           HE2      TYR  32  -5.312   0.495   2.509
  214    HH   TYR  32           HH       TYR  32  -5.711   0.734  -0.823
  215    H    HIS  33           H        HIS  33  -2.266  -4.980   4.438
  216    HA   HIS  33           HA       HIS  33  -5.148  -5.357   4.209
  217   1HB   HIS  33          2HB       HIS  33  -3.951  -7.301   4.939
  218   2HB   HIS  33          1HB       HIS  33  -3.087  -6.392   6.167
  219    HD1  HIS  33           HD1      HIS  33  -3.879  -7.011   8.410
  220    HD2  HIS  33           HD2      HIS  33  -6.957  -7.067   5.608
  221    HE1  HIS  33           HE1      HIS  33  -5.937  -7.693   9.676
  222    HE2  HIS  33           HE2      HIS  33  -7.711  -7.979   7.913
  223    H    ASP  34           H        ASP  34  -6.431  -3.853   4.901
  224    HA   ASP  34           HA       ASP  34  -5.739  -1.699   6.593
  225   1HB   ASP  34          2HB       ASP  34  -8.395  -2.856   5.746
  226   2HB   ASP  34          1HB       ASP  34  -8.273  -1.442   6.782
  227    H    GLN  35           H        GLN  35  -6.607  -1.222   8.718
  228    HA   GLN  35           HA       GLN  35  -6.864  -3.411  10.546
  229   1HB   GLN  35          2HB       GLN  35  -7.818  -0.552  10.894
  230   2HB   GLN  35          1HB       GLN  35  -7.591  -1.734  12.175
  231   1HG   GLN  35          2HG       GLN  35  -5.167  -1.774  11.608
  232   2HG   GLN  35          1HG       GLN  35  -5.463  -0.447  10.484
  233   1HE2  GLN  35          1HE2      GLN  35  -6.104   1.573  11.316
  234   2HE2  GLN  35          2HE2      GLN  35  -5.778   2.013  12.955
  235    H    GLN  36           H        GLN  36  -8.803  -1.909   8.270
  236    HA   GLN  36           HA       GLN  36 -11.395  -2.475   9.323
  237   1HB   GLN  36          2HB       GLN  36 -10.899  -0.658   7.719
  238   2HB   GLN  36          1HB       GLN  36 -10.470  -1.855   6.513
  239   1HG   GLN  36          2HG       GLN  36 -12.738  -2.652   6.434
  240   2HG   GLN  36          1HG       GLN  36 -13.194  -1.564   7.746
  241   1HE2  GLN  36          1HE2      GLN  36 -10.954  -0.559   5.272
  242   2HE2  GLN  36          2HE2      GLN  36 -12.024   0.542   4.476
  243    H    GLY  37           H        GLY  37  -8.956  -4.332   7.927
  244   1HA   GLY  37          2HA       GLY  37  -8.951  -6.641   7.649
  245   2HA   GLY  37          1HA       GLY  37 -10.702  -6.640   7.805
  246    H    ASN  38           H        ASN  38  -8.807  -4.703   5.560
  247    HA   ASN  38           HA       ASN  38  -9.996  -6.247   3.340
  248   1HB   ASN  38          2HB       ASN  38  -9.440  -3.283   3.538
  249   2HB   ASN  38          1HB       ASN  38  -9.791  -4.094   2.019
  250   1HD2  ASN  38          1HD2      ASN  38 -11.193  -1.985   3.446
  251   2HD2  ASN  38          2HD2      ASN  38 -12.815  -2.554   3.660
  252    H    ALA  39           H        ALA  39  -8.692  -6.663   1.557
  253    HA   ALA  39           HA       ALA  39  -5.865  -5.884   1.829
  254   1HB   ALA  39          1HB       ALA  39  -7.061  -8.103   0.167
  255   2HB   ALA  39          2HB       ALA  39  -6.237  -8.308   1.712
  256   3HB   ALA  39          3HB       ALA  39  -5.344  -7.720   0.308
  257    H    MET  40           H        MET  40  -5.865  -3.895   0.908
  258    HA   MET  40           HA       MET  40  -7.004  -3.658  -1.793
  259   1HB   MET  40          2HB       MET  40  -6.155  -1.450   0.102
  260   2HB   MET  40          1HB       MET  40  -6.917  -1.232  -1.470
  261   1HG   MET  40          2HG       MET  40  -8.841  -2.606  -0.532
  262   2HG   MET  40          1HG       MET  40  -8.108  -2.340   1.046
  263   1HE   MET  40          1HE       MET  40  -8.097  -0.099   2.316
  264   2HE   MET  40          2HE       MET  40  -8.486   1.465   1.595
  265   3HE   MET  40          3HE       MET  40  -7.055   0.579   1.065
  266    H    GLN  41           H        GLN  41  -5.696  -2.341  -3.361
  267    HA   GLN  41           HA       GLN  41  -2.830  -2.926  -2.934
  268   1HB   GLN  41          2HB       GLN  41  -4.244  -3.089  -5.597
  269   2HB   GLN  41          1HB       GLN  41  -2.603  -3.591  -5.225
  270   1HG   GLN  41          2HG       GLN  41  -3.585  -5.619  -5.217
  271   2HG   GLN  41          1HG       GLN  41  -3.894  -5.184  -3.538
  272   1HE2  GLN  41          1HE2      GLN  41  -5.257  -5.574  -6.696
  273   2HE2  GLN  41          2HE2      GLN  41  -6.915  -5.558  -6.214
  274    H    ILE  42           H        ILE  42  -1.510  -1.219  -3.175
  275    HA   ILE  42           HA       ILE  42  -2.367   0.917  -5.021
  276    HB   ILE  42           HB       ILE  42  -0.852   2.465  -3.964
  277   1HG1  ILE  42          2HG1      ILE  42  -0.166   0.470  -1.822
  278   2HG1  ILE  42          1HG1      ILE  42   0.788   0.561  -3.301
  279   1HG2  ILE  42          1HG2      ILE  42  -2.363   1.118  -1.748
  280   2HG2  ILE  42          2HG2      ILE  42  -3.124   2.129  -2.975
  281   3HG2  ILE  42          3HG2      ILE  42  -1.927   2.819  -1.877
  282   1HD1  ILE  42          1HD1      ILE  42   1.374   2.828  -2.855
  283   2HD1  ILE  42          2HD1      ILE  42   1.708   1.862  -1.414
  284   3HD1  ILE  42          3HD1      ILE  42   0.277   2.889  -1.472
  285    H    ASN  43           H        ASN  43  -0.192   2.047  -5.871
  286    HA   ASN  43           HA       ASN  43   1.448  -0.119  -6.958
  287   1HB   ASN  43          2HB       ASN  43   0.633   2.540  -7.910
  288   2HB   ASN  43          1HB       ASN  43   2.314   2.130  -8.223
  289   1HD2  ASN  43          1HD2      ASN  43   2.798   0.400  -9.583
  290   2HD2  ASN  43          2HD2      ASN  43   1.613  -0.287 -10.652
  291    H    ARG  44           H        ARG  44   3.732  -0.015  -6.922
  292    HA   ARG  44           HA       ARG  44   4.817   0.851  -4.469
  293   1HB   ARG  44          2HB       ARG  44   5.727  -1.030  -5.832
  294   2HB   ARG  44          1HB       ARG  44   6.344   0.146  -6.987
  295   1HG   ARG  44          2HG       ARG  44   7.877   1.027  -5.408
  296   2HG   ARG  44          1HG       ARG  44   7.108   0.157  -4.081
  297   1HD   ARG  44          2HD       ARG  44   9.131  -0.982  -4.632
  298   2HD   ARG  44          1HD       ARG  44   7.784  -1.977  -5.175
  299    HE   ARG  44           HE       ARG  44   8.952  -0.236  -7.180
  300   1HH1  ARG  44          1HH1      ARG  44   8.891  -3.416  -5.724
  301   2HH1  ARG  44          2HH1      ARG  44   9.650  -4.206  -7.079
  302   1HH2  ARG  44          1HH2      ARG  44   9.955  -1.262  -8.972
  303   2HH2  ARG  44          2HH2      ARG  44  10.253  -2.972  -8.923
  304    H    ASP  45           H        ASP  45   4.431   2.396  -7.519
  305    HA   ASP  45           HA       ASP  45   6.293   4.484  -7.326
  306   1HB   ASP  45          2HB       ASP  45   3.613   4.269  -8.677
  307   2HB   ASP  45          1HB       ASP  45   4.547   5.757  -8.731
  308    H    ASP  46           H        ASP  46   3.473   3.898  -5.455
  309    HA   ASP  46           HA       ASP  46   3.408   6.736  -4.677
  310   1HB   ASP  46          2HB       ASP  46   1.308   5.622  -5.682
  311   2HB   ASP  46          1HB       ASP  46   1.162   4.820  -4.121
  312    H    VAL  47           H        VAL  47   4.602   3.861  -3.632
  313    HA   VAL  47           HA       VAL  47   3.944   4.125  -0.833
  314    HB   VAL  47           HB       VAL  47   6.280   2.548  -1.919
  315   1HG1  VAL  47          1HG1      VAL  47   4.522   2.126   0.495
  316   2HG1  VAL  47          2HG1      VAL  47   6.114   2.886   0.524
  317   3HG1  VAL  47          3HG1      VAL  47   5.953   1.192   0.058
  318   1HG2  VAL  47          1HG2      VAL  47   3.470   1.519  -1.597
  319   2HG2  VAL  47          2HG2      VAL  47   4.867   0.641  -2.214
  320   3HG2  VAL  47          3HG2      VAL  47   4.179   1.977  -3.142
  321    H    SER  48           H        SER  48   4.654   5.920   0.167
  322    HA   SER  48           HA       SER  48   7.174   7.100  -0.686
  323   1HB   SER  48          2HB       SER  48   5.240   8.565  -0.560
  324   2HB   SER  48          1HB       SER  48   4.995   8.153   1.134
  325    HG   SER  48           HG       SER  48   6.312   9.728   1.558
  326    H    GLN  49           H        GLN  49   5.621   6.532   2.491
  327    HA   GLN  49           HA       GLN  49   8.222   5.689   3.520
  328   1HB   GLN  49          2HB       GLN  49   7.779   7.117   5.584
  329   2HB   GLN  49          1HB       GLN  49   8.293   7.958   4.129
  330   1HG   GLN  49          2HG       GLN  49   5.931   8.520   3.669
  331   2HG   GLN  49          1HG       GLN  49   5.488   7.774   5.203
  332   1HE2  GLN  49          1HE2      GLN  49   5.966   8.823   7.117
  333   2HE2  GLN  49          2HE2      GLN  49   6.501  10.469   7.165
  334    H    ILE  50           H        ILE  50   8.089   3.953   4.715
  335    HA   ILE  50           HA       ILE  50   5.466   3.217   5.840
  336    HB   ILE  50           HB       ILE  50   5.976   1.798   3.939
  337   1HG1  ILE  50          2HG1      ILE  50   6.366   0.340   6.559
  338   2HG1  ILE  50          1HG1      ILE  50   4.821   0.770   5.833
  339   1HG2  ILE  50          1HG2      ILE  50   8.387   2.046   3.898
  340   2HG2  ILE  50          2HG2      ILE  50   7.934   0.342   3.895
  341   3HG2  ILE  50          3HG2      ILE  50   8.526   1.093   5.376
  342   1HD1  ILE  50          1HD1      ILE  50   5.370  -0.674   3.909
  343   2HD1  ILE  50          2HD1      ILE  50   5.269  -1.548   5.437
  344   3HD1  ILE  50          3HD1      ILE  50   6.845  -1.167   4.743
  345    H    ILE  51           H        ILE  51   8.873   3.540   6.294
  346    HA   ILE  51           HA       ILE  51  10.145   3.676   8.159
  347    HB   ILE  51           HB       ILE  51   7.474   3.466   9.523
  348   1HG1  ILE  51          2HG1      ILE  51   8.199   5.752  10.360
  349   2HG1  ILE  51          1HG1      ILE  51   9.550   5.643   9.242
  350   1HG2  ILE  51          1HG2      ILE  51  10.151   3.648  10.902
  351   2HG2  ILE  51          2HG2      ILE  51   9.031   2.288  10.970
  352   3HG2  ILE  51          3HG2      ILE  51   8.579   3.839  11.682
  353   1HD1  ILE  51          1HD1      ILE  51   7.726   6.972   8.335
  354   2HD1  ILE  51          2HD1      ILE  51   6.639   5.591   8.482
  355   3HD1  ILE  51          3HD1      ILE  51   8.006   5.523   7.369
  356    H    GLU  52           H        GLU  52  11.551   2.122   8.460
  357    HA   GLU  52           HA       GLU  52  10.789  -0.637   8.747
  358   1HB   GLU  52          2HB       GLU  52  12.863   0.018   7.575
  359   2HB   GLU  52          1HB       GLU  52  13.486   0.703   9.068
  360   1HG   GLU  52          2HG       GLU  52  14.487  -1.446   8.685
  361   2HG   GLU  52          1HG       GLU  52  13.428  -1.536  10.091
  362    H    ARG  53           H        ARG  53  10.540  -1.742  10.609
  363    HA   ARG  53           HA       ARG  53  10.099  -0.286  12.981
  364   1HB   ARG  53          2HB       ARG  53  10.013  -2.789  13.917
  365   2HB   ARG  53          1HB       ARG  53   8.708  -2.073  12.984
  366   1HG   ARG  53          2HG       ARG  53   8.979  -4.157  12.014
  367   2HG   ARG  53          1HG       ARG  53   9.887  -3.094  10.940
  368   1HD   ARG  53          2HD       ARG  53  11.794  -3.822  12.750
  369   2HD   ARG  53          1HD       ARG  53  10.811  -5.284  12.655
  370    HE   ARG  53           HE       ARG  53  11.606  -4.092  10.120
  371   1HH1  ARG  53          1HH1      ARG  53  12.176  -6.574  12.533
  372   2HH1  ARG  53          2HH1      ARG  53  13.193  -7.518  11.492
  373   1HH2  ARG  53          1HH2      ARG  53  12.950  -5.315   8.770
  374   2HH2  ARG  53          2HH2      ARG  53  13.669  -6.785   9.357
  Start of MODEL    3
    1    H    ASP   4           H        ASP   4   5.762   4.570  14.317
    2    HA   ASP   4           HA       ASP   4   8.257   3.616  13.127
    3   1HB   ASP   4          2HB       ASP   4   7.898   3.708  15.638
    4   2HB   ASP   4          1HB       ASP   4   6.724   2.410  15.449
    5    H    TYR   5           H        TYR   5   5.011   3.315  12.675
    6    HA   TYR   5           HA       TYR   5   5.324   0.896  11.076
    7   1HB   TYR   5          2HB       TYR   5   3.105   1.305  13.100
    8   2HB   TYR   5          1HB       TYR   5   3.136   0.025  11.894
    9    HD1  TYR   5           HD1      TYR   5   5.224  -1.546  11.959
   10    HD2  TYR   5           HD2      TYR   5   3.975   0.899  15.210
   11    HE1  TYR   5           HE1      TYR   5   6.467  -2.989  13.515
   12    HE2  TYR   5           HE2      TYR   5   5.217  -0.533  16.773
   13    HH   TYR   5           HH       TYR   5   7.531  -2.763  15.782
   14    H    VAL   6           H        VAL   6   2.566   0.727  10.451
   15    HA   VAL   6           HA       VAL   6   1.008   1.417   9.006
   16    HB   VAL   6           HB       VAL   6   0.014   3.492   9.174
   17   1HG1  VAL   6          1HG1      VAL   6  -0.024   4.061  11.545
   18   2HG1  VAL   6          2HG1      VAL   6   1.436   3.106  11.793
   19   3HG1  VAL   6          3HG1      VAL   6  -0.056   2.318  11.281
   20   1HG2  VAL   6          1HG2      VAL   6   2.602   4.722  10.117
   21   2HG2  VAL   6          2HG2      VAL   6   1.061   5.561   9.933
   22   3HG2  VAL   6          3HG2      VAL   6   1.885   4.910   8.516
   23    H    MET   7           H        MET   7   0.622   3.169   7.101
   24    HA   MET   7           HA       MET   7   3.157   3.330   5.629
   25   1HB   MET   7          2HB       MET   7   1.979   1.289   4.933
   26   2HB   MET   7          1HB       MET   7   0.562   2.247   4.525
   27   1HG   MET   7          2HG       MET   7   1.858   3.424   2.816
   28   2HG   MET   7          1HG       MET   7   3.266   2.440   3.216
   29   1HE   MET   7          1HE       MET   7  -0.516   1.276   3.059
   30   2HE   MET   7          2HE       MET   7  -0.625   0.771   1.376
   31   3HE   MET   7          3HE       MET   7  -0.365   2.470   1.770
   32    H    ALA   8           H        ALA   8   3.449   5.426   5.344
   33    HA   ALA   8           HA       ALA   8   1.242   7.182   4.629
   34   1HB   ALA   8          1HB       ALA   8   2.922   8.952   4.626
   35   2HB   ALA   8          2HB       ALA   8   4.204   7.753   4.813
   36   3HB   ALA   8          3HB       ALA   8   3.030   8.000   6.108
   37    H    THR   9           H        THR   9   0.915   8.034   2.576
   38    HA   THR   9           HA       THR   9   2.431   6.656   0.465
   39    HB   THR   9           HB       THR   9   0.336   7.020  -0.921
   40    HG1  THR   9           HG1      THR   9  -0.939   7.242   1.604
   41   1HG2  THR   9          1HG2      THR   9   0.987   4.827  -0.003
   42   2HG2  THR   9          2HG2      THR   9  -0.763   5.032  -0.028
   43   3HG2  THR   9          3HG2      THR   9   0.122   5.204   1.488
   44    H    LYS  10           H        LYS  10   2.435   7.717  -1.634
   45    HA   LYS  10           HA       LYS  10   3.671  10.202  -1.607
   46   1HB   LYS  10          2HB       LYS  10   3.878   8.534  -3.409
   47   2HB   LYS  10          1HB       LYS  10   2.215   8.836  -3.880
   48   1HG   LYS  10          2HG       LYS  10   2.758  11.065  -4.589
   49   2HG   LYS  10          1HG       LYS  10   4.398  10.906  -3.953
   50   1HD   LYS  10          2HD       LYS  10   4.358  10.592  -6.382
   51   2HD   LYS  10          1HD       LYS  10   4.848   9.112  -5.552
   52   1HE   LYS  10          2HE       LYS  10   2.524   8.291  -5.721
   53   2HE   LYS  10          1HE       LYS  10   2.106   9.736  -6.636
   54   1HZ   LYS  10          1HZ       LYS  10   4.191   7.806  -7.498
   55   2HZ   LYS  10          2HZ       LYS  10   3.498   9.061  -8.409
   56   3HZ   LYS  10          3HZ       LYS  10   2.569   7.710  -7.977
   57    H    ASP  11           H        ASP  11   0.309   9.354  -2.229
   58    HA   ASP  11           HA       ASP  11  -0.680  11.783  -3.123
   59   1HB   ASP  11          2HB       ASP  11  -1.981   9.708  -3.127
   60   2HB   ASP  11          1HB       ASP  11  -2.045   9.731  -1.369
   61    H    GLY  12           H        GLY  12   0.141  10.777   0.117
   62   1HA   GLY  12          2HA       GLY  12   0.665  12.364   1.819
   63   2HA   GLY  12          1HA       GLY  12  -0.435  13.498   1.049
   64    H    ARG  13           H        ARG  13  -0.679  10.172   2.259
   65    HA   ARG  13           HA       ARG  13  -2.647  10.996   4.214
   66   1HB   ARG  13          2HB       ARG  13  -4.344   9.382   3.445
   67   2HB   ARG  13          1HB       ARG  13  -4.038  10.622   2.236
   68   1HG   ARG  13          2HG       ARG  13  -2.288   8.723   1.449
   69   2HG   ARG  13          1HG       ARG  13  -3.567   7.723   2.136
   70   1HD   ARG  13          2HD       ARG  13  -3.954   9.864   0.054
   71   2HD   ARG  13          1HD       ARG  13  -3.849   8.139  -0.276
   72    HE   ARG  13           HE       ARG  13  -5.886   8.087   1.343
   73   1HH1  ARG  13          1HH1      ARG  13  -5.173  10.600  -1.008
   74   2HH1  ARG  13          2HH1      ARG  13  -6.850  10.900  -1.380
   75   1HH2  ARG  13          1HH2      ARG  13  -8.091   8.513   0.875
   76   2HH2  ARG  13          2HH2      ARG  13  -8.498   9.751  -0.278
   77    H    MET  14           H        MET  14  -2.565   9.744   5.992
   78    HA   MET  14           HA       MET  14  -0.520   7.664   6.013
   79   1HB   MET  14          2HB       MET  14  -0.389   9.391   7.739
   80   2HB   MET  14          1HB       MET  14  -2.014   8.997   8.284
   81   1HG   MET  14          2HG       MET  14  -1.216   6.728   8.860
   82   2HG   MET  14          1HG       MET  14   0.417   7.233   8.432
   83   1HE   MET  14          1HE       MET  14   1.764   9.146   9.746
   84   2HE   MET  14          2HE       MET  14   1.091  10.039  11.110
   85   3HE   MET  14          3HE       MET  14   0.420  10.260   9.495
   86    H    ILE  15           H        ILE  15  -1.171   5.671   5.575
   87    HA   ILE  15           HA       ILE  15  -3.923   4.913   6.185
   88    HB   ILE  15           HB       ILE  15  -1.827   3.413   4.608
   89   1HG1  ILE  15          2HG1      ILE  15  -4.192   5.053   3.661
   90   2HG1  ILE  15          1HG1      ILE  15  -2.507   5.547   3.553
   91   1HG2  ILE  15          1HG2      ILE  15  -3.705   2.041   3.847
   92   2HG2  ILE  15          2HG2      ILE  15  -4.794   2.941   4.902
   93   3HG2  ILE  15          3HG2      ILE  15  -3.511   1.949   5.598
   94   1HD1  ILE  15          1HD1      ILE  15  -2.056   3.693   2.039
   95   2HD1  ILE  15          2HD1      ILE  15  -3.339   4.734   1.421
   96   3HD1  ILE  15          3HD1      ILE  15  -3.740   3.181   2.157
   97    H    LEU  16           H        LEU  16  -4.366   3.889   7.989
   98    HA   LEU  16           HA       LEU  16  -2.342   2.753   9.664
   99   1HB   LEU  16          2HB       LEU  16  -4.712   3.830  10.212
  100   2HB   LEU  16          1HB       LEU  16  -5.249   2.172  10.045
  101    HG   LEU  16           HG       LEU  16  -4.867   2.708  12.381
  102   1HD1  LEU  16          1HD1      LEU  16  -3.328   0.920  12.993
  103   2HD1  LEU  16          2HD1      LEU  16  -2.741   0.850  11.330
  104   3HD1  LEU  16          3HD1      LEU  16  -4.414   0.422  11.696
  105   1HD2  LEU  16          1HD2      LEU  16  -3.236   4.489  12.067
  106   2HD2  LEU  16          2HD2      LEU  16  -2.027   3.304  11.571
  107   3HD2  LEU  16          3HD2      LEU  16  -2.657   3.286  13.219
  108    H    THR  17           H        THR  17  -1.383   0.943   8.989
  109    HA   THR  17           HA       THR  17  -2.912  -1.010   7.454
  110    HB   THR  17           HB       THR  17  -0.567  -2.000   7.078
  111    HG1  THR  17           HG1      THR  17   1.039  -0.174   7.379
  112   1HG2  THR  17          1HG2      THR  17  -1.784  -0.650   5.396
  113   2HG2  THR  17          2HG2      THR  17  -0.046  -0.375   5.333
  114   3HG2  THR  17          3HG2      THR  17  -1.098   0.816   6.094
  115    H    ASP  18           H        ASP  18  -3.252  -3.079   8.090
  116    HA   ASP  18           HA       ASP  18  -2.834  -4.017  10.719
  117   1HB   ASP  18          2HB       ASP  18  -4.461  -5.184   9.475
  118   2HB   ASP  18          1HB       ASP  18  -3.412  -5.336   8.073
  119    H    GLY  19           H        GLY  19  -1.095  -4.465   7.707
  120   1HA   GLY  19          2HA       GLY  19   1.392  -3.888   8.268
  121   2HA   GLY  19          1HA       GLY  19   1.277  -5.429   9.122
  122    H    LYS  20           H        LYS  20   3.134  -5.517   7.159
  123    HA   LYS  20           HA       LYS  20   3.628  -7.172   5.677
  124   1HB   LYS  20          2HB       LYS  20   0.746  -7.955   6.055
  125   2HB   LYS  20          1HB       LYS  20   1.885  -8.856   5.065
  126   1HG   LYS  20          2HG       LYS  20   3.319  -9.127   7.094
  127   2HG   LYS  20          1HG       LYS  20   2.018  -8.394   8.038
  128   1HD   LYS  20          2HD       LYS  20   0.503 -10.172   7.341
  129   2HD   LYS  20          1HD       LYS  20   1.783 -10.895   6.367
  130   1HE   LYS  20          2HE       LYS  20   3.119 -11.196   8.435
  131   2HE   LYS  20          1HE       LYS  20   1.757 -10.576   9.366
  132   1HZ   LYS  20          1HZ       LYS  20   1.711 -12.961   9.394
  133   2HZ   LYS  20          2HZ       LYS  20   1.787 -13.036   7.699
  134   3HZ   LYS  20          3HZ       LYS  20   0.407 -12.410   8.459
  135    HA   PRO  21           HA       PRO  21   2.010  -4.777   2.147
  136   1HB   PRO  21          2HB       PRO  21   4.368  -3.812   1.282
  137   2HB   PRO  21          1HB       PRO  21   3.446  -3.018   2.563
  138   1HG   PRO  21          2HG       PRO  21   5.866  -4.738   2.756
  139   2HG   PRO  21          1HG       PRO  21   5.401  -3.335   3.730
  140   1HD   PRO  21          2HD       PRO  21   5.101  -6.001   4.480
  141   2HD   PRO  21          1HD       PRO  21   4.261  -4.620   5.213
  142    H    GLU  22           H        GLU  22   1.505  -6.747   1.167
  143    HA   GLU  22           HA       GLU  22   3.588  -8.453   0.142
  144   1HB   GLU  22          2HB       GLU  22   0.613  -8.541  -0.406
  145   2HB   GLU  22          1HB       GLU  22   1.773  -9.832  -0.698
  146   1HG   GLU  22          2HG       GLU  22   2.161 -10.073   1.675
  147   2HG   GLU  22          1HG       GLU  22   1.096  -8.710   2.012
  148    H    ILE  23           H        ILE  23   4.744  -7.176  -1.242
  149    HA   ILE  23           HA       ILE  23   3.434  -5.648  -3.300
  150    HB   ILE  23           HB       ILE  23   6.386  -6.185  -2.938
  151   1HG1  ILE  23          2HG1      ILE  23   4.641  -3.932  -1.915
  152   2HG1  ILE  23          1HG1      ILE  23   5.494  -5.120  -0.949
  153   1HG2  ILE  23          1HG2      ILE  23   6.661  -4.143  -4.294
  154   2HG2  ILE  23          2HG2      ILE  23   4.914  -4.083  -4.526
  155   3HG2  ILE  23          3HG2      ILE  23   5.843  -5.431  -5.179
  156   1HD1  ILE  23          1HD1      ILE  23   6.623  -2.973  -0.918
  157   2HD1  ILE  23          2HD1      ILE  23   6.783  -3.024  -2.674
  158   3HD1  ILE  23          3HD1      ILE  23   7.628  -4.208  -1.677
  159    H    ASP  24           H        ASP  24   2.485  -6.843  -4.823
  160    HA   ASP  24           HA       ASP  24   3.672  -9.199  -5.943
  161   1HB   ASP  24          2HB       ASP  24   1.349  -7.503  -6.899
  162   2HB   ASP  24          1HB       ASP  24   1.812  -9.053  -7.592
  163    H    ASP  25           H        ASP  25   5.584  -8.854  -6.892
  164    HA   ASP  25           HA       ASP  25   6.172  -6.360  -8.183
  165   1HB   ASP  25          2HB       ASP  25   7.815  -7.585  -6.787
  166   2HB   ASP  25          1HB       ASP  25   7.859  -8.860  -7.999
  167    H    ASP  26           H        ASP  26   4.485  -8.928  -9.285
  168    HA   ASP  26           HA       ASP  26   5.536  -9.188 -11.918
  169   1HB   ASP  26          2HB       ASP  26   3.565 -10.373 -12.461
  170   2HB   ASP  26          1HB       ASP  26   3.834 -10.738 -10.761
  171    H    THR  27           H        THR  27   3.379  -7.001 -10.313
  172    HA   THR  27           HA       THR  27   3.199  -5.397 -12.771
  173    HB   THR  27           HB       THR  27   0.992  -6.118 -12.200
  174    HG1  THR  27           HG1      THR  27   1.698  -3.522 -12.078
  175   1HG2  THR  27          1HG2      THR  27   1.338  -6.783  -9.895
  176   2HG2  THR  27          2HG2      THR  27  -0.024  -5.667 -10.001
  177   3HG2  THR  27          3HG2      THR  27   1.539  -5.097  -9.417
  178    H    GLY  28           H        GLY  28   4.006  -5.480  -9.394
  179   1HA   GLY  28          2HA       GLY  28   5.547  -3.994  -8.399
  180   2HA   GLY  28          1HA       GLY  28   5.180  -2.811  -9.650
  181    H    LEU  29           H        LEU  29   2.662  -4.509  -7.947
  182    HA   LEU  29           HA       LEU  29   1.891  -1.963  -6.703
  183   1HB   LEU  29          2HB       LEU  29   0.164  -4.371  -7.284
  184   2HB   LEU  29          1HB       LEU  29  -0.384  -2.847  -6.615
  185    HG   LEU  29           HG       LEU  29   0.645  -3.338  -9.408
  186   1HD1  LEU  29          1HD1      LEU  29  -2.045  -2.474  -8.351
  187   2HD1  LEU  29          2HD1      LEU  29  -1.647  -4.047  -9.044
  188   3HD1  LEU  29          3HD1      LEU  29  -1.605  -2.603 -10.055
  189   1HD2  LEU  29          1HD2      LEU  29   1.465  -1.182  -8.586
  190   2HD2  LEU  29          2HD2      LEU  29  -0.180  -0.722  -8.146
  191   3HD2  LEU  29          3HD2      LEU  29   0.242  -0.978  -9.839
  192    H    VAL  30           H        VAL  30   1.130  -1.955  -4.564
  193    HA   VAL  30           HA       VAL  30   2.354  -4.075  -2.935
  194    HB   VAL  30           HB       VAL  30   1.545  -1.280  -2.112
  195   1HG1  VAL  30          1HG1      VAL  30   3.153  -3.377  -0.656
  196   2HG1  VAL  30          2HG1      VAL  30   1.517  -2.859  -0.254
  197   3HG1  VAL  30          3HG1      VAL  30   2.863  -1.731  -0.092
  198   1HG2  VAL  30          1HG2      VAL  30   4.260  -2.404  -2.788
  199   2HG2  VAL  30          2HG2      VAL  30   3.970  -0.818  -2.078
  200   3HG2  VAL  30          3HG2      VAL  30   3.370  -1.181  -3.696
  201    H    SER  31           H        SER  31   0.839  -5.580  -2.534
  202    HA   SER  31           HA       SER  31  -1.887  -4.842  -1.920
  203   1HB   SER  31          2HB       SER  31  -0.536  -7.551  -1.780
  204   2HB   SER  31          1HB       SER  31  -2.272  -7.246  -1.734
  205    HG   SER  31           HG       SER  31  -0.721  -7.586  -3.874
  206    H    TYR  32           H        TYR  32  -1.952  -3.736  -0.046
  207    HA   TYR  32           HA       TYR  32  -0.568  -4.839   2.300
  208   1HB   TYR  32          2HB       TYR  32  -0.734  -2.655   3.287
  209   2HB   TYR  32          1HB       TYR  32  -0.152  -2.439   1.641
  210    HD1  TYR  32           HD1      TYR  32  -1.949  -1.864  -0.152
  211    HD2  TYR  32           HD2      TYR  32  -2.578  -1.458   4.033
  212    HE1  TYR  32           HE1      TYR  32  -3.805  -0.306  -0.584
  213    HE2  TYR  32           HE2      TYR  32  -4.423   0.107   3.610
  214    HH   TYR  32           HH       TYR  32  -5.354   1.453   2.016
  215    H    HIS  33           H        HIS  33  -1.884  -4.260   4.419
  216    HA   HIS  33           HA       HIS  33  -4.675  -5.094   3.952
  217   1HB   HIS  33          2HB       HIS  33  -3.102  -5.726   6.455
  218   2HB   HIS  33          1HB       HIS  33  -4.636  -6.411   5.944
  219    HD1  HIS  33           HD1      HIS  33  -1.779  -7.841   6.620
  220    HD2  HIS  33           HD2      HIS  33  -3.621  -7.396   2.919
  221    HE1  HIS  33           HE1      HIS  33  -0.802  -9.637   5.155
  222    HE2  HIS  33           HE2      HIS  33  -1.781  -9.227   2.868
  223    H    ASP  34           H        ASP  34  -6.180  -3.760   4.726
  224    HA   ASP  34           HA       ASP  34  -5.520  -1.316   6.037
  225   1HB   ASP  34          2HB       ASP  34  -8.213  -2.683   5.834
  226   2HB   ASP  34          1HB       ASP  34  -7.946  -1.010   6.289
  227    H    GLN  35           H        GLN  35  -6.216  -0.652   8.180
  228    HA   GLN  35           HA       GLN  35  -6.291  -2.594  10.254
  229   1HB   GLN  35          2HB       GLN  35  -7.041  -0.773  11.686
  230   2HB   GLN  35          1HB       GLN  35  -5.763  -0.187  10.630
  231   1HG   GLN  35          2HG       GLN  35  -7.428   0.834   9.170
  232   2HG   GLN  35          1HG       GLN  35  -8.715   0.244  10.217
  233   1HE2  GLN  35          1HE2      GLN  35  -8.098   2.958   9.475
  234   2HE2  GLN  35          2HE2      GLN  35  -7.759   3.815  10.940
  235    H    GLN  36           H        GLN  36  -8.487  -1.434   7.957
  236    HA   GLN  36           HA       GLN  36 -10.946  -2.116   9.201
  237   1HB   GLN  36          2HB       GLN  36 -10.702  -0.463   7.371
  238   2HB   GLN  36          1HB       GLN  36 -10.255  -1.761   6.277
  239   1HG   GLN  36          2HG       GLN  36 -12.440  -2.720   6.426
  240   2HG   GLN  36          1HG       GLN  36 -12.901  -1.580   7.693
  241   1HE2  GLN  36          1HE2      GLN  36 -10.972  -0.629   4.947
  242   2HE2  GLN  36          2HE2      GLN  36 -12.180   0.351   4.191
  243    H    GLY  37           H        GLY  37  -8.547  -3.833   7.335
  244   1HA   GLY  37          2HA       GLY  37  -8.310  -6.181   7.739
  245   2HA   GLY  37          1HA       GLY  37 -10.054  -6.286   7.908
  246    H    ASN  38           H        ASN  38  -8.880  -4.434   5.226
  247    HA   ASN  38           HA       ASN  38  -9.520  -6.707   3.451
  248   1HB   ASN  38          2HB       ASN  38  -9.326  -3.870   2.468
  249   2HB   ASN  38          1HB       ASN  38 -10.197  -5.226   1.767
  250   1HD2  ASN  38          1HD2      ASN  38 -10.281  -2.586   3.908
  251   2HD2  ASN  38          2HD2      ASN  38 -11.945  -2.745   4.388
  252    H    ALA  39           H        ALA  39  -8.217  -6.961   1.520
  253    HA   ALA  39           HA       ALA  39  -5.483  -5.917   1.842
  254   1HB   ALA  39          1HB       ALA  39  -5.665  -8.362   1.813
  255   2HB   ALA  39          2HB       ALA  39  -4.763  -7.762   0.420
  256   3HB   ALA  39          3HB       ALA  39  -6.438  -8.283   0.230
  257    H    MET  40           H        MET  40  -5.294  -4.076   0.730
  258    HA   MET  40           HA       MET  40  -6.497  -3.970  -1.957
  259   1HB   MET  40          2HB       MET  40  -5.927  -1.687  -0.052
  260   2HB   MET  40          1HB       MET  40  -6.484  -1.486  -1.710
  261   1HG   MET  40          2HG       MET  40  -8.421  -3.000  -1.010
  262   2HG   MET  40          1HG       MET  40  -7.935  -2.638   0.637
  263   1HE   MET  40          1HE       MET  40  -7.104   0.293   0.752
  264   2HE   MET  40          2HE       MET  40  -8.322  -0.383   1.834
  265   3HE   MET  40          3HE       MET  40  -8.632   1.137   0.995
  266    H    GLN  41           H        GLN  41  -5.289  -2.630  -3.546
  267    HA   GLN  41           HA       GLN  41  -2.404  -3.098  -3.134
  268   1HB   GLN  41          2HB       GLN  41  -3.881  -3.150  -5.767
  269   2HB   GLN  41          1HB       GLN  41  -2.200  -3.582  -5.489
  270   1HG   GLN  41          2HG       GLN  41  -2.969  -5.462  -4.074
  271   2HG   GLN  41          1HG       GLN  41  -4.630  -5.063  -4.513
  272   1HE2  GLN  41          1HE2      GLN  41  -1.638  -6.425  -5.556
  273   2HE2  GLN  41          2HE2      GLN  41  -2.205  -7.067  -7.063
  274    H    ILE  42           H        ILE  42  -1.315  -1.244  -2.935
  275    HA   ILE  42           HA       ILE  42  -2.187   1.048  -4.563
  276    HB   ILE  42           HB       ILE  42  -0.910   2.508  -3.191
  277   1HG1  ILE  42          2HG1      ILE  42   0.057   0.330  -1.381
  278   2HG1  ILE  42          1HG1      ILE  42   0.939   0.651  -2.871
  279   1HG2  ILE  42          1HG2      ILE  42  -1.894   2.164  -0.963
  280   2HG2  ILE  42          2HG2      ILE  42  -2.353   0.529  -1.438
  281   3HG2  ILE  42          3HG2      ILE  42  -3.060   1.919  -2.265
  282   1HD1  ILE  42          1HD1      ILE  42   0.318   2.707  -0.772
  283   2HD1  ILE  42          2HD1      ILE  42   1.313   2.923  -2.215
  284   3HD1  ILE  42          3HD1      ILE  42   1.845   1.839  -0.926
  285    H    ASN  43           H        ASN  43  -0.041   2.435  -5.090
  286    HA   ASN  43           HA       ASN  43   1.515   0.673  -6.802
  287   1HB   ASN  43          2HB       ASN  43   0.552   2.778  -7.676
  288   2HB   ASN  43          1HB       ASN  43   1.533   3.685  -6.538
  289   1HD2  ASN  43          1HD2      ASN  43   2.547   4.801  -8.157
  290   2HD2  ASN  43          2HD2      ASN  43   3.746   4.078  -9.182
  291    H    ARG  44           H        ARG  44   3.759   0.387  -6.637
  292    HA   ARG  44           HA       ARG  44   4.825   0.592  -4.009
  293   1HB   ARG  44          2HB       ARG  44   5.440  -1.186  -5.653
  294   2HB   ARG  44          1HB       ARG  44   6.351   0.023  -6.552
  295   1HG   ARG  44          2HG       ARG  44   7.829   0.366  -4.677
  296   2HG   ARG  44          1HG       ARG  44   6.874  -0.737  -3.686
  297   1HD   ARG  44          2HD       ARG  44   8.819  -1.899  -4.471
  298   2HD   ARG  44          1HD       ARG  44   7.402  -2.550  -5.293
  299    HE   ARG  44           HE       ARG  44   8.860  -0.457  -6.691
  300   1HH1  ARG  44          1HH1      ARG  44   8.305  -3.888  -6.269
  301   2HH1  ARG  44          2HH1      ARG  44   8.980  -4.329  -7.807
  302   1HH2  ARG  44          1HH2      ARG  44   9.758  -1.014  -8.703
  303   2HH2  ARG  44          2HH2      ARG  44   9.853  -2.688  -9.183
  304    H    ASP  45           H        ASP  45   5.146   2.528  -6.913
  305    HA   ASP  45           HA       ASP  45   7.221   4.222  -5.934
  306   1HB   ASP  45          2HB       ASP  45   6.843   4.141  -8.303
  307   2HB   ASP  45          1HB       ASP  45   5.151   4.582  -8.108
  308    H    ASP  46           H        ASP  46   3.882   3.948  -5.330
  309    HA   ASP  46           HA       ASP  46   3.559   6.667  -4.373
  310   1HB   ASP  46          2HB       ASP  46   1.718   4.315  -4.666
  311   2HB   ASP  46          1HB       ASP  46   1.260   5.677  -3.651
  312    H    VAL  47           H        VAL  47   4.917   3.921  -3.129
  313    HA   VAL  47           HA       VAL  47   3.956   4.194  -0.420
  314    HB   VAL  47           HB       VAL  47   6.445   2.708  -1.278
  315   1HG1  VAL  47          1HG1      VAL  47   6.095   3.103   1.139
  316   2HG1  VAL  47          2HG1      VAL  47   6.068   1.392   0.702
  317   3HG1  VAL  47          3HG1      VAL  47   4.556   2.245   1.023
  318   1HG2  VAL  47          1HG2      VAL  47   4.588   1.923  -2.651
  319   2HG2  VAL  47          2HG2      VAL  47   3.617   1.669  -1.202
  320   3HG2  VAL  47          3HG2      VAL  47   5.063   0.698  -1.475
  321    H    SER  48           H        SER  48   4.459   6.046   0.573
  322    HA   SER  48           HA       SER  48   7.006   7.337  -0.000
  323   1HB   SER  48          2HB       SER  48   4.988   8.704  -0.120
  324   2HB   SER  48          1HB       SER  48   4.584   8.297   1.544
  325    HG   SER  48           HG       SER  48   7.103   9.298   1.352
  326    H    GLN  49           H        GLN  49   5.281   5.803   2.647
  327    HA   GLN  49           HA       GLN  49   7.789   5.523   4.058
  328   1HB   GLN  49          2HB       GLN  49   7.050   7.635   4.974
  329   2HB   GLN  49          1HB       GLN  49   5.442   6.995   5.274
  330   1HG   GLN  49          2HG       GLN  49   7.644   5.543   6.575
  331   2HG   GLN  49          1HG       GLN  49   7.375   7.191   7.140
  332   1HE2  GLN  49          1HE2      GLN  49   6.799   6.188   9.157
  333   2HE2  GLN  49          2HE2      GLN  49   5.218   5.527   9.382
  334    H    ILE  50           H        ILE  50   7.803   3.835   5.525
  335    HA   ILE  50           HA       ILE  50   5.522   2.541   6.508
  336    HB   ILE  50           HB       ILE  50   5.272   1.733   4.193
  337   1HG1  ILE  50          2HG1      ILE  50   6.178  -0.478   6.047
  338   2HG1  ILE  50          1HG1      ILE  50   4.614   0.320   6.141
  339   1HG2  ILE  50          1HG2      ILE  50   6.908   0.233   3.190
  340   2HG2  ILE  50          2HG2      ILE  50   7.972   0.447   4.580
  341   3HG2  ILE  50          3HG2      ILE  50   7.621   1.812   3.521
  342   1HD1  ILE  50          1HD1      ILE  50   4.070  -0.483   3.906
  343   2HD1  ILE  50          2HD1      ILE  50   4.443  -1.808   5.009
  344   3HD1  ILE  50          3HD1      ILE  50   5.636  -1.288   3.818
  345    H    ILE  51           H        ILE  51   8.898   2.436   5.637
  346    HA   ILE  51           HA       ILE  51  10.776   1.964   6.784
  347    HB   ILE  51           HB       ILE  51   8.974   1.860   9.210
  348   1HG1  ILE  51          2HG1      ILE  51  10.707   4.081   8.085
  349   2HG1  ILE  51          1HG1      ILE  51   8.945   4.035   8.063
  350   1HG2  ILE  51          1HG2      ILE  51  11.062   2.223  10.482
  351   2HG2  ILE  51          2HG2      ILE  51  11.980   2.025   8.988
  352   3HG2  ILE  51          3HG2      ILE  51  11.044   0.678   9.632
  353   1HD1  ILE  51          1HD1      ILE  51  10.680   4.162  10.520
  354   2HD1  ILE  51          2HD1      ILE  51   8.916   4.124  10.499
  355   3HD1  ILE  51          3HD1      ILE  51   9.776   5.501   9.811
  356    H    GLU  52           H        GLU  52  11.418   0.087   5.961
  357    HA   GLU  52           HA       GLU  52  10.293  -2.384   7.053
  358   1HB   GLU  52          2HB       GLU  52  10.426  -2.116   4.563
  359   2HB   GLU  52          1HB       GLU  52  12.180  -2.085   4.713
  360   1HG   GLU  52          2HG       GLU  52  11.951  -4.339   5.876
  361   2HG   GLU  52          1HG       GLU  52  10.299  -4.351   5.262
  362    H    ARG  53           H        ARG  53  11.382  -2.017   9.072
  363    HA   ARG  53           HA       ARG  53  13.963  -3.324   9.062
  364   1HB   ARG  53          2HB       ARG  53  14.136  -0.668   8.999
  365   2HB   ARG  53          1HB       ARG  53  13.819  -0.840  10.719
  366   1HG   ARG  53          2HG       ARG  53  16.035  -2.296   9.299
  367   2HG   ARG  53          1HG       ARG  53  16.236  -0.712  10.050
  368   1HD   ARG  53          2HD       ARG  53  15.268  -3.165  11.512
  369   2HD   ARG  53          1HD       ARG  53  16.953  -2.647  11.464
  370    HE   ARG  53           HE       ARG  53  15.382  -0.485  12.318
  371   1HH1  ARG  53          1HH1      ARG  53  16.342  -3.667  13.429
  372   2HH1  ARG  53          2HH1      ARG  53  16.365  -3.211  15.113
  373   1HH2  ARG  53          1HH2      ARG  53  15.336   0.102  14.516
  374   2HH2  ARG  53          2HH2      ARG  53  15.796  -1.055  15.729
  Start of MODEL    4
    1    H    ASP   4           H        ASP   4   2.028   1.571  15.917
    2    HA   ASP   4           HA       ASP   4   3.512   3.574  14.364
    3   1HB   ASP   4          2HB       ASP   4   4.479   0.948  15.512
    4   2HB   ASP   4          1HB       ASP   4   5.476   2.168  14.725
    5    H    TYR   5           H        TYR   5   1.218   1.714  13.573
    6    HA   TYR   5           HA       TYR   5   2.526   0.427  11.280
    7   1HB   TYR   5          2HB       TYR   5  -0.321   0.025  12.216
    8   2HB   TYR   5          1HB       TYR   5   0.580  -0.965  11.073
    9    HD1  TYR   5           HD1      TYR   5   2.821  -1.996  12.063
   10    HD2  TYR   5           HD2      TYR   5  -0.512  -0.732  14.384
   11    HE1  TYR   5           HE1      TYR   5   3.565  -3.442  13.907
   12    HE2  TYR   5           HE2      TYR   5   0.221  -2.172  16.237
   13    HH   TYR   5           HH       TYR   5   1.626  -4.252  16.521
   14    H    VAL   6           H        VAL   6   2.721   2.055   9.789
   15    HA   VAL   6           HA       VAL   6   0.314   3.395   8.888
   16    HB   VAL   6           HB       VAL   6   1.522   5.657   9.014
   17   1HG1  VAL   6          1HG1      VAL   6   0.735   6.074  11.313
   18   2HG1  VAL   6          2HG1      VAL   6   0.531   4.335  11.533
   19   3HG1  VAL   6          3HG1      VAL   6  -0.440   5.194  10.336
   20   1HG2  VAL   6          1HG2      VAL   6   3.096   4.172  11.119
   21   2HG2  VAL   6          2HG2      VAL   6   3.096   5.919  10.884
   22   3HG2  VAL   6          3HG2      VAL   6   3.735   4.862   9.626
   23    H    MET   7           H        MET   7   0.427   2.888   6.813
   24    HA   MET   7           HA       MET   7   2.869   2.864   5.317
   25   1HB   MET   7          2HB       MET   7   1.040   1.427   4.629
   26   2HB   MET   7          1HB       MET   7  -0.026   2.814   4.436
   27   1HG   MET   7          2HG       MET   7   1.380   3.636   2.613
   28   2HG   MET   7          1HG       MET   7   2.437   2.240   2.802
   29   1HE   MET   7          1HE       MET   7  -1.211   3.426   1.890
   30   2HE   MET   7          2HE       MET   7  -1.489   2.214   3.141
   31   3HE   MET   7          3HE       MET   7  -1.977   1.893   1.477
   32    H    ALA   8           H        ALA   8   3.888   4.790   5.254
   33    HA   ALA   8           HA       ALA   8   2.548   7.271   4.760
   34   1HB   ALA   8          1HB       ALA   8   5.476   6.594   4.460
   35   2HB   ALA   8          2HB       ALA   8   4.707   7.161   5.943
   36   3HB   ALA   8          3HB       ALA   8   4.781   8.213   4.529
   37    H    THR   9           H        THR   9   1.819   7.968   2.854
   38    HA   THR   9           HA       THR   9   2.599   6.413   0.490
   39    HB   THR   9           HB       THR   9   0.465   7.293  -0.483
   40    HG1  THR   9           HG1      THR   9  -0.215   7.979   2.190
   41   1HG2  THR   9          1HG2      THR   9   0.209   5.715   2.081
   42   2HG2  THR   9          2HG2      THR   9   0.592   5.045   0.495
   43   3HG2  THR   9          3HG2      THR   9  -0.987   5.777   0.785
   44    H    LYS  10           H        LYS  10   2.288   7.634  -1.600
   45    HA   LYS  10           HA       LYS  10   4.098   9.696  -1.948
   46   1HB   LYS  10          2HB       LYS  10   3.278   8.322  -3.775
   47   2HB   LYS  10          1HB       LYS  10   1.650   8.943  -3.555
   48   1HG   LYS  10          2HG       LYS  10   2.306  11.109  -4.332
   49   2HG   LYS  10          1HG       LYS  10   4.003  10.623  -4.386
   50   1HD   LYS  10          2HD       LYS  10   2.971  10.592  -6.617
   51   2HD   LYS  10          1HD       LYS  10   3.492   8.980  -6.116
   52   1HE   LYS  10          2HE       LYS  10   1.181   8.493  -5.394
   53   2HE   LYS  10          1HE       LYS  10   0.685  10.076  -5.989
   54   1HZ   LYS  10          1HZ       LYS  10   1.862   7.918  -7.656
   55   2HZ   LYS  10          2HZ       LYS  10   1.315   9.422  -8.212
   56   3HZ   LYS  10          3HZ       LYS  10   0.214   8.303  -7.572
   57    H    ASP  11           H        ASP  11   0.655   9.820  -1.288
   58    HA   ASP  11           HA       ASP  11   0.273  12.581  -1.765
   59   1HB   ASP  11          2HB       ASP  11  -1.544  10.887  -1.724
   60   2HB   ASP  11          1HB       ASP  11  -1.333  10.735   0.016
   61    H    GLY  12           H        GLY  12   1.727  10.877   0.796
   62   1HA   GLY  12          2HA       GLY  12   3.012  11.910   2.470
   63   2HA   GLY  12          1HA       GLY  12   2.058  13.372   2.268
   64    H    ARG  13           H        ARG  13  -0.062  10.857   2.353
   65    HA   ARG  13           HA       ARG  13  -0.676  11.446   5.146
   66   1HB   ARG  13          2HB       ARG  13  -2.895  10.520   4.683
   67   2HB   ARG  13          1HB       ARG  13  -2.484  11.807   3.560
   68   1HG   ARG  13          2HG       ARG  13  -1.836  10.023   1.913
   69   2HG   ARG  13          1HG       ARG  13  -2.533   8.848   3.030
   70   1HD   ARG  13          2HD       ARG  13  -3.997  11.183   1.801
   71   2HD   ARG  13          1HD       ARG  13  -4.112   9.510   1.263
   72    HE   ARG  13           HE       ARG  13  -5.318   8.982   3.216
   73   1HH1  ARG  13          1HH1      ARG  13  -4.501  12.399   3.060
   74   2HH1  ARG  13          2HH1      ARG  13  -5.734  12.861   4.189
   75   1HH2  ARG  13          1HH2      ARG  13  -6.941   9.613   4.686
   76   2HH2  ARG  13          2HH2      ARG  13  -7.120  11.292   5.112
   77    H    MET  14           H        MET  14  -0.884   9.929   6.702
   78    HA   MET  14           HA       MET  14   0.412   7.375   6.156
   79   1HB   MET  14          2HB       MET  14  -0.208   8.906   8.666
   80   2HB   MET  14          1HB       MET  14   0.177   7.194   8.740
   81   1HG   MET  14          2HG       MET  14   2.151   8.440   9.185
   82   2HG   MET  14          1HG       MET  14   2.319   7.670   7.610
   83   1HE   MET  14          1HE       MET  14   4.217  10.004   8.620
   84   2HE   MET  14          2HE       MET  14   4.318  11.017   7.180
   85   3HE   MET  14          3HE       MET  14   4.373   9.261   7.028
   86    H    ILE  15           H        ILE  15  -0.897   5.801   5.518
   87    HA   ILE  15           HA       ILE  15  -3.601   5.636   6.600
   88    HB   ILE  15           HB       ILE  15  -2.208   3.918   4.534
   89   1HG1  ILE  15          2HG1      ILE  15  -4.339   6.052   4.235
   90   2HG1  ILE  15          1HG1      ILE  15  -2.641   6.239   3.809
   91   1HG2  ILE  15          1HG2      ILE  15  -3.906   2.639   5.713
   92   2HG2  ILE  15          2HG2      ILE  15  -4.442   2.998   4.071
   93   3HG2  ILE  15          3HG2      ILE  15  -5.090   3.917   5.431
   94   1HD1  ILE  15          1HD1      ILE  15  -4.580   4.322   2.533
   95   2HD1  ILE  15          2HD1      ILE  15  -2.882   4.519   2.099
   96   3HD1  ILE  15          3HD1      ILE  15  -4.016   5.847   1.848
   97    H    LEU  16           H        LEU  16  -4.120   4.302   8.242
   98    HA   LEU  16           HA       LEU  16  -2.033   3.088   9.739
   99   1HB   LEU  16          2HB       LEU  16  -4.476   4.031  10.355
  100   2HB   LEU  16          1HB       LEU  16  -4.859   2.325  10.237
  101    HG   LEU  16           HG       LEU  16  -4.416   2.987  12.542
  102   1HD1  LEU  16          1HD1      LEU  16  -2.760   1.293  13.114
  103   2HD1  LEU  16          2HD1      LEU  16  -2.249   1.216  11.428
  104   3HD1  LEU  16          3HD1      LEU  16  -3.876   0.706  11.879
  105   1HD2  LEU  16          1HD2      LEU  16  -1.683   3.743  11.519
  106   2HD2  LEU  16          2HD2      LEU  16  -2.148   3.662  13.219
  107   3HD2  LEU  16          3HD2      LEU  16  -2.914   4.838  12.152
  108    H    THR  17           H        THR  17  -1.078   1.222   9.207
  109    HA   THR  17           HA       THR  17  -2.663  -0.761   7.721
  110    HB   THR  17           HB       THR  17  -0.320  -1.260   6.646
  111    HG1  THR  17           HG1      THR  17   1.139   0.202   7.125
  112   1HG2  THR  17          1HG2      THR  17  -0.876   0.271   4.796
  113   2HG2  THR  17          2HG2      THR  17  -2.028   1.102   5.843
  114   3HG2  THR  17          3HG2      THR  17  -2.304  -0.580   5.392
  115    H    ASP  18           H        ASP  18  -2.875  -1.714   9.978
  116    HA   ASP  18           HA       ASP  18  -0.619  -3.516  10.466
  117   1HB   ASP  18          2HB       ASP  18  -1.819  -2.763  12.474
  118   2HB   ASP  18          1HB       ASP  18  -3.333  -3.389  11.820
  119    H    GLY  19           H        GLY  19  -0.539  -5.517   9.498
  120   1HA   GLY  19          2HA       GLY  19  -1.736  -7.265   8.204
  121   2HA   GLY  19          1HA       GLY  19  -2.836  -5.991   7.665
  122    H    LYS  20           H        LYS  20  -1.754  -4.123   6.345
  123    HA   LYS  20           HA       LYS  20   0.162  -2.948   5.968
  124   1HB   LYS  20          2HB       LYS  20   0.955  -3.967   8.030
  125   2HB   LYS  20          1HB       LYS  20   1.525  -5.366   7.145
  126   1HG   LYS  20          2HG       LYS  20   2.603  -2.624   6.589
  127   2HG   LYS  20          1HG       LYS  20   3.230  -3.613   7.906
  128   1HD   LYS  20          2HD       LYS  20   3.250  -4.230   4.956
  129   2HD   LYS  20          1HD       LYS  20   4.638  -3.958   6.013
  130   1HE   LYS  20          2HE       LYS  20   4.293  -6.009   7.141
  131   2HE   LYS  20          1HE       LYS  20   2.695  -6.214   6.423
  132   1HZ   LYS  20          1HZ       LYS  20   5.345  -6.540   5.158
  133   2HZ   LYS  20          2HZ       LYS  20   3.959  -6.249   4.223
  134   3HZ   LYS  20          3HZ       LYS  20   4.040  -7.626   5.209
  135    HA   PRO  21           HA       PRO  21   0.930  -3.558   1.770
  136   1HB   PRO  21          2HB       PRO  21   3.484  -2.199   2.523
  137   2HB   PRO  21          1HB       PRO  21   2.391  -1.865   1.174
  138   1HG   PRO  21          2HG       PRO  21   2.300  -0.336   3.317
  139   2HG   PRO  21          1HG       PRO  21   0.794  -0.874   2.550
  140   1HD   PRO  21          2HD       PRO  21   2.080  -1.818   5.064
  141   2HD   PRO  21          1HD       PRO  21   0.358  -1.658   4.665
  142    H    GLU  22           H        GLU  22   1.539  -5.287   0.732
  143    HA   GLU  22           HA       GLU  22   4.256  -6.355   1.165
  144   1HB   GLU  22          2HB       GLU  22   2.007  -7.804   1.398
  145   2HB   GLU  22          1HB       GLU  22   2.179  -7.875  -0.345
  146   1HG   GLU  22          2HG       GLU  22   4.438  -8.791  -0.075
  147   2HG   GLU  22          1HG       GLU  22   4.210  -8.786   1.675
  148    H    ILE  23           H        ILE  23   5.586  -5.598  -0.412
  149    HA   ILE  23           HA       ILE  23   4.514  -4.342  -2.733
  150    HB   ILE  23           HB       ILE  23   7.398  -5.067  -2.187
  151   1HG1  ILE  23          2HG1      ILE  23   5.855  -2.518  -1.632
  152   2HG1  ILE  23          1HG1      ILE  23   6.497  -3.624  -0.423
  153   1HG2  ILE  23          1HG2      ILE  23   7.886  -3.283  -3.819
  154   2HG2  ILE  23          2HG2      ILE  23   6.157  -3.119  -4.131
  155   3HG2  ILE  23          3HG2      ILE  23   6.988  -4.621  -4.536
  156   1HD1  ILE  23          1HD1      ILE  23   8.128  -1.998  -2.359
  157   2HD1  ILE  23          2HD1      ILE  23   8.764  -3.091  -1.130
  158   3HD1  ILE  23          3HD1      ILE  23   7.885  -1.640  -0.649
  159    H    ASP  24           H        ASP  24   3.599  -5.500  -4.260
  160    HA   ASP  24           HA       ASP  24   4.556  -8.117  -5.036
  161   1HB   ASP  24          2HB       ASP  24   2.091  -7.062  -5.030
  162   2HB   ASP  24          1HB       ASP  24   2.559  -6.594  -6.660
  163    H    ASP  25           H        ASP  25   6.593  -7.850  -5.900
  164    HA   ASP  25           HA       ASP  25   7.233  -5.372  -7.213
  165   1HB   ASP  25          2HB       ASP  25   8.624  -6.734  -5.480
  166   2HB   ASP  25          1HB       ASP  25   9.164  -7.641  -6.887
  167    H    ASP  26           H        ASP  26   6.257  -8.440  -8.292
  168    HA   ASP  26           HA       ASP  26   7.659  -8.181 -10.845
  169   1HB   ASP  26          2HB       ASP  26   5.989 -10.344  -9.595
  170   2HB   ASP  26          1HB       ASP  26   6.312 -10.350 -11.324
  171    H    THR  27           H        THR  27   5.049  -6.945  -9.440
  172    HA   THR  27           HA       THR  27   3.402  -7.020 -11.874
  173    HB   THR  27           HB       THR  27   2.169  -6.484  -9.213
  174    HG1  THR  27           HG1      THR  27   2.175  -8.657  -8.682
  175   1HG2  THR  27          1HG2      THR  27   0.848  -6.453 -11.290
  176   2HG2  THR  27          2HG2      THR  27   0.331  -7.743 -10.202
  177   3HG2  THR  27          3HG2      THR  27   1.334  -8.120 -11.604
  178    H    GLY  28           H        GLY  28   4.587  -5.079  -9.178
  179   1HA   GLY  28          2HA       GLY  28   5.163  -2.781  -9.424
  180   2HA   GLY  28          1HA       GLY  28   4.003  -2.662 -10.742
  181    H    LEU  29           H        LEU  29   2.851  -4.418  -8.102
  182    HA   LEU  29           HA       LEU  29   1.347  -2.077  -7.139
  183   1HB   LEU  29          2HB       LEU  29   0.444  -4.928  -7.522
  184   2HB   LEU  29          1HB       LEU  29  -0.437  -3.789  -6.524
  185    HG   LEU  29           HG       LEU  29  -0.547  -2.313  -8.627
  186   1HD1  LEU  29          1HD1      LEU  29   0.086  -4.955  -9.929
  187   2HD1  LEU  29          2HD1      LEU  29   1.116  -3.524  -9.942
  188   3HD1  LEU  29          3HD1      LEU  29  -0.450  -3.489 -10.750
  189   1HD2  LEU  29          1HD2      LEU  29  -2.457  -3.452  -7.647
  190   2HD2  LEU  29          2HD2      LEU  29  -2.041  -4.925  -8.522
  191   3HD2  LEU  29          3HD2      LEU  29  -2.539  -3.483  -9.409
  192    H    VAL  30           H        VAL  30   0.384  -2.555  -4.904
  193    HA   VAL  30           HA       VAL  30   2.210  -4.162  -3.258
  194    HB   VAL  30           HB       VAL  30   1.353  -1.340  -2.580
  195   1HG1  VAL  30          1HG1      VAL  30   1.533  -2.739  -0.611
  196   2HG1  VAL  30          2HG1      VAL  30   2.861  -1.579  -0.666
  197   3HG1  VAL  30          3HG1      VAL  30   3.144  -3.262  -1.112
  198   1HG2  VAL  30          1HG2      VAL  30   4.062  -2.405  -3.361
  199   2HG2  VAL  30          2HG2      VAL  30   3.745  -0.778  -2.763
  200   3HG2  VAL  30          3HG2      VAL  30   3.060  -1.300  -4.303
  201    H    SER  31           H        SER  31   1.003  -5.591  -2.188
  202    HA   SER  31           HA       SER  31  -1.845  -5.181  -1.900
  203   1HB   SER  31          2HB       SER  31  -1.663  -7.517  -0.828
  204   2HB   SER  31          1HB       SER  31  -1.261  -7.377  -2.534
  205    HG   SER  31           HG       SER  31   0.316  -8.583  -1.470
  206    H    TYR  32           H        TYR  32  -2.493  -3.883  -0.276
  207    HA   TYR  32           HA       TYR  32  -1.188  -4.268   2.335
  208   1HB   TYR  32          2HB       TYR  32  -1.449  -2.024   2.867
  209   2HB   TYR  32          1HB       TYR  32  -1.084  -1.947   1.150
  210    HD1  TYR  32           HD1      TYR  32  -3.208  -1.887  -0.437
  211    HD2  TYR  32           HD2      TYR  32  -3.238  -0.850   3.694
  212    HE1  TYR  32           HE1      TYR  32  -5.240  -0.542  -0.793
  213    HE2  TYR  32           HE2      TYR  32  -5.265   0.494   3.348
  214    HH   TYR  32           HH       TYR  32  -6.489   1.562   1.680
  215    H    HIS  33           H        HIS  33  -2.551  -4.143   4.204
  216    HA   HIS  33           HA       HIS  33  -5.299  -5.017   3.603
  217   1HB   HIS  33          2HB       HIS  33  -3.515  -5.845   5.916
  218   2HB   HIS  33          1HB       HIS  33  -5.194  -6.333   5.714
  219    HD1  HIS  33           HD1      HIS  33  -2.849  -8.396   5.857
  220    HD2  HIS  33           HD2      HIS  33  -4.530  -6.913   2.347
  221    HE1  HIS  33           HE1      HIS  33  -2.345 -10.104   4.080
  222    HE2  HIS  33           HE2      HIS  33  -3.315  -9.158   1.952
  223    H    ASP  34           H        ASP  34  -6.876  -3.842   4.397
  224    HA   ASP  34           HA       ASP  34  -6.410  -1.381   5.692
  225   1HB   ASP  34          2HB       ASP  34  -8.661  -2.763   4.564
  226   2HB   ASP  34          1HB       ASP  34  -9.108  -2.063   6.115
  227    H    GLN  35           H        GLN  35  -7.744  -0.712   7.583
  228    HA   GLN  35           HA       GLN  35  -6.988  -2.112   9.934
  229   1HB   GLN  35          2HB       GLN  35  -9.064   0.063   9.603
  230   2HB   GLN  35          1HB       GLN  35  -8.271  -0.399  11.103
  231   1HG   GLN  35          2HG       GLN  35  -6.183   0.445  10.349
  232   2HG   GLN  35          1HG       GLN  35  -6.801   0.677   8.714
  233   1HE2  GLN  35          1HE2      GLN  35  -8.124   2.427   8.274
  234   2HE2  GLN  35          2HE2      GLN  35  -8.304   3.754   9.369
  235    H    GLN  36           H        GLN  36  -9.451  -2.623   7.732
  236    HA   GLN  36           HA       GLN  36 -11.117  -4.022   9.719
  237   1HB   GLN  36          2HB       GLN  36 -11.889  -2.843   7.039
  238   2HB   GLN  36          1HB       GLN  36 -12.957  -3.815   8.044
  239   1HG   GLN  36          2HG       GLN  36 -11.715  -1.207   8.885
  240   2HG   GLN  36          1HG       GLN  36 -13.350  -1.389   8.251
  241   1HE2  GLN  36          1HE2      GLN  36 -11.234  -2.032  10.949
  242   2HE2  GLN  36          2HE2      GLN  36 -12.480  -2.423  12.090
  243    H    GLY  37           H        GLY  37  -8.667  -4.863   8.152
  244   1HA   GLY  37          2HA       GLY  37  -7.913  -6.825   7.233
  245   2HA   GLY  37          1HA       GLY  37  -9.472  -7.523   7.644
  246    H    ASN  38           H        ASN  38  -8.822  -4.814   5.468
  247    HA   ASN  38           HA       ASN  38 -10.174  -6.289   3.325
  248   1HB   ASN  38          2HB       ASN  38  -9.383  -3.364   3.464
  249   2HB   ASN  38          1HB       ASN  38 -10.286  -4.116   2.158
  250   1HD2  ASN  38          1HD2      ASN  38 -10.986  -1.906   3.944
  251   2HD2  ASN  38          2HD2      ASN  38 -12.482  -2.373   4.679
  252    H    ALA  39           H        ALA  39  -8.941  -7.360   1.919
  253    HA   ALA  39           HA       ALA  39  -6.132  -6.678   1.622
  254   1HB   ALA  39          1HB       ALA  39  -6.787  -9.029   1.810
  255   2HB   ALA  39          2HB       ALA  39  -5.978  -8.705   0.278
  256   3HB   ALA  39          3HB       ALA  39  -7.732  -8.885   0.328
  257    H    MET  40           H        MET  40  -5.771  -4.929   0.382
  258    HA   MET  40           HA       MET  40  -6.911  -4.959  -2.330
  259   1HB   MET  40          2HB       MET  40  -6.722  -2.573  -0.489
  260   2HB   MET  40          1HB       MET  40  -7.028  -2.448  -2.216
  261   1HG   MET  40          2HG       MET  40  -9.039  -3.839  -1.913
  262   2HG   MET  40          1HG       MET  40  -8.756  -3.816  -0.174
  263   1HE   MET  40          1HE       MET  40  -9.168  -1.812   1.378
  264   2HE   MET  40          2HE       MET  40  -9.380  -0.154   0.817
  265   3HE   MET  40          3HE       MET  40  -7.851  -0.987   0.545
  266    H    GLN  41           H        GLN  41  -5.636  -3.854  -3.930
  267    HA   GLN  41           HA       GLN  41  -2.794  -3.771  -3.166
  268   1HB   GLN  41          2HB       GLN  41  -4.015  -4.451  -5.847
  269   2HB   GLN  41          1HB       GLN  41  -2.292  -4.364  -5.508
  270   1HG   GLN  41          2HG       GLN  41  -2.534  -6.201  -3.900
  271   2HG   GLN  41          1HG       GLN  41  -4.250  -6.300  -4.290
  272   1HE2  GLN  41          1HE2      GLN  41  -2.160  -8.308  -4.584
  273   2HE2  GLN  41          2HE2      GLN  41  -2.122  -8.734  -6.262
  274    H    ILE  42           H        ILE  42  -1.843  -1.874  -3.275
  275    HA   ILE  42           HA       ILE  42  -3.048   0.247  -4.914
  276    HB   ILE  42           HB       ILE  42  -1.745   1.834  -3.680
  277   1HG1  ILE  42          2HG1      ILE  42  -0.510  -0.300  -1.977
  278   2HG1  ILE  42          1HG1      ILE  42   0.237   0.131  -3.513
  279   1HG2  ILE  42          1HG2      ILE  42  -2.533   1.469  -1.385
  280   2HG2  ILE  42          2HG2      ILE  42  -2.918  -0.201  -1.799
  281   3HG2  ILE  42          3HG2      ILE  42  -3.777   1.123  -2.586
  282   1HD1  ILE  42          1HD1      ILE  42   1.254   1.352  -1.697
  283   2HD1  ILE  42          2HD1      ILE  42  -0.317   2.001  -1.224
  284   3HD1  ILE  42          3HD1      ILE  42   0.393   2.450  -2.776
  285    H    ASN  43           H        ASN  43  -1.093   1.817  -5.683
  286    HA   ASN  43           HA       ASN  43   0.468   0.155  -7.484
  287   1HB   ASN  43          2HB       ASN  43  -0.769   2.278  -8.162
  288   2HB   ASN  43          1HB       ASN  43   0.489   3.166  -7.314
  289   1HD2  ASN  43          1HD2      ASN  43  -0.318   1.328 -10.115
  290   2HD2  ASN  43          2HD2      ASN  43   1.167   1.594 -10.969
  291    H    ARG  44           H        ARG  44   2.733   0.260  -7.671
  292    HA   ARG  44           HA       ARG  44   4.215   0.359  -5.274
  293   1HB   ARG  44          2HB       ARG  44   4.702  -0.817  -7.542
  294   2HB   ARG  44          1HB       ARG  44   5.430   0.712  -8.003
  295   1HG   ARG  44          2HG       ARG  44   6.907   0.497  -5.977
  296   2HG   ARG  44          1HG       ARG  44   6.284  -1.149  -5.805
  297   1HD   ARG  44          2HD       ARG  44   6.965  -1.431  -8.271
  298   2HD   ARG  44          1HD       ARG  44   7.924   0.026  -8.026
  299    HE   ARG  44           HE       ARG  44   8.325  -2.546  -6.653
  300   1HH1  ARG  44          1HH1      ARG  44   9.490   0.651  -7.510
  301   2HH1  ARG  44          2HH1      ARG  44  11.151   0.266  -7.150
  302   1HH2  ARG  44          1HH2      ARG  44  10.487  -3.056  -6.218
  303   2HH2  ARG  44          2HH2      ARG  44  11.713  -1.829  -6.408
  304    H    ASP  45           H        ASP  45   3.337   2.767  -7.581
  305    HA   ASP  45           HA       ASP  45   5.338   4.693  -6.741
  306   1HB   ASP  45          2HB       ASP  45   4.753   4.666  -9.075
  307   2HB   ASP  45          1HB       ASP  45   3.040   4.816  -8.705
  308    H    ASP  46           H        ASP  46   2.175   3.772  -5.816
  309    HA   ASP  46           HA       ASP  46   1.391   6.360  -4.812
  310   1HB   ASP  46          2HB       ASP  46   0.161   3.617  -4.519
  311   2HB   ASP  46          1HB       ASP  46  -0.499   5.049  -3.737
  312    H    VAL  47           H        VAL  47   2.914   3.488  -3.573
  313    HA   VAL  47           HA       VAL  47   2.743   4.376  -0.821
  314    HB   VAL  47           HB       VAL  47   2.634   1.971  -1.311
  315   1HG1  VAL  47          1HG1      VAL  47   5.476   2.246  -2.261
  316   2HG1  VAL  47          2HG1      VAL  47   4.074   1.926  -3.279
  317   3HG1  VAL  47          3HG1      VAL  47   4.580   0.739  -2.078
  318   1HG2  VAL  47          1HG2      VAL  47   4.293   1.194   0.322
  319   2HG2  VAL  47          2HG2      VAL  47   3.456   2.650   0.863
  320   3HG2  VAL  47          3HG2      VAL  47   5.098   2.760   0.229
  321    H    SER  48           H        SER  48   4.381   5.268   0.370
  322    HA   SER  48           HA       SER  48   6.726   6.139  -1.173
  323   1HB   SER  48          2HB       SER  48   5.419   8.022  -0.478
  324   2HB   SER  48          1HB       SER  48   5.287   7.407   1.166
  325    HG   SER  48           HG       SER  48   6.860   9.040   1.039
  326    H    GLN  49           H        GLN  49   5.829   5.350   2.211
  327    HA   GLN  49           HA       GLN  49   8.250   3.761   2.464
  328   1HB   GLN  49          2HB       GLN  49   8.965   6.076   3.029
  329   2HB   GLN  49          1HB       GLN  49   7.736   6.128   4.285
  330   1HG   GLN  49          2HG       GLN  49   8.864   4.172   5.355
  331   2HG   GLN  49          1HG       GLN  49  10.164   4.355   4.179
  332   1HE2  GLN  49          1HE2      GLN  49   9.923   7.287   4.208
  333   2HE2  GLN  49          2HE2      GLN  49  10.645   7.800   5.697
  334    H    ILE  50           H        ILE  50   8.005   2.113   3.888
  335    HA   ILE  50           HA       ILE  50   5.735   2.223   5.755
  336    HB   ILE  50           HB       ILE  50   5.435  -0.239   5.418
  337   1HG1  ILE  50          2HG1      ILE  50   7.151   0.252   2.973
  338   2HG1  ILE  50          1HG1      ILE  50   7.608  -0.718   4.369
  339   1HG2  ILE  50          1HG2      ILE  50   4.128  -0.006   3.353
  340   2HG2  ILE  50          2HG2      ILE  50   4.928   1.534   3.034
  341   3HG2  ILE  50          3HG2      ILE  50   3.892   1.353   4.450
  342   1HD1  ILE  50          1HD1      ILE  50   5.310  -1.312   2.525
  343   2HD1  ILE  50          2HD1      ILE  50   5.863  -2.312   3.871
  344   3HD1  ILE  50          3HD1      ILE  50   6.897  -2.077   2.461
  345    H    ILE  51           H        ILE  51   6.117   1.388   7.777
  346    HA   ILE  51           HA       ILE  51   8.717   0.172   8.342
  347    HB   ILE  51           HB       ILE  51   9.112   1.789  10.232
  348   1HG1  ILE  51          2HG1      ILE  51   7.085   3.461   8.728
  349   2HG1  ILE  51          1HG1      ILE  51   6.836   2.738  10.313
  350   1HG2  ILE  51          1HG2      ILE  51  10.439   1.885   8.206
  351   2HG2  ILE  51          2HG2      ILE  51  10.138   3.512   8.815
  352   3HG2  ILE  51          3HG2      ILE  51   9.225   2.904   7.433
  353   1HD1  ILE  51          1HD1      ILE  51   7.357   5.107  10.479
  354   2HD1  ILE  51          2HD1      ILE  51   8.884   4.836   9.638
  355   3HD1  ILE  51          3HD1      ILE  51   8.616   4.126  11.229
  356    H    GLU  52           H        GLU  52   5.645  -0.219   8.566
  357    HA   GLU  52           HA       GLU  52   4.765  -0.330  11.154
  358   1HB   GLU  52          2HB       GLU  52   4.245  -2.302   8.925
  359   2HB   GLU  52          1HB       GLU  52   3.329  -2.241  10.423
  360   1HG   GLU  52          2HG       GLU  52   1.984  -1.063   8.991
  361   2HG   GLU  52          1HG       GLU  52   2.896   0.225   9.771
  362    H    ARG  53           H        ARG  53   6.167  -3.161   9.478
  363    HA   ARG  53           HA       ARG  53   7.297  -3.997  12.054
  364   1HB   ARG  53          2HB       ARG  53   5.934  -5.859  10.095
  365   2HB   ARG  53          1HB       ARG  53   6.684  -6.318  11.620
  366   1HG   ARG  53          2HG       ARG  53   5.032  -4.827  12.773
  367   2HG   ARG  53          1HG       ARG  53   4.215  -4.646  11.222
  368   1HD   ARG  53          2HD       ARG  53   3.981  -7.131  11.145
  369   2HD   ARG  53          1HD       ARG  53   4.634  -7.188  12.781
  370    HE   ARG  53           HE       ARG  53   2.034  -6.082  11.977
  371   1HH1  ARG  53          1HH1      ARG  53   4.276  -7.001  14.523
  372   2HH1  ARG  53          2HH1      ARG  53   3.077  -6.896  15.782
  373   1HH2  ARG  53          1HH2      ARG  53   0.462  -5.918  13.632
  374   2HH2  ARG  53          2HH2      ARG  53   0.924  -6.256  15.280
  Start of MODEL    5
    1    H    ASP   4           H        ASP   4  -0.661  -1.663  14.904
    2    HA   ASP   4           HA       ASP   4   2.071  -1.480  15.648
    3   1HB   ASP   4          2HB       ASP   4   2.299  -3.753  14.725
    4   2HB   ASP   4          1HB       ASP   4   0.914  -3.611  15.797
    5    H    TYR   5           H        TYR   5   0.411  -1.225  12.538
    6    HA   TYR   5           HA       TYR   5   2.947  -0.276  11.423
    7   1HB   TYR   5          2HB       TYR   5   1.332  -2.568  10.446
    8   2HB   TYR   5          1HB       TYR   5   2.003  -1.487   9.228
    9    HD1  TYR   5           HD1      TYR   5   2.901  -3.700  12.068
   10    HD2  TYR   5           HD2      TYR   5   4.290  -1.568   8.659
   11    HE1  TYR   5           HE1      TYR   5   5.079  -4.831  12.259
   12    HE2  TYR   5           HE2      TYR   5   6.468  -2.693   8.835
   13    HH   TYR   5           HH       TYR   5   7.835  -3.816  10.502
   14    H    VAL   6           H        VAL   6   2.807   1.429  10.116
   15    HA   VAL   6           HA       VAL   6   0.180   2.309   9.157
   16    HB   VAL   6           HB       VAL   6   2.205   4.175  10.419
   17   1HG1  VAL   6          1HG1      VAL   6  -0.602   4.648   9.434
   18   2HG1  VAL   6          2HG1      VAL   6   0.886   5.236   8.693
   19   3HG1  VAL   6          3HG1      VAL   6   0.395   5.833  10.279
   20   1HG2  VAL   6          1HG2      VAL   6   1.213   2.783  12.151
   21   2HG2  VAL   6          2HG2      VAL   6  -0.402   3.175  11.562
   22   3HG2  VAL   6          3HG2      VAL   6   0.610   4.436  12.265
   23    H    MET   7           H        MET   7   0.247   3.114   7.095
   24    HA   MET   7           HA       MET   7   2.925   3.372   5.888
   25   1HB   MET   7          2HB       MET   7   1.774   1.358   5.108
   26   2HB   MET   7          1HB       MET   7   0.393   2.325   4.610
   27   1HG   MET   7          2HG       MET   7   1.728   3.444   2.937
   28   2HG   MET   7          1HG       MET   7   3.169   2.585   3.473
   29   1HE   MET   7          1HE       MET   7  -0.454   1.084   3.161
   30   2HE   MET   7          2HE       MET   7  -0.443   0.489   1.501
   31   3HE   MET   7          3HE       MET   7  -0.382   2.223   1.818
   32    H    ALA   8           H        ALA   8   3.359   5.380   5.398
   33    HA   ALA   8           HA       ALA   8   1.243   7.261   4.699
   34   1HB   ALA   8          1HB       ALA   8   3.012   8.947   4.722
   35   2HB   ALA   8          2HB       ALA   8   4.227   7.690   4.942
   36   3HB   ALA   8          3HB       ALA   8   3.041   8.002   6.209
   37    H    THR   9           H        THR   9   0.839   7.926   2.643
   38    HA   THR   9           HA       THR   9   2.357   6.511   0.567
   39    HB   THR   9           HB       THR   9   0.379   6.975  -0.877
   40    HG1  THR   9           HG1      THR   9  -0.968   7.621   1.543
   41   1HG2  THR   9          1HG2      THR   9  -1.055   5.269   0.158
   42   2HG2  THR   9          2HG2      THR   9  -0.159   5.440   1.667
   43   3HG2  THR   9          3HG2      THR   9   0.645   4.810   0.230
   44    H    LYS  10           H        LYS  10   2.426   7.581  -1.568
   45    HA   LYS  10           HA       LYS  10   3.943   9.893  -1.554
   46   1HB   LYS  10          2HB       LYS  10   3.736   8.168  -3.372
   47   2HB   LYS  10          1HB       LYS  10   2.214   8.914  -3.826
   48   1HG   LYS  10          2HG       LYS  10   3.319  10.945  -4.451
   49   2HG   LYS  10          1HG       LYS  10   4.858  10.353  -3.819
   50   1HD   LYS  10          2HD       LYS  10   4.795  10.136  -6.244
   51   2HD   LYS  10          1HD       LYS  10   4.829   8.542  -5.484
   52   1HE   LYS  10          2HE       LYS  10   2.274   8.613  -5.663
   53   2HE   LYS  10          1HE       LYS  10   2.519   9.955  -6.780
   54   1HZ   LYS  10          1HZ       LYS  10   2.631   8.361  -8.311
   55   2HZ   LYS  10          2HZ       LYS  10   2.910   7.133  -7.183
   56   3HZ   LYS  10          3HZ       LYS  10   4.209   8.074  -7.745
   57    H    ASP  11           H        ASP  11   0.466   9.506  -2.039
   58    HA   ASP  11           HA       ASP  11  -0.043  12.146  -2.916
   59   1HB   ASP  11          2HB       ASP  11  -1.517   9.996  -3.061
   60   2HB   ASP  11          1HB       ASP  11  -2.098  10.499  -1.477
   61    H    GLY  12           H        GLY  12   0.320  10.720   0.230
   62   1HA   GLY  12          2HA       GLY  12   0.901  12.143   2.081
   63   2HA   GLY  12          1HA       GLY  12  -0.145  13.378   1.400
   64    H    ARG  13           H        ARG  13  -1.421  10.202   1.347
   65    HA   ARG  13           HA       ARG  13  -3.113  10.886   3.641
   66   1HB   ARG  13          2HB       ARG  13  -4.687   9.171   2.765
   67   2HB   ARG  13          1HB       ARG  13  -4.415  10.508   1.657
   68   1HG   ARG  13          2HG       ARG  13  -2.794   9.072   0.430
   69   2HG   ARG  13          1HG       ARG  13  -3.279   7.731   1.472
   70   1HD   ARG  13          2HD       ARG  13  -4.482   7.699  -0.662
   71   2HD   ARG  13          1HD       ARG  13  -5.571   7.931   0.703
   72    HE   ARG  13           HE       ARG  13  -5.633  10.316   0.103
   73   1HH1  ARG  13          1HH1      ARG  13  -4.515   8.027  -2.315
   74   2HH1  ARG  13          2HH1      ARG  13  -4.975   9.035  -3.652
   75   1HH2  ARG  13          1HH2      ARG  13  -6.234  11.631  -1.654
   76   2HH2  ARG  13          2HH2      ARG  13  -5.944  11.088  -3.279
   77    H    MET  14           H        MET  14  -3.333   9.523   5.365
   78    HA   MET  14           HA       MET  14  -1.097   7.662   5.663
   79   1HB   MET  14          2HB       MET  14  -2.962   8.815   7.743
   80   2HB   MET  14          1HB       MET  14  -1.554   7.819   8.073
   81   1HG   MET  14          2HG       MET  14  -1.490  10.524   6.760
   82   2HG   MET  14          1HG       MET  14  -1.160  10.208   8.462
   83   1HE   MET  14          1HE       MET  14   0.911   8.860   9.348
   84   2HE   MET  14          2HE       MET  14   2.117   8.097   8.310
   85   3HE   MET  14          3HE       MET  14   0.465   7.476   8.349
   86    H    ILE  15           H        ILE  15  -1.442   5.585   5.372
   87    HA   ILE  15           HA       ILE  15  -4.149   4.521   5.762
   88    HB   ILE  15           HB       ILE  15  -1.781   3.345   4.288
   89   1HG1  ILE  15          2HG1      ILE  15  -4.405   4.472   3.284
   90   2HG1  ILE  15          1HG1      ILE  15  -2.836   5.256   3.143
   91   1HG2  ILE  15          1HG2      ILE  15  -3.167   1.608   5.313
   92   2HG2  ILE  15          2HG2      ILE  15  -3.311   1.591   3.555
   93   3HG2  ILE  15          3HG2      ILE  15  -4.598   2.290   4.540
   94   1HD1  ILE  15          1HD1      ILE  15  -3.705   2.701   1.810
   95   2HD1  ILE  15          2HD1      ILE  15  -2.075   3.369   1.739
   96   3HD1  ILE  15          3HD1      ILE  15  -3.424   4.267   1.044
   97    H    LEU  16           H        LEU  16  -4.549   3.438   7.555
   98    HA   LEU  16           HA       LEU  16  -2.395   2.554   9.275
   99   1HB   LEU  16          2HB       LEU  16  -5.403   2.398   9.518
  100   2HB   LEU  16          1HB       LEU  16  -4.318   1.696  10.697
  101    HG   LEU  16           HG       LEU  16  -5.098   3.786  11.550
  102   1HD1  LEU  16          1HD1      LEU  16  -2.270   4.100  10.560
  103   2HD1  LEU  16          2HD1      LEU  16  -2.776   3.245  12.017
  104   3HD1  LEU  16          3HD1      LEU  16  -3.008   4.989  11.894
  105   1HD2  LEU  16          1HD2      LEU  16  -4.101   5.040   8.995
  106   2HD2  LEU  16          2HD2      LEU  16  -4.719   5.916  10.396
  107   3HD2  LEU  16          3HD2      LEU  16  -5.786   4.851   9.481
  108    H    THR  17           H        THR  17  -1.582   0.517   9.290
  109    HA   THR  17           HA       THR  17  -3.005  -1.421   7.599
  110    HB   THR  17           HB       THR  17  -0.661  -2.372   7.146
  111    HG1  THR  17           HG1      THR  17   0.005  -0.386   8.779
  112   1HG2  THR  17          1HG2      THR  17  -1.981  -1.231   5.438
  113   2HG2  THR  17          2HG2      THR  17  -0.282  -0.779   5.303
  114   3HG2  THR  17          3HG2      THR  17  -1.433   0.336   6.038
  115    H    ASP  18           H        ASP  18  -3.202  -3.473   8.244
  116    HA   ASP  18           HA       ASP  18  -2.609  -4.233  10.950
  117   1HB   ASP  18          2HB       ASP  18  -4.587  -5.095   9.752
  118   2HB   ASP  18          1HB       ASP  18  -3.542  -5.872   8.572
  119    H    GLY  19           H        GLY  19  -0.926  -4.049   8.087
  120   1HA   GLY  19          2HA       GLY  19   1.508  -4.077   8.389
  121   2HA   GLY  19          1HA       GLY  19   1.303  -5.600   9.253
  122    H    LYS  20           H        LYS  20   3.097  -5.742   7.208
  123    HA   LYS  20           HA       LYS  20   3.503  -7.360   5.680
  124   1HB   LYS  20          2HB       LYS  20   0.625  -8.127   6.106
  125   2HB   LYS  20          1HB       LYS  20   1.746  -9.025   5.091
  126   1HG   LYS  20          2HG       LYS  20   3.225  -9.215   7.144
  127   2HG   LYS  20          1HG       LYS  20   1.841  -8.626   8.065
  128   1HD   LYS  20          2HD       LYS  20   1.560 -10.903   8.243
  129   2HD   LYS  20          1HD       LYS  20   0.574 -10.551   6.824
  130   1HE   LYS  20          2HE       LYS  20   3.422 -11.554   6.790
  131   2HE   LYS  20          1HE       LYS  20   1.989 -12.538   6.509
  132   1HZ   LYS  20          1HZ       LYS  20   2.982 -10.314   4.811
  133   2HZ   LYS  20          2HZ       LYS  20   1.507 -11.113   4.565
  134   3HZ   LYS  20          3HZ       LYS  20   2.967 -11.965   4.427
  135    HA   PRO  21           HA       PRO  21   1.864  -4.943   2.193
  136   1HB   PRO  21          2HB       PRO  21   4.164  -3.809   1.400
  137   2HB   PRO  21          1HB       PRO  21   3.199  -3.132   2.716
  138   1HG   PRO  21          2HG       PRO  21   5.725  -4.689   2.829
  139   2HG   PRO  21          1HG       PRO  21   5.145  -3.402   3.898
  140   1HD   PRO  21          2HD       PRO  21   5.017  -6.170   4.392
  141   2HD   PRO  21          1HD       PRO  21   4.177  -4.898   5.296
  142    H    GLU  22           H        GLU  22   1.459  -6.808   1.025
  143    HA   GLU  22           HA       GLU  22   3.636  -8.393  -0.011
  144   1HB   GLU  22          2HB       GLU  22   0.645  -8.520  -0.395
  145   2HB   GLU  22          1HB       GLU  22   1.763  -9.622  -1.187
  146   1HG   GLU  22          2HG       GLU  22   1.421  -9.295   1.783
  147   2HG   GLU  22          1HG       GLU  22   0.789 -10.619   0.802
  148    H    ILE  23           H        ILE  23   4.800  -7.038  -1.312
  149    HA   ILE  23           HA       ILE  23   3.523  -5.627  -3.492
  150    HB   ILE  23           HB       ILE  23   6.490  -5.973  -3.036
  151   1HG1  ILE  23          2HG1      ILE  23   4.636  -3.852  -1.923
  152   2HG1  ILE  23          1HG1      ILE  23   5.477  -5.079  -0.991
  153   1HG2  ILE  23          1HG2      ILE  23   6.651  -3.881  -4.297
  154   2HG2  ILE  23          2HG2      ILE  23   4.896  -3.849  -4.470
  155   3HG2  ILE  23          3HG2      ILE  23   5.833  -5.133  -5.234
  156   1HD1  ILE  23          1HD1      ILE  23   6.780  -2.865  -2.551
  157   2HD1  ILE  23          2HD1      ILE  23   7.618  -4.093  -1.603
  158   3HD1  ILE  23          3HD1      ILE  23   6.570  -2.922  -0.803
  159    H    ASP  24           H        ASP  24   3.046  -6.605  -5.355
  160    HA   ASP  24           HA       ASP  24   4.211  -9.149  -6.042
  161   1HB   ASP  24          2HB       ASP  24   2.756  -9.155  -7.938
  162   2HB   ASP  24          1HB       ASP  24   1.835  -8.483  -6.603
  163    H    ASP  25           H        ASP  25   5.212  -9.483  -8.234
  164    HA   ASP  25           HA       ASP  25   6.893  -7.161  -8.911
  165   1HB   ASP  25          2HB       ASP  25   8.601  -8.785  -9.694
  166   2HB   ASP  25          1HB       ASP  25   8.274  -8.878  -7.969
  167    H    ASP  26           H        ASP  26   4.254  -8.485  -9.921
  168    HA   ASP  26           HA       ASP  26   4.767  -8.855 -12.724
  169   1HB   ASP  26          2HB       ASP  26   2.185  -8.261 -11.250
  170   2HB   ASP  26          1HB       ASP  26   2.294  -8.678 -12.955
  171    H    THR  27           H        THR  27   3.329  -6.333 -10.728
  172    HA   THR  27           HA       THR  27   4.188  -4.329 -12.706
  173    HB   THR  27           HB       THR  27   1.800  -4.529 -12.979
  174    HG1  THR  27           HG1      THR  27   1.790  -2.422 -13.095
  175   1HG2  THR  27          1HG2      THR  27   1.577  -4.109 -10.001
  176   2HG2  THR  27          2HG2      THR  27   1.243  -5.608 -10.867
  177   3HG2  THR  27          3HG2      THR  27   0.225  -4.192 -11.131
  178    H    GLY  28           H        GLY  28   3.731  -5.281  -9.387
  179   1HA   GLY  28          2HA       GLY  28   5.221  -4.500  -7.703
  180   2HA   GLY  28          1HA       GLY  28   5.388  -2.991  -8.591
  181    H    LEU  29           H        LEU  29   2.323  -4.575  -7.913
  182    HA   LEU  29           HA       LEU  29   1.454  -2.213  -6.485
  183   1HB   LEU  29          2HB       LEU  29   0.020  -4.770  -7.198
  184   2HB   LEU  29          1HB       LEU  29  -0.723  -3.441  -6.322
  185    HG   LEU  29           HG       LEU  29   0.319  -3.373  -9.153
  186   1HD1  LEU  29          1HD1      LEU  29  -2.465  -3.142  -8.029
  187   2HD1  LEU  29          2HD1      LEU  29  -1.807  -4.513  -8.921
  188   3HD1  LEU  29          3HD1      LEU  29  -2.020  -2.958  -9.724
  189   1HD2  LEU  29          1HD2      LEU  29   0.772  -1.246  -8.053
  190   2HD2  LEU  29          2HD2      LEU  29  -0.903  -1.157  -7.509
  191   3HD2  LEU  29          3HD2      LEU  29  -0.530  -1.077  -9.229
  192    H    VAL  30           H        VAL  30   1.149  -2.013  -4.368
  193    HA   VAL  30           HA       VAL  30   2.308  -4.080  -2.676
  194    HB   VAL  30           HB       VAL  30   1.404  -1.292  -1.932
  195   1HG1  VAL  30          1HG1      VAL  30   1.512  -2.803  -0.033
  196   2HG1  VAL  30          2HG1      VAL  30   2.806  -1.607   0.045
  197   3HG1  VAL  30          3HG1      VAL  30   3.158  -3.257  -0.469
  198   1HG2  VAL  30          1HG2      VAL  30   3.786  -0.703  -1.997
  199   2HG2  VAL  30          2HG2      VAL  30   3.168  -1.171  -3.581
  200   3HG2  VAL  30          3HG2      VAL  30   4.150  -2.301  -2.649
  201    H    SER  31           H        SER  31   0.832  -5.628  -2.244
  202    HA   SER  31           HA       SER  31  -1.917  -4.948  -1.640
  203   1HB   SER  31          2HB       SER  31  -0.552  -7.632  -1.407
  204   2HB   SER  31          1HB       SER  31  -2.281  -7.325  -1.532
  205    HG   SER  31           HG       SER  31  -0.385  -6.654  -3.541
  206    H    TYR  32           H        TYR  32  -2.240  -4.023   0.270
  207    HA   TYR  32           HA       TYR  32  -0.686  -4.966   2.588
  208   1HB   TYR  32          2HB       TYR  32  -1.105  -2.755   3.576
  209   2HB   TYR  32          1HB       TYR  32  -0.318  -2.596   2.007
  210    HD1  TYR  32           HD2      TYR  32  -1.600  -1.823   0.052
  211    HD2  TYR  32           HD1      TYR  32  -3.346  -1.940   3.928
  212    HE1  TYR  32           HE2      TYR  32  -3.438  -0.393  -0.731
  213    HE2  TYR  32           HE1      TYR  32  -5.185  -0.509   3.145
  214    HH   TYR  32           HH       TYR  32  -5.705   1.035   1.447
  215    H    HIS  33           H        HIS  33  -1.879  -4.637   4.703
  216    HA   HIS  33           HA       HIS  33  -4.722  -5.349   4.400
  217   1HB   HIS  33          2HB       HIS  33  -2.884  -5.799   6.770
  218   2HB   HIS  33          1HB       HIS  33  -4.575  -6.276   6.681
  219    HD1  HIS  33           HD1      HIS  33  -1.542  -7.864   6.696
  220    HD2  HIS  33           HD2      HIS  33  -4.710  -7.979   3.999
  221    HE1  HIS  33           HE1      HIS  33  -1.288 -10.026   5.442
  222    HE2  HIS  33           HE2      HIS  33  -3.338 -10.175   3.985
  223    H    ASP  34           H        ASP  34  -6.015  -3.650   4.696
  224    HA   ASP  34           HA       ASP  34  -5.268  -1.245   6.001
  225   1HB   ASP  34          2HB       ASP  34  -7.585  -2.262   4.613
  226   2HB   ASP  34          1HB       ASP  34  -8.079  -1.416   6.076
  227    H    GLN  35           H        GLN  35  -6.338  -0.321   7.901
  228    HA   GLN  35           HA       GLN  35  -6.288  -1.907  10.208
  229   1HB   GLN  35          2HB       GLN  35  -6.122   0.547  10.245
  230   2HB   GLN  35          1HB       GLN  35  -7.789   0.676   9.701
  231   1HG   GLN  35          2HG       GLN  35  -8.435  -0.567  11.801
  232   2HG   GLN  35          1HG       GLN  35  -6.777  -0.324  12.345
  233   1HE2  GLN  35          1HE2      GLN  35  -6.626   2.308  11.025
  234   2HE2  GLN  35          2HE2      GLN  35  -7.522   3.387  12.041
  235    H    GLN  36           H        GLN  36  -8.769  -1.209   7.903
  236    HA   GLN  36           HA       GLN  36 -10.961  -2.203   9.449
  237   1HB   GLN  36          2HB       GLN  36 -10.851  -1.816   6.456
  238   2HB   GLN  36          1HB       GLN  36 -12.285  -1.883   7.466
  239   1HG   GLN  36          2HG       GLN  36 -12.111   0.362   7.102
  240   2HG   GLN  36          1HG       GLN  36 -11.227   0.201   8.613
  241   1HE2  GLN  36          1HE2      GLN  36 -10.996   0.789   5.206
  242   2HE2  GLN  36          2HE2      GLN  36  -9.355   1.354   5.208
  243    H    GLY  37           H        GLY  37  -8.427  -3.779   8.061
  244   1HA   GLY  37          2HA       GLY  37  -8.099  -6.067   7.824
  245   2HA   GLY  37          1HA       GLY  37  -9.823  -6.313   8.065
  246    H    ASN  38           H        ASN  38  -8.530  -4.092   5.716
  247    HA   ASN  38           HA       ASN  38  -9.777  -5.665   3.585
  248   1HB   ASN  38          2HB       ASN  38  -8.699  -2.839   3.540
  249   2HB   ASN  38          1HB       ASN  38  -9.572  -3.628   2.232
  250   1HD2  ASN  38          1HD2      ASN  38 -10.117  -1.200   3.853
  251   2HD2  ASN  38          2HD2      ASN  38 -11.731  -1.420   4.441
  252    H    ALA  39           H        ALA  39  -8.623  -6.477   1.865
  253    HA   ALA  39           HA       ALA  39  -5.696  -6.183   2.020
  254   1HB   ALA  39          1HB       ALA  39  -6.535  -8.492   2.211
  255   2HB   ALA  39          2HB       ALA  39  -5.537  -8.259   0.776
  256   3HB   ALA  39          3HB       ALA  39  -7.292  -8.332   0.626
  257    H    MET  40           H        MET  40  -5.362  -4.342   0.846
  258    HA   MET  40           HA       MET  40  -6.526  -4.267  -1.861
  259   1HB   MET  40          2HB       MET  40  -6.015  -1.855  -0.116
  260   2HB   MET  40          1HB       MET  40  -6.846  -1.888  -1.667
  261   1HG   MET  40          2HG       MET  40  -8.405  -3.579  -0.377
  262   2HG   MET  40          1HG       MET  40  -7.796  -2.708   1.019
  263   1HE   MET  40          1HE       MET  40  -7.492   0.279   0.088
  264   2HE   MET  40          2HE       MET  40  -8.275  -0.256   1.574
  265   3HE   MET  40          3HE       MET  40  -9.093   0.886   0.505
  266    H    GLN  41           H        GLN  41  -5.275  -2.556  -3.249
  267    HA   GLN  41           HA       GLN  41  -2.406  -3.113  -2.831
  268   1HB   GLN  41          2HB       GLN  41  -3.937  -3.243  -5.439
  269   2HB   GLN  41          1HB       GLN  41  -2.207  -3.492  -5.255
  270   1HG   GLN  41          2HG       GLN  41  -2.630  -5.462  -3.881
  271   2HG   GLN  41          1HG       GLN  41  -4.365  -5.203  -4.041
  272   1HE2  GLN  41          1HE2      GLN  41  -4.202  -4.390  -6.821
  273   2HE2  GLN  41          2HE2      GLN  41  -3.881  -5.826  -7.737
  274    H    ILE  42           H        ILE  42  -1.243  -1.264  -2.743
  275    HA   ILE  42           HA       ILE  42  -2.150   1.018  -4.375
  276    HB   ILE  42           HB       ILE  42  -0.765   2.489  -3.108
  277   1HG1  ILE  42          2HG1      ILE  42   0.211   0.337  -1.275
  278   2HG1  ILE  42          1HG1      ILE  42   1.030   0.577  -2.817
  279   1HG2  ILE  42          1HG2      ILE  42  -2.923   1.868  -2.085
  280   2HG2  ILE  42          2HG2      ILE  42  -1.708   2.340  -0.897
  281   3HG2  ILE  42          3HG2      ILE  42  -2.086   0.638  -1.137
  282   1HD1  ILE  42          1HD1      ILE  42   1.487   2.875  -2.255
  283   2HD1  ILE  42          2HD1      ILE  42   2.089   1.802  -0.987
  284   3HD1  ILE  42          3HD1      ILE  42   0.595   2.706  -0.741
  285    H    ASN  43           H        ASN  43   0.037   2.357  -4.986
  286    HA   ASN  43           HA       ASN  43   1.427   0.490  -6.743
  287   1HB   ASN  43          2HB       ASN  43   0.344   2.574  -7.625
  288   2HB   ASN  43          1HB       ASN  43   1.541   3.506  -6.741
  289   1HD2  ASN  43          1HD2      ASN  43   2.353   4.401  -8.607
  290   2HD2  ASN  43          2HD2      ASN  43   3.320   3.502  -9.736
  291    H    ARG  44           H        ARG  44   3.650   0.242  -6.798
  292    HA   ARG  44           HA       ARG  44   5.100   0.530  -4.417
  293   1HB   ARG  44          2HB       ARG  44   7.111   0.018  -5.862
  294   2HB   ARG  44          1HB       ARG  44   5.798  -1.150  -5.937
  295   1HG   ARG  44          2HG       ARG  44   5.047  -0.204  -8.044
  296   2HG   ARG  44          1HG       ARG  44   6.315   1.020  -7.965
  297   1HD   ARG  44          2HD       ARG  44   8.020  -0.596  -8.240
  298   2HD   ARG  44          1HD       ARG  44   6.904  -1.930  -7.947
  299    HE   ARG  44           HE       ARG  44   5.891  -1.448 -10.100
  300   1HH1  ARG  44          1HH1      ARG  44   9.038  -0.020  -9.488
  301   2HH1  ARG  44          2HH1      ARG  44   9.415   0.172 -11.172
  302   1HH2  ARG  44          1HH2      ARG  44   6.404  -1.210 -12.307
  303   2HH2  ARG  44          2HH2      ARG  44   7.928  -0.514 -12.769
  304    H    ASP  45           H        ASP  45   4.789   2.656  -7.174
  305    HA   ASP  45           HA       ASP  45   6.994   4.343  -6.440
  306   1HB   ASP  45          2HB       ASP  45   6.179   4.145  -8.777
  307   2HB   ASP  45          1HB       ASP  45   4.668   4.910  -8.296
  308    H    ASP  46           H        ASP  46   3.921   3.875  -5.248
  309    HA   ASP  46           HA       ASP  46   3.569   6.645  -4.374
  310   1HB   ASP  46          2HB       ASP  46   1.704   4.301  -4.609
  311   2HB   ASP  46          1HB       ASP  46   1.282   5.707  -3.635
  312    H    VAL  47           H        VAL  47   5.068   3.990  -3.252
  313    HA   VAL  47           HA       VAL  47   4.141   4.079  -0.514
  314    HB   VAL  47           HB       VAL  47   6.664   2.746  -1.508
  315   1HG1  VAL  47          1HG1      VAL  47   4.859   2.165   0.835
  316   2HG1  VAL  47          2HG1      VAL  47   6.425   2.976   0.915
  317   3HG1  VAL  47          3HG1      VAL  47   6.331   1.287   0.416
  318   1HG2  VAL  47          1HG2      VAL  47   3.866   1.618  -1.456
  319   2HG2  VAL  47          2HG2      VAL  47   5.332   0.686  -1.757
  320   3HG2  VAL  47          3HG2      VAL  47   4.836   1.944  -2.890
  321    H    SER  48           H        SER  48   4.648   5.804   0.674
  322    HA   SER  48           HA       SER  48   7.040   7.316   0.005
  323   1HB   SER  48          2HB       SER  48   4.984   8.575   0.126
  324   2HB   SER  48          1HB       SER  48   4.659   7.985   1.754
  325    HG   SER  48           HG       SER  48   6.994   9.455   1.083
  326    H    GLN  49           H        GLN  49   5.467   6.327   3.078
  327    HA   GLN  49           HA       GLN  49   8.075   5.531   4.114
  328   1HB   GLN  49          2HB       GLN  49   7.549   8.043   4.602
  329   2HB   GLN  49          1HB       GLN  49   6.407   7.397   5.773
  330   1HG   GLN  49          2HG       GLN  49   8.355   6.083   6.728
  331   2HG   GLN  49          1HG       GLN  49   9.391   7.098   5.728
  332   1HE2  GLN  49          1HE2      GLN  49  10.413   8.135   7.366
  333   2HE2  GLN  49          2HE2      GLN  49   9.623   9.226   8.455
  334    H    ILE  50           H        ILE  50   7.928   4.005   5.766
  335    HA   ILE  50           HA       ILE  50   5.217   3.288   6.653
  336    HB   ILE  50           HB       ILE  50   7.334   1.270   5.864
  337   1HG1  ILE  50          2HG1      ILE  50   4.720   1.975   4.503
  338   2HG1  ILE  50          1HG1      ILE  50   6.321   2.401   3.909
  339   1HG2  ILE  50          1HG2      ILE  50   4.471   0.879   6.742
  340   2HG2  ILE  50          2HG2      ILE  50   5.901   0.543   7.718
  341   3HG2  ILE  50          3HG2      ILE  50   5.592  -0.393   6.256
  342   1HD1  ILE  50          1HD1      ILE  50   6.853   0.047   3.624
  343   2HD1  ILE  50          2HD1      ILE  50   5.395   0.479   2.732
  344   3HD1  ILE  50          3HD1      ILE  50   5.268  -0.397   4.257
  345    H    ILE  51           H        ILE  51   8.485   1.996   7.265
  346    HA   ILE  51           HA       ILE  51   8.109   2.643  10.109
  347    HB   ILE  51           HB       ILE  51   9.287   0.497  10.653
  348   1HG1  ILE  51          2HG1      ILE  51   8.631  -0.175   7.776
  349   2HG1  ILE  51          1HG1      ILE  51  10.250   0.099   8.407
  350   1HG2  ILE  51          1HG2      ILE  51   6.616   0.293   9.276
  351   2HG2  ILE  51          2HG2      ILE  51   6.902   0.733  10.960
  352   3HG2  ILE  51          3HG2      ILE  51   7.280  -0.895  10.398
  353   1HD1  ILE  51          1HD1      ILE  51   8.391  -2.119   9.233
  354   2HD1  ILE  51          2HD1      ILE  51  10.019  -1.847   9.853
  355   3HD1  ILE  51          3HD1      ILE  51   9.782  -2.271   8.158
  356    H    GLU  52           H        GLU  52  10.400   1.882  11.198
  357    HA   GLU  52           HA       GLU  52  12.301   3.745  10.005
  358   1HB   GLU  52          2HB       GLU  52  11.505   3.472  12.553
  359   2HB   GLU  52          1HB       GLU  52  12.852   2.348  12.583
  360   1HG   GLU  52          2HG       GLU  52  13.199   5.135  11.555
  361   2HG   GLU  52          1HG       GLU  52  13.236   4.795  13.282
  362    H    ARG  53           H        ARG  53  14.587   3.150   9.929
  363    HA   ARG  53           HA       ARG  53  16.272   1.928   9.112
  364   1HB   ARG  53          2HB       ARG  53  14.868  -0.166  10.718
  365   2HB   ARG  53          1HB       ARG  53  16.246  -0.600   9.714
  366   1HG   ARG  53          2HG       ARG  53  16.187   1.346  12.002
  367   2HG   ARG  53          1HG       ARG  53  17.063  -0.186  11.899
  368   1HD   ARG  53          2HD       ARG  53  18.364   0.756  10.002
  369   2HD   ARG  53          1HD       ARG  53  17.559   2.300  10.265
  370    HE   ARG  53           HE       ARG  53  19.541   1.038  12.019
  371   1HH1  ARG  53          1HH1      ARG  53  17.407   3.749  11.354
  372   2HH1  ARG  53          2HH1      ARG  53  18.308   4.846  12.350
  373   1HH2  ARG  53          1HH2      ARG  53  20.715   2.485  13.314
  374   2HH2  ARG  53          2HH2      ARG  53  20.181   4.131  13.473
  Start of MODEL    6
    1    H    ASP   4           H        ASP   4   0.645  -0.780  16.945
    2    HA   ASP   4           HA       ASP   4  -1.705   0.334  15.568
    3   1HB   ASP   4          2HB       ASP   4  -1.158   1.466  17.751
    4   2HB   ASP   4          1HB       ASP   4   0.410   1.893  17.077
    5    H    TYR   5           H        TYR   5  -1.309   0.495  13.436
    6    HA   TYR   5           HA       TYR   5   1.464   0.978  12.587
    7   1HB   TYR   5          2HB       TYR   5  -0.509  -0.996  11.437
    8   2HB   TYR   5          1HB       TYR   5   0.938  -0.479  10.580
    9    HD1  TYR   5           HD1      TYR   5   3.188  -0.993  11.559
   10    HD2  TYR   5           HD2      TYR   5  -0.401  -2.647  13.142
   11    HE1  TYR   5           HE1      TYR   5   4.501  -2.720  12.712
   12    HE2  TYR   5           HE2      TYR   5   0.904  -4.383  14.298
   13    HH   TYR   5           HH       TYR   5   3.075  -5.485  14.120
   14    H    VAL   6           H        VAL   6   1.727   1.973  10.539
   15    HA   VAL   6           HA       VAL   6  -0.518   3.113   9.161
   16    HB   VAL   6           HB       VAL   6  -0.233   4.673  11.084
   17   1HG1  VAL   6          1HG1      VAL   6   1.742   6.133  11.170
   18   2HG1  VAL   6          2HG1      VAL   6   2.492   5.171   9.895
   19   3HG1  VAL   6          3HG1      VAL   6   2.145   4.440  11.462
   20   1HG2  VAL   6          1HG2      VAL   6  -0.198   6.735   9.783
   21   2HG2  VAL   6          2HG2      VAL   6  -1.147   5.487   8.976
   22   3HG2  VAL   6          3HG2      VAL   6   0.478   5.863   8.406
   23    H    MET   7           H        MET   7   0.136   4.055   7.141
   24    HA   MET   7           HA       MET   7   2.962   3.636   6.453
   25   1HB   MET   7          2HB       MET   7   1.570   1.752   5.617
   26   2HB   MET   7          1HB       MET   7   0.601   2.901   4.709
   27   1HG   MET   7          2HG       MET   7   3.538   2.828   4.252
   28   2HG   MET   7          1HG       MET   7   2.537   1.544   3.579
   29   1HE   MET   7          1HE       MET   7  -0.144   2.967   2.900
   30   2HE   MET   7          2HE       MET   7   0.677   1.901   1.761
   31   3HE   MET   7          3HE       MET   7   0.119   3.489   1.237
   32    H    ALA   8           H        ALA   8   3.889   5.276   5.421
   33    HA   ALA   8           HA       ALA   8   2.253   7.641   4.907
   34   1HB   ALA   8          1HB       ALA   8   5.250   7.337   5.103
   35   2HB   ALA   8          2HB       ALA   8   4.175   7.907   6.383
   36   3HB   ALA   8          3HB       ALA   8   4.377   8.859   4.911
   37    H    THR   9           H        THR   9   1.613   8.036   2.904
   38    HA   THR   9           HA       THR   9   2.957   6.725   0.678
   39    HB   THR   9           HB       THR   9   1.094   7.568  -0.677
   40    HG1  THR   9           HG1      THR   9   0.031   8.595   1.763
   41   1HG2  THR   9          1HG2      THR   9  -0.714   6.281   0.397
   42   2HG2  THR   9          2HG2      THR   9   0.230   6.220   1.884
   43   3HG2  THR   9          3HG2      THR   9   0.822   5.420   0.430
   44    H    LYS  10           H        LYS  10   3.225   8.004  -1.358
   45    HA   LYS  10           HA       LYS  10   4.721  10.411  -0.859
   46   1HB   LYS  10          2HB       LYS  10   5.377   8.791  -2.610
   47   2HB   LYS  10          1HB       LYS  10   3.889   9.136  -3.479
   48   1HG   LYS  10          2HG       LYS  10   4.591  11.375  -3.926
   49   2HG   LYS  10          1HG       LYS  10   5.990  11.201  -2.869
   50   1HD   LYS  10          2HD       LYS  10   6.637  11.027  -5.212
   51   2HD   LYS  10          1HD       LYS  10   6.911   9.502  -4.366
   52   1HE   LYS  10          2HE       LYS  10   4.835   8.611  -5.284
   53   2HE   LYS  10          1HE       LYS  10   4.532  10.140  -6.111
   54   1HZ   LYS  10          1HZ       LYS  10   5.520   8.375  -7.527
   55   2HZ   LYS  10          2HZ       LYS  10   6.929   8.453  -6.583
   56   3HZ   LYS  10          3HZ       LYS  10   6.431   9.808  -7.475
   57    H    ASP  11           H        ASP  11   1.506   9.564  -1.747
   58    HA   ASP  11           HA       ASP  11   0.630  11.972  -2.899
   59   1HB   ASP  11          2HB       ASP  11  -0.745  10.018  -3.082
   60   2HB   ASP  11          1HB       ASP  11  -0.831   9.841  -1.333
   61    H    GLY  12           H        GLY  12   0.832  10.898   0.457
   62   1HA   GLY  12          2HA       GLY  12   1.423  12.757   2.034
   63   2HA   GLY  12          1HA       GLY  12   0.087  13.637   1.300
   64    H    ARG  13           H        ARG  13  -1.307  10.944   1.121
   65    HA   ARG  13           HA       ARG  13  -2.799  11.128   3.532
   66   1HB   ARG  13          2HB       ARG  13  -3.934   9.074   2.660
   67   2HB   ARG  13          1HB       ARG  13  -3.894  10.403   1.510
   68   1HG   ARG  13          2HG       ARG  13  -1.886   9.324   0.474
   69   2HG   ARG  13          1HG       ARG  13  -2.175   7.936   1.521
   70   1HD   ARG  13          2HD       ARG  13  -4.360   7.607   0.517
   71   2HD   ARG  13          1HD       ARG  13  -4.132   9.040  -0.489
   72    HE   ARG  13           HE       ARG  13  -2.012   7.192  -0.872
   73   1HH1  ARG  13          1HH1      ARG  13  -5.373   7.747  -1.715
   74   2HH1  ARG  13          2HH1      ARG  13  -5.269   6.847  -3.202
   75   1HH2  ARG  13          1HH2      ARG  13  -1.879   5.990  -2.782
   76   2HH2  ARG  13          2HH2      ARG  13  -3.302   5.799  -3.781
   77    H    MET  14           H        MET  14  -2.688   9.960   5.373
   78    HA   MET  14           HA       MET  14  -0.439   8.089   5.657
   79   1HB   MET  14          2HB       MET  14  -2.124   9.455   7.772
   80   2HB   MET  14          1HB       MET  14  -0.772   8.381   8.093
   81   1HG   MET  14          2HG       MET  14  -0.590  11.014   6.647
   82   2HG   MET  14          1HG       MET  14  -0.197  10.751   8.346
   83   1HE   MET  14          1HE       MET  14   1.201   7.854   8.188
   84   2HE   MET  14          2HE       MET  14   1.812   9.190   9.164
   85   3HE   MET  14          3HE       MET  14   2.894   8.335   8.064
   86    H    ILE  15           H        ILE  15  -1.229   6.162   4.926
   87    HA   ILE  15           HA       ILE  15  -3.956   5.397   5.449
   88    HB   ILE  15           HB       ILE  15  -1.713   3.822   4.170
   89   1HG1  ILE  15          2HG1      ILE  15  -4.035   5.344   2.955
   90   2HG1  ILE  15          1HG1      ILE  15  -2.349   5.850   2.923
   91   1HG2  ILE  15          1HG2      ILE  15  -3.500   2.351   3.327
   92   2HG2  ILE  15          2HG2      ILE  15  -4.676   3.250   4.283
   93   3HG2  ILE  15          3HG2      ILE  15  -3.403   2.333   5.089
   94   1HD1  ILE  15          1HD1      ILE  15  -3.032   4.890   0.800
   95   2HD1  ILE  15          2HD1      ILE  15  -3.474   3.387   1.611
   96   3HD1  ILE  15          3HD1      ILE  15  -1.789   3.903   1.570
   97    H    LEU  16           H        LEU  16  -4.581   4.621   7.319
   98    HA   LEU  16           HA       LEU  16  -2.821   3.438   9.223
   99   1HB   LEU  16          2HB       LEU  16  -5.847   3.381   9.127
  100   2HB   LEU  16          1HB       LEU  16  -4.863   2.946  10.506
  101    HG   LEU  16           HG       LEU  16  -5.687   5.069  11.009
  102   1HD1  LEU  16          1HD1      LEU  16  -2.956   5.526   9.837
  103   2HD1  LEU  16          2HD1      LEU  16  -3.306   4.877  11.437
  104   3HD1  LEU  16          3HD1      LEU  16  -3.755   6.535  11.042
  105   1HD2  LEU  16          1HD2      LEU  16  -5.577   6.995   9.481
  106   2HD2  LEU  16          2HD2      LEU  16  -6.585   5.686   8.861
  107   3HD2  LEU  16          3HD2      LEU  16  -4.962   5.931   8.215
  108    H    THR  17           H        THR  17  -2.144   1.372   9.260
  109    HA   THR  17           HA       THR  17  -3.606  -0.543   7.569
  110    HB   THR  17           HB       THR  17  -1.325  -1.695   7.346
  111    HG1  THR  17           HG1      THR  17  -0.191   0.830   7.831
  112   1HG2  THR  17          1HG2      THR  17  -1.644   1.055   6.116
  113   2HG2  THR  17          2HG2      THR  17  -2.390  -0.425   5.516
  114   3HG2  THR  17          3HG2      THR  17  -0.637  -0.255   5.497
  115    H    ASP  18           H        ASP  18  -3.825  -2.660   8.293
  116    HA   ASP  18           HA       ASP  18  -3.461  -3.223  11.092
  117   1HB   ASP  18          2HB       ASP  18  -5.265  -4.307   9.795
  118   2HB   ASP  18          1HB       ASP  18  -4.066  -5.072   8.760
  119    H    GLY  19           H        GLY  19  -1.865  -3.778   8.072
  120   1HA   GLY  19          2HA       GLY  19   0.661  -3.384   8.596
  121   2HA   GLY  19          1HA       GLY  19   0.479  -4.953   9.378
  122    H    LYS  20           H        LYS  20   2.247  -5.325   7.512
  123    HA   LYS  20           HA       LYS  20   2.492  -7.039   6.042
  124   1HB   LYS  20          2HB       LYS  20  -0.464  -7.223   6.432
  125   2HB   LYS  20          1HB       LYS  20   0.334  -8.194   5.202
  126   1HG   LYS  20          2HG       LYS  20   1.006  -8.195   8.137
  127   2HG   LYS  20          1HG       LYS  20   0.050  -9.419   7.299
  128   1HD   LYS  20          2HD       LYS  20   2.940  -8.731   6.769
  129   2HD   LYS  20          1HD       LYS  20   2.337 -10.184   7.570
  130   1HE   LYS  20          2HE       LYS  20   1.262 -10.917   5.555
  131   2HE   LYS  20          1HE       LYS  20   1.648  -9.399   4.746
  132   1HZ   LYS  20          1HZ       LYS  20   4.028  -9.976   5.044
  133   2HZ   LYS  20          2HZ       LYS  20   3.186 -11.033   4.019
  134   3HZ   LYS  20          3HZ       LYS  20   3.554 -11.504   5.608
  135    HA   PRO  21           HA       PRO  21   1.647  -4.675   2.275
  136   1HB   PRO  21          2HB       PRO  21   4.115  -3.719   1.813
  137   2HB   PRO  21          1HB       PRO  21   2.997  -2.910   2.913
  138   1HG   PRO  21          2HG       PRO  21   5.418  -4.475   3.510
  139   2HG   PRO  21          1HG       PRO  21   4.614  -3.231   4.480
  140   1HD   PRO  21          2HD       PRO  21   4.417  -6.093   4.738
  141   2HD   PRO  21          1HD       PRO  21   3.625  -4.847   5.722
  142    H    GLU  22           H        GLU  22   1.328  -6.700   1.271
  143    HA   GLU  22           HA       GLU  22   3.638  -8.317   0.570
  144   1HB   GLU  22          2HB       GLU  22   1.083  -8.985   1.140
  145   2HB   GLU  22          1HB       GLU  22   0.970  -8.880  -0.610
  146   1HG   GLU  22          2HG       GLU  22   1.421 -11.145   0.023
  147   2HG   GLU  22          1HG       GLU  22   2.832 -10.478  -0.797
  148    H    ILE  23           H        ILE  23   4.859  -7.350  -0.952
  149    HA   ILE  23           HA       ILE  23   3.632  -5.692  -2.983
  150    HB   ILE  23           HB       ILE  23   6.555  -6.323  -2.559
  151   1HG1  ILE  23          2HG1      ILE  23   4.925  -3.959  -1.593
  152   2HG1  ILE  23          1HG1      ILE  23   5.536  -5.252  -0.579
  153   1HG2  ILE  23          1HG2      ILE  23   6.098  -5.512  -4.795
  154   2HG2  ILE  23          2HG2      ILE  23   6.931  -4.266  -3.865
  155   3HG2  ILE  23          3HG2      ILE  23   5.192  -4.145  -4.143
  156   1HD1  ILE  23          1HD1      ILE  23   7.819  -4.592  -1.089
  157   2HD1  ILE  23          2HD1      ILE  23   6.902  -3.250  -0.405
  158   3HD1  ILE  23          3HD1      ILE  23   7.220  -3.307  -2.137
  159    H    ASP  24           H        ASP  24   3.087  -6.369  -4.927
  160    HA   ASP  24           HA       ASP  24   4.310  -8.800  -6.016
  161   1HB   ASP  24          2HB       ASP  24   1.794  -7.287  -6.658
  162   2HB   ASP  24          1HB       ASP  24   2.500  -8.380  -7.845
  163    H    ASP  25           H        ASP  25   6.086  -8.469  -7.111
  164    HA   ASP  25           HA       ASP  25   6.871  -5.854  -7.939
  165   1HB   ASP  25          2HB       ASP  25   8.424  -7.532  -6.998
  166   2HB   ASP  25          1HB       ASP  25   8.202  -8.523  -8.433
  167    H    ASP  26           H        ASP  26   5.341  -8.505  -9.531
  168    HA   ASP  26           HA       ASP  26   6.289  -8.086 -12.147
  169   1HB   ASP  26          2HB       ASP  26   4.511  -9.505 -12.894
  170   2HB   ASP  26          1HB       ASP  26   5.068 -10.134 -11.347
  171    H    THR  27           H        THR  27   3.536  -6.754 -10.408
  172    HA   THR  27           HA       THR  27   2.928  -5.034 -12.705
  173    HB   THR  27           HB       THR  27   1.003  -6.244 -11.937
  174    HG1  THR  27           HG1      THR  27  -0.370  -4.482 -11.362
  175   1HG2  THR  27          1HG2      THR  27   0.139  -6.054  -9.645
  176   2HG2  THR  27          2HG2      THR  27   1.566  -5.118  -9.197
  177   3HG2  THR  27          3HG2      THR  27   1.735  -6.803  -9.692
  178    H    GLY  28           H        GLY  28   4.048  -5.009  -9.408
  179   1HA   GLY  28          2HA       GLY  28   5.232  -3.262  -8.392
  180   2HA   GLY  28          1HA       GLY  28   4.643  -2.169  -9.638
  181    H    LEU  29           H        LEU  29   2.737  -4.363  -7.634
  182    HA   LEU  29           HA       LEU  29   1.439  -1.995  -6.455
  183   1HB   LEU  29          2HB       LEU  29   0.152  -4.658  -7.063
  184   2HB   LEU  29          1HB       LEU  29  -0.644  -3.262  -6.367
  185    HG   LEU  29           HG       LEU  29   0.426  -3.516  -9.177
  186   1HD1  LEU  29          1HD1      LEU  29  -1.668  -4.684  -8.809
  187   2HD1  LEU  29          2HD1      LEU  29  -1.925  -3.250  -9.804
  188   3HD1  LEU  29          3HD1      LEU  29  -2.374  -3.232  -8.098
  189   1HD2  LEU  29          1HD2      LEU  29  -0.882  -1.149  -7.843
  190   2HD2  LEU  29          2HD2      LEU  29  -0.495  -1.286  -9.559
  191   3HD2  LEU  29          3HD2      LEU  29   0.800  -1.256  -8.362
  192    H    VAL  30           H        VAL  30   0.770  -2.158  -4.282
  193    HA   VAL  30           HA       VAL  30   2.131  -4.300  -2.782
  194    HB   VAL  30           HB       VAL  30   1.461  -1.496  -1.863
  195   1HG1  VAL  30          1HG1      VAL  30   2.921  -3.712  -0.432
  196   2HG1  VAL  30          2HG1      VAL  30   1.307  -3.114  -0.042
  197   3HG1  VAL  30          3HG1      VAL  30   2.710  -2.062   0.156
  198   1HG2  VAL  30          1HG2      VAL  30   3.965  -1.308  -1.722
  199   2HG2  VAL  30          2HG2      VAL  30   3.302  -1.384  -3.356
  200   3HG2  VAL  30          3HG2      VAL  30   4.052  -2.812  -2.640
  201    H    SER  31           H        SER  31   0.764  -5.775  -2.067
  202    HA   SER  31           HA       SER  31  -2.010  -5.138  -1.533
  203   1HB   SER  31          2HB       SER  31  -0.523  -7.747  -1.119
  204   2HB   SER  31          1HB       SER  31  -2.272  -7.527  -1.150
  205    HG   SER  31           HG       SER  31  -0.438  -7.593  -3.248
  206    H    TYR  32           H        TYR  32  -2.270  -3.968   0.317
  207    HA   TYR  32           HA       TYR  32  -0.832  -4.906   2.710
  208   1HB   TYR  32          2HB       TYR  32  -1.022  -2.723   3.641
  209   2HB   TYR  32          1HB       TYR  32  -0.479  -2.514   1.983
  210    HD1  TYR  32           HD1      TYR  32  -2.172  -1.803   0.242
  211    HD2  TYR  32           HD2      TYR  32  -3.006  -1.722   4.411
  212    HE1  TYR  32           HE1      TYR  32  -4.021  -0.240  -0.162
  213    HE2  TYR  32           HE2      TYR  32  -4.858  -0.161   4.019
  214    HH   TYR  32           HH       TYR  32  -6.231   0.366   1.097
  215    H    HIS  33           H        HIS  33  -2.024  -4.764   4.769
  216    HA   HIS  33           HA       HIS  33  -4.817  -5.547   4.333
  217   1HB   HIS  33          2HB       HIS  33  -2.970  -6.088   6.668
  218   2HB   HIS  33          1HB       HIS  33  -4.670  -6.547   6.620
  219    HD1  HIS  33           HD1      HIS  33  -2.685  -8.800   6.955
  220    HD2  HIS  33           HD2      HIS  33  -3.923  -7.406   3.232
  221    HE1  HIS  33           HE1      HIS  33  -2.239 -10.673   5.338
  222    HE2  HIS  33           HE2      HIS  33  -2.817  -9.738   3.072
  223    H    ASP  34           H        ASP  34  -6.262  -4.063   4.674
  224    HA   ASP  34           HA       ASP  34  -5.760  -1.591   5.938
  225   1HB   ASP  34          2HB       ASP  34  -7.870  -2.756   4.429
  226   2HB   ASP  34          1HB       ASP  34  -8.555  -2.046   5.888
  227    H    GLN  35           H        GLN  35  -7.371  -0.704   7.510
  228    HA   GLN  35           HA       GLN  35  -7.048  -1.766  10.062
  229   1HB   GLN  35          2HB       GLN  35  -9.302   0.024   9.125
  230   2HB   GLN  35          1HB       GLN  35  -8.663  -0.103  10.758
  231   1HG   GLN  35          2HG       GLN  35  -7.008   1.327  10.346
  232   2HG   GLN  35          1HG       GLN  35  -6.645   0.606   8.779
  233   1HE2  GLN  35          1HE2      GLN  35  -7.613   1.417   6.934
  234   2HE2  GLN  35          2HE2      GLN  35  -8.501   2.908   6.921
  235    H    GLN  36           H        GLN  36  -9.438  -2.370   7.619
  236    HA   GLN  36           HA       GLN  36 -11.226  -3.736   9.463
  237   1HB   GLN  36          2HB       GLN  36 -11.539  -3.580   6.469
  238   2HB   GLN  36          1HB       GLN  36 -12.786  -3.829   7.680
  239   1HG   GLN  36          2HG       GLN  36 -11.279  -1.289   7.114
  240   2HG   GLN  36          1HG       GLN  36 -12.983  -1.615   6.805
  241   1HE2  GLN  36          1HE2      GLN  36 -11.689   0.474   8.382
  242   2HE2  GLN  36          2HE2      GLN  36 -12.345   0.344   9.983
  243    H    GLY  37           H        GLY  37  -8.441  -4.527   7.946
  244   1HA   GLY  37          2HA       GLY  37  -7.460  -6.630   7.745
  245   2HA   GLY  37          1HA       GLY  37  -9.039  -7.364   7.984
  246    H    ASN  38           H        ASN  38  -8.884  -4.866   5.664
  247    HA   ASN  38           HA       ASN  38  -9.576  -6.717   3.567
  248   1HB   ASN  38          2HB       ASN  38  -9.296  -3.707   3.589
  249   2HB   ASN  38          1HB       ASN  38  -9.783  -4.634   2.175
  250   1HD2  ASN  38          1HD2      ASN  38 -11.236  -2.586   3.639
  251   2HD2  ASN  38          2HD2      ASN  38 -12.716  -3.337   4.151
  252    H    ALA  39           H        ALA  39  -8.321  -7.447   1.980
  253    HA   ALA  39           HA       ALA  39  -5.538  -6.516   1.894
  254   1HB   ALA  39          1HB       ALA  39  -6.793  -8.983   0.693
  255   2HB   ALA  39          2HB       ALA  39  -5.877  -8.916   2.200
  256   3HB   ALA  39          3HB       ALA  39  -5.078  -8.575   0.665
  257    H    MET  40           H        MET  40  -5.351  -4.821   0.550
  258    HA   MET  40           HA       MET  40  -6.414  -5.145  -2.174
  259   1HB   MET  40          2HB       MET  40  -7.127  -2.868  -2.292
  260   2HB   MET  40          1HB       MET  40  -7.833  -3.555  -0.835
  261   1HG   MET  40          2HG       MET  40  -6.179  -2.472   0.532
  262   2HG   MET  40          1HG       MET  40  -5.340  -1.877  -0.897
  263   1HE   MET  40          1HE       MET  40  -9.169  -2.067  -0.006
  264   2HE   MET  40          2HE       MET  40  -9.461  -0.421   0.553
  265   3HE   MET  40          3HE       MET  40  -8.404  -1.491   1.476
  266    H    GLN  41           H        GLN  41  -5.333  -3.605  -3.719
  267    HA   GLN  41           HA       GLN  41  -2.460  -3.560  -3.067
  268   1HB   GLN  41          2HB       GLN  41  -3.772  -3.815  -5.778
  269   2HB   GLN  41          1HB       GLN  41  -2.047  -3.895  -5.447
  270   1HG   GLN  41          2HG       GLN  41  -2.319  -5.952  -4.243
  271   2HG   GLN  41          1HG       GLN  41  -4.074  -5.848  -4.386
  272   1HE2  GLN  41          1HE2      GLN  41  -5.047  -6.260  -6.362
  273   2HE2  GLN  41          2HE2      GLN  41  -4.227  -7.069  -7.656
  274    H    ILE  42           H        ILE  42  -1.582  -1.572  -2.917
  275    HA   ILE  42           HA       ILE  42  -2.747   0.569  -4.569
  276    HB   ILE  42           HB       ILE  42  -1.661   2.197  -3.247
  277   1HG1  ILE  42          2HG1      ILE  42  -0.265   0.171  -1.524
  278   2HG1  ILE  42          1HG1      ILE  42   0.473   0.703  -3.034
  279   1HG2  ILE  42          1HG2      ILE  42  -3.635   1.326  -2.194
  280   2HG2  ILE  42          2HG2      ILE  42  -2.438   1.724  -0.959
  281   3HG2  ILE  42          3HG2      ILE  42  -2.700   0.044  -1.424
  282   1HD1  ILE  42          1HD1      ILE  42   1.246   1.957  -1.059
  283   2HD1  ILE  42          2HD1      ILE  42  -0.397   2.548  -0.825
  284   3HD1  ILE  42          3HD1      ILE  42   0.496   2.974  -2.287
  285    H    ASN  43           H        ASN  43  -0.855   2.172  -5.255
  286    HA   ASN  43           HA       ASN  43   0.792   0.582  -7.021
  287   1HB   ASN  43          2HB       ASN  43  -0.461   2.684  -7.689
  288   2HB   ASN  43          1HB       ASN  43   0.726   3.588  -6.761
  289   1HD2  ASN  43          1HD2      ASN  43   1.383   4.669  -8.626
  290   2HD2  ASN  43          2HD2      ASN  43   2.383   3.897  -9.819
  291    H    ARG  44           H        ARG  44   2.973   0.293  -6.885
  292    HA   ARG  44           HA       ARG  44   4.299   0.656  -4.426
  293   1HB   ARG  44          2HB       ARG  44   4.945  -1.040  -6.129
  294   2HB   ARG  44          1HB       ARG  44   5.552   0.256  -7.153
  295   1HG   ARG  44          2HG       ARG  44   7.045   0.860  -5.155
  296   2HG   ARG  44          1HG       ARG  44   6.641  -0.747  -4.552
  297   1HD   ARG  44          2HD       ARG  44   8.747  -0.752  -5.807
  298   2HD   ARG  44          1HD       ARG  44   7.520  -1.750  -6.586
  299    HE   ARG  44           HE       ARG  44   7.657  -0.410  -8.416
  300   1HH1  ARG  44          1HH1      ARG  44   8.945   1.353  -5.668
  301   2HH1  ARG  44          2HH1      ARG  44   9.373   2.758  -6.604
  302   1HH2  ARG  44          1HH2      ARG  44   8.235   1.439  -9.652
  303   2HH2  ARG  44          2HH2      ARG  44   8.972   2.803  -8.864
  304    H    ASP  45           H        ASP  45   4.122   2.608  -7.315
  305    HA   ASP  45           HA       ASP  45   6.228   4.387  -6.789
  306   1HB   ASP  45          2HB       ASP  45   4.985   4.129  -8.959
  307   2HB   ASP  45          1HB       ASP  45   3.657   5.032  -8.241
  308    H    ASP  46           H        ASP  46   3.023   4.155  -5.494
  309    HA   ASP  46           HA       ASP  46   3.007   6.847  -4.437
  310   1HB   ASP  46          2HB       ASP  46   0.919   5.747  -5.193
  311   2HB   ASP  46          1HB       ASP  46   1.106   4.551  -3.914
  312    H    VAL  47           H        VAL  47   4.044   3.733  -3.442
  313    HA   VAL  47           HA       VAL  47   3.862   4.084  -0.623
  314    HB   VAL  47           HB       VAL  47   5.838   2.313  -2.068
  315   1HG1  VAL  47          1HG1      VAL  47   6.198   2.530   0.331
  316   2HG1  VAL  47          2HG1      VAL  47   5.632   0.906  -0.073
  317   3HG1  VAL  47          3HG1      VAL  47   4.518   2.079   0.632
  318   1HG2  VAL  47          1HG2      VAL  47   2.990   1.662  -1.343
  319   2HG2  VAL  47          2HG2      VAL  47   4.171   0.545  -2.023
  320   3HG2  VAL  47          3HG2      VAL  47   3.602   1.916  -2.977
  321    H    SER  48           H        SER  48   4.933   5.629   0.439
  322    HA   SER  48           HA       SER  48   7.521   6.512  -0.601
  323   1HB   SER  48          2HB       SER  48   5.843   8.266  -0.265
  324   2HB   SER  48          1HB       SER  48   5.688   7.816   1.433
  325    HG   SER  48           HG       SER  48   8.235   8.452   0.441
  326    H    GLN  49           H        GLN  49   6.063   6.059   2.645
  327    HA   GLN  49           HA       GLN  49   8.422   4.523   3.437
  328   1HB   GLN  49          2HB       GLN  49   7.414   6.876   5.055
  329   2HB   GLN  49          1HB       GLN  49   8.721   5.791   5.505
  330   1HG   GLN  49          2HG       GLN  49   9.930   6.584   3.439
  331   2HG   GLN  49          1HG       GLN  49   8.689   7.828   3.295
  332   1HE2  GLN  49          1HE2      GLN  49  10.058   9.530   3.618
  333   2HE2  GLN  49          2HE2      GLN  49  10.816   9.853   5.142
  334    H    ILE  50           H        ILE  50   7.994   3.838   5.888
  335    HA   ILE  50           HA       ILE  50   5.175   2.979   6.026
  336    HB   ILE  50           HB       ILE  50   7.559   1.622   7.310
  337   1HG1  ILE  50          2HG1      ILE  50   7.644   1.419   4.859
  338   2HG1  ILE  50          1HG1      ILE  50   7.295  -0.129   5.619
  339   1HG2  ILE  50          1HG2      ILE  50   5.488   1.275   8.529
  340   2HG2  ILE  50          2HG2      ILE  50   5.986  -0.217   7.729
  341   3HG2  ILE  50          3HG2      ILE  50   4.682   0.759   7.048
  342   1HD1  ILE  50          1HD1      ILE  50   4.930   0.140   5.061
  343   2HD1  ILE  50          2HD1      ILE  50   5.958   0.186   3.628
  344   3HD1  ILE  50          3HD1      ILE  50   5.293   1.683   4.284
  345    H    ILE  51           H        ILE  51   7.784   3.059   8.417
  346    HA   ILE  51           HA       ILE  51   6.064   4.694  10.159
  347    HB   ILE  51           HB       ILE  51   6.414   2.376  10.976
  348   1HG1  ILE  51          2HG1      ILE  51   7.836   4.437  12.667
  349   2HG1  ILE  51          1HG1      ILE  51   6.089   4.246  12.566
  350   1HG2  ILE  51          1HG2      ILE  51   8.569   1.889  10.034
  351   2HG2  ILE  51          2HG2      ILE  51   8.657   1.717  11.787
  352   3HG2  ILE  51          3HG2      ILE  51   9.323   3.150  11.009
  353   1HD1  ILE  51          1HD1      ILE  51   6.976   3.219  14.577
  354   2HD1  ILE  51          2HD1      ILE  51   8.037   2.199  13.603
  355   3HD1  ILE  51          3HD1      ILE  51   6.285   2.002  13.502
  356    H    GLU  52           H        GLU  52   7.200   6.218  11.559
  357    HA   GLU  52           HA       GLU  52   9.212   7.643  10.157
  358   1HB   GLU  52          2HB       GLU  52   9.306   9.065  12.216
  359   2HB   GLU  52          1HB       GLU  52   7.702   8.886  11.528
  360   1HG   GLU  52          2HG       GLU  52   8.456   6.982  13.655
  361   2HG   GLU  52          1HG       GLU  52   8.211   8.661  14.132
  362    H    ARG  53           H        ARG  53  11.327   8.197  10.937
  363    HA   ARG  53           HA       ARG  53  12.787   5.880  11.798
  364   1HB   ARG  53          2HB       ARG  53  13.665   8.699  11.147
  365   2HB   ARG  53          1HB       ARG  53  14.769   7.390  11.540
  366   1HG   ARG  53          2HG       ARG  53  12.843   7.324   9.232
  367   2HG   ARG  53          1HG       ARG  53  14.520   7.852   9.108
  368   1HD   ARG  53          2HD       ARG  53  15.272   5.653   9.862
  369   2HD   ARG  53          1HD       ARG  53  13.595   5.125  10.017
  370    HE   ARG  53           HE       ARG  53  13.677   5.878   7.450
  371   1HH1  ARG  53          1HH1      ARG  53  15.907   3.882   9.301
  372   2HH1  ARG  53          2HH1      ARG  53  16.363   2.919   7.928
  373   1HH2  ARG  53          1HH2      ARG  53  14.269   4.602   5.673
  374   2HH2  ARG  53          2HH2      ARG  53  15.416   3.311   5.868
  Start of MODEL    7
    1    H    ASP   4           H        ASP   4   4.146   0.700  17.002
    2    HA   ASP   4           HA       ASP   4   1.511   0.587  15.953
    3   1HB   ASP   4          2HB       ASP   4   3.629   2.735  15.703
    4   2HB   ASP   4          1HB       ASP   4   1.930   2.932  15.287
    5    H    TYR   5           H        TYR   5   0.816   0.762  13.838
    6    HA   TYR   5           HA       TYR   5   2.840   0.378  11.753
    7   1HB   TYR   5          2HB       TYR   5   0.225  -1.116  12.012
    8   2HB   TYR   5          1HB       TYR   5   1.291  -1.194  10.615
    9    HD1  TYR   5           HD1      TYR   5   3.860  -1.728  11.378
   10    HD2  TYR   5           HD2      TYR   5   0.331  -2.925  13.429
   11    HE1  TYR   5           HE1      TYR   5   5.097  -3.587  12.404
   12    HE2  TYR   5           HE2      TYR   5   1.559  -4.787  14.460
   13    HH   TYR   5           HH       TYR   5   4.964  -5.032  14.338
   14    H    VAL   6           H        VAL   6   2.424   1.382   9.825
   15    HA   VAL   6           HA       VAL   6   0.000   2.502   9.013
   16    HB   VAL   6           HB       VAL   6   0.281   4.031  10.912
   17   1HG1  VAL   6          1HG1      VAL   6   2.685   4.022  11.161
   18   2HG1  VAL   6          2HG1      VAL   6   2.121   5.678  10.934
   19   3HG1  VAL   6          3HG1      VAL   6   2.880   4.812   9.598
   20   1HG2  VAL   6          1HG2      VAL   6   0.703   5.363   8.242
   21   2HG2  VAL   6          2HG2      VAL   6   0.082   6.150   9.692
   22   3HG2  VAL   6          3HG2      VAL   6  -0.840   4.856   8.926
   23    H    MET   7           H        MET   7   0.152   2.966   6.899
   24    HA   MET   7           HA       MET   7   2.859   3.031   5.754
   25   1HB   MET   7          2HB       MET   7   1.326   1.113   5.167
   26   2HB   MET   7          1HB       MET   7   0.282   2.278   4.367
   27   1HG   MET   7          2HG       MET   7   3.164   2.026   3.614
   28   2HG   MET   7          1HG       MET   7   1.954   0.922   2.968
   29   1HE   MET   7          1HE       MET   7  -0.425   3.325   1.036
   30   2HE   MET   7          2HE       MET   7  -0.583   2.784   2.707
   31   3HE   MET   7          3HE       MET   7  -0.062   1.651   1.460
   32    H    ALA   8           H        ALA   8   3.465   5.025   5.300
   33    HA   ALA   8           HA       ALA   8   1.482   7.030   4.562
   34   1HB   ALA   8          1HB       ALA   8   4.441   7.341   5.067
   35   2HB   ALA   8          2HB       ALA   8   3.156   7.633   6.240
   36   3HB   ALA   8          3HB       ALA   8   3.288   8.649   4.804
   37    H    THR   9           H        THR   9   1.208   7.769   2.558
   38    HA   THR   9           HA       THR   9   2.644   6.347   0.464
   39    HB   THR   9           HB       THR   9   0.863   7.335  -1.014
   40    HG1  THR   9           HG1      THR   9  -0.474   7.976   1.403
   41   1HG2  THR   9          1HG2      THR   9   0.666   5.066  -0.130
   42   2HG2  THR   9          2HG2      THR   9  -0.912   5.851  -0.192
   43   3HG2  THR   9          3HG2      THR   9  -0.065   5.698   1.347
   44    H    LYS  10           H        LYS  10   2.677   7.680  -1.634
   45    HA   LYS  10           HA       LYS  10   4.701   9.561  -1.617
   46   1HB   LYS  10          2HB       LYS  10   4.097   8.289  -3.558
   47   2HB   LYS  10          1HB       LYS  10   2.484   8.976  -3.572
   48   1HG   LYS  10          2HG       LYS  10   3.341  11.110  -4.257
   49   2HG   LYS  10          1HG       LYS  10   5.004  10.537  -4.083
   50   1HD   LYS  10          2HD       LYS  10   4.182  10.522  -6.436
   51   2HD   LYS  10          1HD       LYS  10   4.699   8.936  -5.854
   52   1HE   LYS  10          2HE       LYS  10   2.332   8.419  -5.324
   53   2HE   LYS  10          1HE       LYS  10   1.867   9.956  -6.049
   54   1HZ   LYS  10          1HZ       LYS  10   3.265   7.760  -7.483
   55   2HZ   LYS  10          2HZ       LYS  10   2.699   9.206  -8.157
   56   3HZ   LYS  10          3HZ       LYS  10   1.602   8.065  -7.555
   57    H    ASP  11           H        ASP  11   1.194  10.054  -1.668
   58    HA   ASP  11           HA       ASP  11   1.221  12.829  -2.149
   59   1HB   ASP  11          2HB       ASP  11  -0.895  11.299  -0.631
   60   2HB   ASP  11          1HB       ASP  11  -1.103  12.814  -1.500
   61    H    GLY  12           H        GLY  12   1.609  10.948   0.747
   62   1HA   GLY  12          2HA       GLY  12   2.666  11.991   2.671
   63   2HA   GLY  12          1HA       GLY  12   1.751  13.450   2.306
   64    H    ARG  13           H        ARG  13  -0.481  11.373   1.649
   65    HA   ARG  13           HA       ARG  13  -1.819  11.528   4.158
   66   1HB   ARG  13          2HB       ARG  13  -3.518  10.052   3.014
   67   2HB   ARG  13          1HB       ARG  13  -3.170  11.568   2.190
   68   1HG   ARG  13          2HG       ARG  13  -1.641  10.362   0.692
   69   2HG   ARG  13          1HG       ARG  13  -2.086   8.855   1.482
   70   1HD   ARG  13          2HD       ARG  13  -4.307   8.985   0.693
   71   2HD   ARG  13          1HD       ARG  13  -4.105  10.660   0.180
   72    HE   ARG  13           HE       ARG  13  -2.278   9.465  -1.341
   73   1HH1  ARG  13          1HH1      ARG  13  -5.606   8.544  -0.680
   74   2HH1  ARG  13          2HH1      ARG  13  -5.803   7.747  -2.211
   75   1HH2  ARG  13          1HH2      ARG  13  -2.554   8.464  -3.336
   76   2HH2  ARG  13          2HH2      ARG  13  -4.073   7.699  -3.728
   77    H    MET  14           H        MET  14  -1.961  10.084   5.750
   78    HA   MET  14           HA       MET  14  -0.201   7.749   5.570
   79   1HB   MET  14          2HB       MET  14  -1.402   9.103   7.995
   80   2HB   MET  14          1HB       MET  14  -0.259   7.765   8.033
   81   1HG   MET  14          2HG       MET  14   1.431   9.155   6.983
   82   2HG   MET  14          1HG       MET  14   0.290  10.493   6.886
   83   1HE   MET  14          1HE       MET  14   2.042   8.813  10.809
   84   2HE   MET  14          2HE       MET  14   2.511   8.269   9.199
   85   3HE   MET  14          3HE       MET  14   0.898   7.907   9.815
   86    H    ILE  15           H        ILE  15  -1.076   5.834   5.241
   87    HA   ILE  15           HA       ILE  15  -3.940   5.485   5.737
   88    HB   ILE  15           HB       ILE  15  -2.000   3.863   4.084
   89   1HG1  ILE  15          2HG1      ILE  15  -4.312   5.657   3.310
   90   2HG1  ILE  15          1HG1      ILE  15  -2.605   6.041   3.124
   91   1HG2  ILE  15          1HG2      ILE  15  -3.931   2.573   3.332
   92   2HG2  ILE  15          2HG2      ILE  15  -4.968   3.465   4.445
   93   3HG2  ILE  15          3HG2      ILE  15  -3.698   2.412   5.073
   94   1HD1  ILE  15          1HD1      ILE  15  -2.379   4.193   1.534
   95   2HD1  ILE  15          2HD1      ILE  15  -3.571   5.385   1.013
   96   3HD1  ILE  15          3HD1      ILE  15  -4.102   3.851   1.706
   97    H    LEU  16           H        LEU  16  -4.662   4.271   7.349
   98    HA   LEU  16           HA       LEU  16  -2.813   3.091   9.193
   99   1HB   LEU  16          2HB       LEU  16  -5.810   3.302   9.087
  100   2HB   LEU  16          1HB       LEU  16  -5.016   2.312  10.295
  101    HG   LEU  16           HG       LEU  16  -5.546   4.419  11.287
  102   1HD1  LEU  16          1HD1      LEU  16  -2.603   4.305  10.649
  103   2HD1  LEU  16          2HD1      LEU  16  -3.425   3.439  11.946
  104   3HD1  LEU  16          3HD1      LEU  16  -3.339   5.200  11.981
  105   1HD2  LEU  16          1HD2      LEU  16  -5.769   5.759   9.266
  106   2HD2  LEU  16          2HD2      LEU  16  -4.021   5.718   9.035
  107   3HD2  LEU  16          3HD2      LEU  16  -4.707   6.545  10.434
  108    H    THR  17           H        THR  17  -1.954   1.195   8.962
  109    HA   THR  17           HA       THR  17  -3.464  -0.972   7.675
  110    HB   THR  17           HB       THR  17  -1.052  -1.683   6.893
  111    HG1  THR  17           HG1      THR  17   0.362  -0.233   7.560
  112   1HG2  THR  17          1HG2      THR  17  -2.847  -1.088   5.339
  113   2HG2  THR  17          2HG2      THR  17  -1.316  -0.395   4.804
  114   3HG2  THR  17          3HG2      THR  17  -2.519   0.626   5.591
  115    H    ASP  18           H        ASP  18  -3.018  -3.103   8.533
  116    HA   ASP  18           HA       ASP  18  -1.333  -3.179  10.898
  117   1HB   ASP  18          2HB       ASP  18  -1.774  -5.614  10.959
  118   2HB   ASP  18          1HB       ASP  18  -3.259  -4.678  10.943
  119    H    GLY  19           H        GLY  19   0.700  -4.317  10.931
  120   1HA   GLY  19          2HA       GLY  19   2.167  -3.003   8.919
  121   2HA   GLY  19          1HA       GLY  19   2.846  -4.068  10.136
  122    H    LYS  20           H        LYS  20   3.625  -3.773   7.294
  123    HA   LYS  20           HA       LYS  20   4.764  -5.431   6.157
  124   1HB   LYS  20          2HB       LYS  20   2.879  -7.383   7.448
  125   2HB   LYS  20          1HB       LYS  20   4.005  -7.833   6.179
  126   1HG   LYS  20          2HG       LYS  20   5.851  -6.980   7.627
  127   2HG   LYS  20          1HG       LYS  20   4.662  -6.780   8.917
  128   1HD   LYS  20          2HD       LYS  20   5.310  -9.366   7.503
  129   2HD   LYS  20          1HD       LYS  20   5.869  -8.909   9.113
  130   1HE   LYS  20          2HE       LYS  20   3.635  -8.934   9.969
  131   2HE   LYS  20          1HE       LYS  20   2.961  -9.123   8.351
  132   1HZ   LYS  20          1HZ       LYS  20   3.847 -11.309   8.202
  133   2HZ   LYS  20          2HZ       LYS  20   3.035 -11.201   9.687
  134   3HZ   LYS  20          3HZ       LYS  20   4.731 -11.129   9.638
  135    HA   PRO  21           HA       PRO  21   1.583  -4.842   2.952
  136   1HB   PRO  21          2HB       PRO  21   3.081  -3.237   1.388
  137   2HB   PRO  21          1HB       PRO  21   2.117  -2.607   2.730
  138   1HG   PRO  21          2HG       PRO  21   5.049  -3.177   2.606
  139   2HG   PRO  21          1HG       PRO  21   4.204  -1.801   3.340
  140   1HD   PRO  21          2HD       PRO  21   5.136  -3.940   4.763
  141   2HD   PRO  21          1HD       PRO  21   3.755  -2.947   5.269
  142    H    GLU  22           H        GLU  22   1.503  -6.330   1.394
  143    HA   GLU  22           HA       GLU  22   3.919  -7.826   0.767
  144   1HB   GLU  22          2HB       GLU  22   1.344  -8.616   1.193
  145   2HB   GLU  22          1HB       GLU  22   1.376  -8.543  -0.564
  146   1HG   GLU  22          2HG       GLU  22   3.217 -10.152   1.192
  147   2HG   GLU  22          1HG       GLU  22   1.885 -10.773   0.221
  148    H    ILE  23           H        ILE  23   5.161  -7.018  -0.784
  149    HA   ILE  23           HA       ILE  23   3.992  -5.279  -2.794
  150    HB   ILE  23           HB       ILE  23   6.889  -5.979  -2.293
  151   1HG1  ILE  23          2HG1      ILE  23   5.272  -3.534  -1.536
  152   2HG1  ILE  23          1HG1      ILE  23   5.859  -4.757  -0.422
  153   1HG2  ILE  23          1HG2      ILE  23   6.489  -5.294  -4.602
  154   2HG2  ILE  23          2HG2      ILE  23   7.382  -4.054  -3.722
  155   3HG2  ILE  23          3HG2      ILE  23   5.660  -3.844  -4.035
  156   1HD1  ILE  23          1HD1      ILE  23   7.571  -2.915  -2.072
  157   2HD1  ILE  23          2HD1      ILE  23   8.158  -4.143  -0.952
  158   3HD1  ILE  23          3HD1      ILE  23   7.239  -2.765  -0.348
  159    H    ASP  24           H        ASP  24   3.536  -5.843  -4.780
  160    HA   ASP  24           HA       ASP  24   4.309  -8.488  -5.748
  161   1HB   ASP  24          2HB       ASP  24   1.933  -7.790  -5.896
  162   2HB   ASP  24          1HB       ASP  24   2.408  -6.450  -6.933
  163    H    ASP  25           H        ASP  25   6.123  -8.635  -6.872
  164    HA   ASP  25           HA       ASP  25   7.301  -6.244  -8.024
  165   1HB   ASP  25          2HB       ASP  25   8.324  -9.037  -7.560
  166   2HB   ASP  25          1HB       ASP  25   9.222  -7.872  -8.525
  167    H    ASP  26           H        ASP  26   5.036  -8.187  -9.192
  168    HA   ASP  26           HA       ASP  26   6.234  -8.546 -11.842
  169   1HB   ASP  26          2HB       ASP  26   3.555  -9.438 -10.754
  170   2HB   ASP  26          1HB       ASP  26   4.108  -9.726 -12.401
  171    H    THR  27           H        THR  27   3.329  -7.118 -10.379
  172    HA   THR  27           HA       THR  27   2.989  -5.475 -12.782
  173    HB   THR  27           HB       THR  27   0.996  -6.642 -12.061
  174    HG1  THR  27           HG1      THR  27   0.314  -4.786 -12.888
  175   1HG2  THR  27          1HG2      THR  27   1.489  -6.927  -9.704
  176   2HG2  THR  27          2HG2      THR  27  -0.085  -6.157  -9.914
  177   3HG2  THR  27          3HG2      THR  27   1.313  -5.192  -9.442
  178    H    GLY  28           H        GLY  28   4.146  -5.288  -9.566
  179   1HA   GLY  28          2HA       GLY  28   5.350  -3.497  -8.671
  180   2HA   GLY  28          1HA       GLY  28   4.725  -2.467  -9.951
  181    H    LEU  29           H        LEU  29   2.737  -4.473  -7.867
  182    HA   LEU  29           HA       LEU  29   1.534  -2.005  -6.813
  183   1HB   LEU  29          2HB       LEU  29   0.354  -4.781  -6.959
  184   2HB   LEU  29          1HB       LEU  29  -0.456  -3.361  -6.328
  185    HG   LEU  29           HG       LEU  29   0.320  -3.901  -9.189
  186   1HD1  LEU  29          1HD1      LEU  29  -2.347  -3.464  -7.860
  187   2HD1  LEU  29          2HD1      LEU  29  -1.708  -5.007  -8.425
  188   3HD1  LEU  29          3HD1      LEU  29  -2.079  -3.730  -9.583
  189   1HD2  LEU  29          1HD2      LEU  29   0.754  -1.554  -8.642
  190   2HD2  LEU  29          2HD2      LEU  29  -0.897  -1.396  -8.039
  191   3HD2  LEU  29          3HD2      LEU  29  -0.607  -1.737  -9.746
  192    H    VAL  30           H        VAL  30   0.705  -2.121  -4.585
  193    HA   VAL  30           HA       VAL  30   2.359  -3.856  -2.863
  194    HB   VAL  30           HB       VAL  30   1.503  -1.014  -2.272
  195   1HG1  VAL  30          1HG1      VAL  30   3.252  -2.915  -0.719
  196   2HG1  VAL  30          2HG1      VAL  30   1.632  -2.384  -0.269
  197   3HG1  VAL  30          3HG1      VAL  30   2.960  -1.224  -0.311
  198   1HG2  VAL  30          1HG2      VAL  30   4.234  -2.111  -2.944
  199   2HG2  VAL  30          2HG2      VAL  30   3.883  -0.456  -2.445
  200   3HG2  VAL  30          3HG2      VAL  30   3.249  -1.070  -3.973
  201    H    SER  31           H        SER  31   1.063  -5.296  -1.940
  202    HA   SER  31           HA       SER  31  -1.751  -4.757  -1.565
  203   1HB   SER  31          2HB       SER  31  -0.189  -7.214  -0.749
  204   2HB   SER  31          1HB       SER  31  -1.931  -7.084  -0.992
  205    HG   SER  31           HG       SER  31  -0.073  -7.712  -2.777
  206    H    TYR  32           H        TYR  32  -2.120  -3.381   0.067
  207    HA   TYR  32           HA       TYR  32  -0.780  -3.816   2.637
  208   1HB   TYR  32          2HB       TYR  32  -1.532  -1.619   3.276
  209   2HB   TYR  32          1HB       TYR  32  -0.830  -1.504   1.669
  210    HD1  TYR  32           HD1      TYR  32  -2.514  -1.599  -0.325
  211    HD2  TYR  32           HD2      TYR  32  -3.632  -0.708   3.679
  212    HE1  TYR  32           HE1      TYR  32  -4.557  -0.501  -1.143
  213    HE2  TYR  32           HE2      TYR  32  -5.673   0.389   2.870
  214    HH   TYR  32           HH       TYR  32  -6.767   0.109  -0.345
  215    H    HIS  33           H        HIS  33  -2.439  -3.185   4.538
  216    HA   HIS  33           HA       HIS  33  -4.825  -4.843   4.069
  217   1HB   HIS  33          2HB       HIS  33  -3.006  -4.830   6.477
  218   2HB   HIS  33          1HB       HIS  33  -4.589  -5.590   6.454
  219    HD1  HIS  33           HD1      HIS  33  -1.535  -6.818   6.700
  220    HD2  HIS  33           HD2      HIS  33  -4.317  -7.231   3.637
  221    HE1  HIS  33           HE1      HIS  33  -0.912  -8.940   5.496
  222    HE2  HIS  33           HE2      HIS  33  -2.788  -9.306   3.847
  223    H    ASP  34           H        ASP  34  -6.680  -3.968   4.611
  224    HA   ASP  34           HA       ASP  34  -7.006  -1.508   5.992
  225   1HB   ASP  34          2HB       ASP  34  -8.709  -3.565   4.828
  226   2HB   ASP  34          1HB       ASP  34  -9.348  -3.011   6.367
  227    H    GLN  35           H        GLN  35  -7.655  -1.158   8.178
  228    HA   GLN  35           HA       GLN  35  -6.971  -3.207  10.079
  229   1HB   GLN  35          2HB       GLN  35  -8.503  -0.630  10.519
  230   2HB   GLN  35          1HB       GLN  35  -7.820  -1.649  11.777
  231   1HG   GLN  35          2HG       GLN  35  -5.567  -1.221  10.717
  232   2HG   GLN  35          1HG       GLN  35  -6.367   0.018   9.751
  233   1HE2  GLN  35          1HE2      GLN  35  -5.268  -0.904  12.898
  234   2HE2  GLN  35          2HE2      GLN  35  -5.484   0.642  13.650
  235    H    GLN  36           H        GLN  36  -9.499  -2.607   8.081
  236    HA   GLN  36           HA       GLN  36 -11.631  -3.772   9.626
  237   1HB   GLN  36          2HB       GLN  36 -12.006  -2.024   7.913
  238   2HB   GLN  36          1HB       GLN  36 -11.408  -3.117   6.679
  239   1HG   GLN  36          2HG       GLN  36 -13.284  -4.592   7.015
  240   2HG   GLN  36          1HG       GLN  36 -13.861  -3.600   8.353
  241   1HE2  GLN  36          1HE2      GLN  36 -12.473  -2.173   5.505
  242   2HE2  GLN  36          2HE2      GLN  36 -13.943  -1.513   4.867
  243    H    GLY  37           H        GLY  37  -8.960  -4.933   7.942
  244   1HA   GLY  37          2HA       GLY  37  -8.355  -7.203   7.809
  245   2HA   GLY  37          1HA       GLY  37 -10.047  -7.643   7.981
  246    H    ASN  38           H        ASN  38  -8.888  -5.272   5.676
  247    HA   ASN  38           HA       ASN  38  -9.648  -7.124   3.512
  248   1HB   ASN  38          2HB       ASN  38  -9.911  -4.137   3.741
  249   2HB   ASN  38          1HB       ASN  38  -9.958  -4.948   2.179
  250   1HD2  ASN  38          1HD2      ASN  38 -11.992  -3.431   3.697
  251   2HD2  ASN  38          2HD2      ASN  38 -13.358  -4.493   3.809
  252    H    ALA  39           H        ALA  39  -8.125  -7.740   2.132
  253    HA   ALA  39           HA       ALA  39  -5.565  -6.346   2.088
  254   1HB   ALA  39          1HB       ALA  39  -5.587  -8.798   2.148
  255   2HB   ALA  39          2HB       ALA  39  -4.802  -8.191   0.691
  256   3HB   ALA  39          3HB       ALA  39  -6.445  -8.826   0.607
  257    H    MET  40           H        MET  40  -5.139  -4.790   0.669
  258    HA   MET  40           HA       MET  40  -6.497  -4.806  -1.933
  259   1HB   MET  40          2HB       MET  40  -6.341  -2.468  -0.024
  260   2HB   MET  40          1HB       MET  40  -6.747  -2.300  -1.727
  261   1HG   MET  40          2HG       MET  40  -8.710  -3.662  -1.431
  262   2HG   MET  40          1HG       MET  40  -8.282  -3.963   0.253
  263   1HE   MET  40          1HE       MET  40  -8.628  -2.324   2.193
  264   2HE   MET  40          2HE       MET  40  -8.887  -0.590   1.991
  265   3HE   MET  40          3HE       MET  40  -7.375  -1.325   1.457
  266    H    GLN  41           H        GLN  41  -5.377  -3.438  -3.544
  267    HA   GLN  41           HA       GLN  41  -2.491  -3.338  -2.917
  268   1HB   GLN  41          2HB       GLN  41  -3.707  -3.952  -5.611
  269   2HB   GLN  41          1HB       GLN  41  -2.008  -4.029  -5.175
  270   1HG   GLN  41          2HG       GLN  41  -2.555  -5.872  -3.602
  271   2HG   GLN  41          1HG       GLN  41  -4.210  -5.840  -4.213
  272   1HE2  GLN  41          1HE2      GLN  41  -0.931  -6.726  -4.863
  273   2HE2  GLN  41          2HE2      GLN  41  -1.236  -7.611  -6.325
  274    H    ILE  42           H        ILE  42  -1.630  -1.359  -3.064
  275    HA   ILE  42           HA       ILE  42  -2.815   0.535  -4.983
  276    HB   ILE  42           HB       ILE  42  -1.796   2.333  -3.852
  277   1HG1  ILE  42          2HG1      ILE  42  -0.296   0.576  -1.933
  278   2HG1  ILE  42          1HG1      ILE  42   0.390   0.948  -3.512
  279   1HG2  ILE  42          1HG2      ILE  42  -2.667   0.407  -1.704
  280   2HG2  ILE  42          2HG2      ILE  42  -3.730   1.432  -2.671
  281   3HG2  ILE  42          3HG2      ILE  42  -2.577   2.163  -1.554
  282   1HD1  ILE  42          1HD1      ILE  42  -0.538   3.045  -1.574
  283   2HD1  ILE  42          2HD1      ILE  42   0.405   3.268  -3.052
  284   3HD1  ILE  42          3HD1      ILE  42   1.118   2.450  -1.662
  285    H    ASN  43           H        ASN  43  -0.840   2.047  -5.834
  286    HA   ASN  43           HA       ASN  43   0.911   0.227  -7.242
  287   1HB   ASN  43          2HB       ASN  43   0.791   3.249  -7.261
  288   2HB   ASN  43          1HB       ASN  43   1.800   2.277  -8.316
  289   1HD2  ASN  43          1HD2      ASN  43  -1.241   3.641  -7.784
  290   2HD2  ASN  43          2HD2      ASN  43  -2.052   2.985  -9.170
  291    H    ARG  44           H        ARG  44   3.131  -0.003  -6.972
  292    HA   ARG  44           HA       ARG  44   4.295   0.831  -4.494
  293   1HB   ARG  44          2HB       ARG  44   4.984  -1.228  -5.759
  294   2HB   ARG  44          1HB       ARG  44   5.720  -0.185  -6.968
  295   1HG   ARG  44          2HG       ARG  44   7.338   0.604  -5.436
  296   2HG   ARG  44          1HG       ARG  44   6.491  -0.112  -4.067
  297   1HD   ARG  44          2HD       ARG  44   8.434  -1.435  -4.634
  298   2HD   ARG  44          1HD       ARG  44   6.963  -2.347  -4.964
  299    HE   ARG  44           HE       ARG  44   7.911  -0.950  -7.276
  300   1HH1  ARG  44          1HH1      ARG  44   8.376  -3.813  -5.317
  301   2HH1  ARG  44          2HH1      ARG  44   9.085  -4.752  -6.595
  302   1HH2  ARG  44          1HH2      ARG  44   8.851  -2.173  -8.977
  303   2HH2  ARG  44          2HH2      ARG  44   9.347  -3.818  -8.682
  304    H    ASP  45           H        ASP  45   3.694   2.277  -7.423
  305    HA   ASP  45           HA       ASP  45   5.699   4.302  -7.438
  306   1HB   ASP  45          2HB       ASP  45   4.397   3.631  -9.432
  307   2HB   ASP  45          1HB       ASP  45   2.929   4.218  -8.667
  308    H    ASP  46           H        ASP  46   2.855   3.708  -5.615
  309    HA   ASP  46           HA       ASP  46   2.509   6.546  -4.975
  310   1HB   ASP  46          2HB       ASP  46   0.658   4.193  -4.589
  311   2HB   ASP  46          1HB       ASP  46   0.334   5.797  -3.943
  312    H    VAL  47           H        VAL  47   3.818   3.701  -3.595
  313    HA   VAL  47           HA       VAL  47   3.390   4.530  -0.862
  314    HB   VAL  47           HB       VAL  47   5.140   2.809  -0.289
  315   1HG1  VAL  47          1HG1      VAL  47   2.733   2.300  -0.264
  316   2HG1  VAL  47          2HG1      VAL  47   3.713   0.901  -0.702
  317   3HG1  VAL  47          3HG1      VAL  47   2.843   1.791  -1.951
  318   1HG2  VAL  47          1HG2      VAL  47   4.951   2.158  -3.222
  319   2HG2  VAL  47          2HG2      VAL  47   5.819   1.229  -1.999
  320   3HG2  VAL  47          3HG2      VAL  47   6.350   2.860  -2.412
  321    H    SER  48           H        SER  48   5.195   5.083   0.602
  322    HA   SER  48           HA       SER  48   7.512   6.286  -0.649
  323   1HB   SER  48          2HB       SER  48   5.838   8.033  -0.929
  324   2HB   SER  48          1HB       SER  48   5.436   7.954   0.784
  325    HG   SER  48           HG       SER  48   8.029   8.606  -0.188
  326    H    GLN  49           H        GLN  49   5.677   6.413   2.432
  327    HA   GLN  49           HA       GLN  49   8.255   6.053   3.813
  328   1HB   GLN  49          2HB       GLN  49   7.364   8.343   4.024
  329   2HB   GLN  49          1HB       GLN  49   5.878   7.697   4.703
  330   1HG   GLN  49          2HG       GLN  49   7.152   6.811   6.606
  331   2HG   GLN  49          1HG       GLN  49   8.621   7.519   5.929
  332   1HE2  GLN  49          1HE2      GLN  49   5.570   8.161   7.450
  333   2HE2  GLN  49          2HE2      GLN  49   5.873   9.818   7.852
  334    H    ILE  50           H        ILE  50   8.198   3.941   4.314
  335    HA   ILE  50           HA       ILE  50   5.868   2.970   5.837
  336    HB   ILE  50           HB       ILE  50   7.893   1.328   4.298
  337   1HG1  ILE  50          2HG1      ILE  50   4.983   1.894   3.679
  338   2HG1  ILE  50          1HG1      ILE  50   6.353   2.622   2.847
  339   1HG2  ILE  50          1HG2      ILE  50   6.389  -0.558   4.764
  340   2HG2  ILE  50          2HG2      ILE  50   5.381   0.499   5.751
  341   3HG2  ILE  50          3HG2      ILE  50   7.037   0.146   6.245
  342   1HD1  ILE  50          1HD1      ILE  50   7.034   0.434   2.035
  343   2HD1  ILE  50          2HD1      ILE  50   5.377   0.806   1.559
  344   3HD1  ILE  50          3HD1      ILE  50   5.683  -0.310   2.890
  345    H    ILE  51           H        ILE  51   6.287   3.054   7.945
  346    HA   ILE  51           HA       ILE  51   9.062   2.733   8.850
  347    HB   ILE  51           HB       ILE  51   6.737   3.828  10.440
  348   1HG1  ILE  51          2HG1      ILE  51   8.846   5.337   8.871
  349   2HG1  ILE  51          1HG1      ILE  51   7.153   5.197   8.417
  350   1HG2  ILE  51          1HG2      ILE  51   8.583   3.056  11.807
  351   2HG2  ILE  51          2HG2      ILE  51   8.524   4.819  11.822
  352   3HG2  ILE  51          3HG2      ILE  51   9.724   3.985  10.833
  353   1HD1  ILE  51          1HD1      ILE  51   7.636   7.348   9.440
  354   2HD1  ILE  51          2HD1      ILE  51   8.196   6.535  10.903
  355   3HD1  ILE  51          3HD1      ILE  51   6.503   6.415  10.420
  356    H    GLU  52           H        GLU  52   6.146   1.069   8.672
  357    HA   GLU  52           HA       GLU  52   5.883  -0.318  11.051
  358   1HB   GLU  52          2HB       GLU  52   5.545  -1.655   8.373
  359   2HB   GLU  52          1HB       GLU  52   4.650  -1.945   9.857
  360   1HG   GLU  52          2HG       GLU  52   3.546   0.192   9.650
  361   2HG   GLU  52          1HG       GLU  52   4.498   0.566   8.211
  362    H    ARG  53           H        ARG  53   7.191  -1.889   8.185
  363    HA   ARG  53           HA       ARG  53   8.868  -3.339   7.814
  364   1HB   ARG  53          2HB       ARG  53  10.156  -1.306   8.363
  365   2HB   ARG  53          1HB       ARG  53  10.220  -1.818  10.040
  366   1HG   ARG  53          2HG       ARG  53  11.609  -3.670   9.508
  367   2HG   ARG  53          1HG       ARG  53  11.361  -3.436   7.775
  368   1HD   ARG  53          2HD       ARG  53  13.554  -2.607   8.570
  369   2HD   ARG  53          1HD       ARG  53  12.561  -1.357   7.823
  370    HE   ARG  53           HE       ARG  53  12.817  -1.653  10.753
  371   1HH1  ARG  53          1HH1      ARG  53  12.651   0.312   7.866
  372   2HH1  ARG  53          2HH1      ARG  53  12.940   1.802   8.711
  373   1HH2  ARG  53          1HH2      ARG  53  13.196   0.338  11.877
  374   2HH2  ARG  53          2HH2      ARG  53  13.233   1.820  10.960
  Start of MODEL    8
    1    H    ASP   4           H        ASP   4  -1.428  -3.594  15.037
    2    HA   ASP   4           HA       ASP   4  -1.336  -3.566  12.178
    3   1HB   ASP   4          2HB       ASP   4  -2.648  -1.499  12.367
    4   2HB   ASP   4          1HB       ASP   4  -3.321  -2.780  13.367
    5    H    TYR   5           H        TYR   5  -0.855  -1.364  11.119
    6    HA   TYR   5           HA       TYR   5   1.553  -0.098  12.132
    7   1HB   TYR   5          2HB       TYR   5   2.174  -2.296  10.940
    8   2HB   TYR   5          1HB       TYR   5   1.659  -1.504   9.460
    9    HD1  TYR   5           HD2      TYR   5   3.812  -0.622  12.395
   10    HD2  TYR   5           HD1      TYR   5   3.386  -0.720   8.162
   11    HE1  TYR   5           HE2      TYR   5   6.063   0.336  12.153
   12    HE2  TYR   5           HE1      TYR   5   5.638   0.238   7.909
   13    HH   TYR   5           HH       TYR   5   7.270   1.495   9.141
   14    H    VAL   6           H        VAL   6   2.369   1.333  10.046
   15    HA   VAL   6           HA       VAL   6  -0.017   2.568   8.885
   16    HB   VAL   6           HB       VAL   6   0.518   3.822  10.928
   17   1HG1  VAL   6          1HG1      VAL   6   2.588   5.115  11.110
   18   2HG1  VAL   6          2HG1      VAL   6   3.189   4.352   9.636
   19   3HG1  VAL   6          3HG1      VAL   6   2.897   3.379  11.078
   20   1HG2  VAL   6          1HG2      VAL   6   0.661   6.061   9.934
   21   2HG2  VAL   6          2HG2      VAL   6  -0.476   5.020   9.079
   22   3HG2  VAL   6          3HG2      VAL   6   1.117   5.335   8.392
   23    H    MET   7           H        MET   7   0.266   3.438   6.879
   24    HA   MET   7           HA       MET   7   2.977   3.286   5.737
   25   1HB   MET   7          2HB       MET   7   1.631   1.413   4.923
   26   2HB   MET   7          1HB       MET   7   0.363   2.522   4.417
   27   1HG   MET   7          2HG       MET   7   1.867   3.504   2.770
   28   2HG   MET   7          1HG       MET   7   3.154   2.416   3.289
   29   1HE   MET   7          1HE       MET   7  -0.669   1.619   2.936
   30   2HE   MET   7          2HE       MET   7  -0.752   0.957   1.303
   31   3HE   MET   7          3HE       MET   7  -0.382   2.663   1.543
   32    H    ALA   8           H        ALA   8   3.657   5.246   5.232
   33    HA   ALA   8           HA       ALA   8   1.736   7.352   4.609
   34   1HB   ALA   8          1HB       ALA   8   3.647   8.867   4.751
   35   2HB   ALA   8          2HB       ALA   8   4.736   7.490   4.940
   36   3HB   ALA   8          3HB       ALA   8   3.542   7.850   6.189
   37    H    THR   9           H        THR   9   1.208   7.781   2.559
   38    HA   THR   9           HA       THR   9   2.856   6.598   0.452
   39    HB   THR   9           HB       THR   9   0.921   7.004  -1.026
   40    HG1  THR   9           HG1      THR   9  -0.585   8.328  -0.382
   41   1HG2  THR   9          1HG2      THR   9  -0.547   5.309  -0.055
   42   2HG2  THR   9          2HG2      THR   9   0.238   5.516   1.511
   43   3HG2  THR   9          3HG2      THR   9   1.148   4.866   0.147
   44    H    LYS  10           H        LYS  10   2.531   7.882  -1.689
   45    HA   LYS  10           HA       LYS  10   4.119  10.071  -1.883
   46   1HB   LYS  10          2HB       LYS  10   3.269   8.781  -3.773
   47   2HB   LYS  10          1HB       LYS  10   1.649   9.397  -3.492
   48   1HG   LYS  10          2HG       LYS  10   2.324  11.610  -4.133
   49   2HG   LYS  10          1HG       LYS  10   4.009  11.095  -4.264
   50   1HD   LYS  10          2HD       LYS  10   2.958  11.209  -6.466
   51   2HD   LYS  10          1HD       LYS  10   3.393   9.544  -6.060
   52   1HE   LYS  10          2HE       LYS  10   1.080   9.124  -5.363
   53   2HE   LYS  10          1HE       LYS  10   0.656  10.780  -5.789
   54   1HZ   LYS  10          1HZ       LYS  10   1.265  10.294  -8.085
   55   2HZ   LYS  10          2HZ       LYS  10   0.035   9.271  -7.535
   56   3HZ   LYS  10          3HZ       LYS  10   1.621   8.688  -7.665
   57    H    ASP  11           H        ASP  11   0.665  10.034  -1.229
   58    HA   ASP  11           HA       ASP  11   0.143  12.776  -1.632
   59   1HB   ASP  11          2HB       ASP  11  -1.424  11.035   0.258
   60   2HB   ASP  11          1HB       ASP  11  -2.010  12.333  -0.772
   61    H    GLY  12           H        GLY  12   1.626  11.091   0.966
   62   1HA   GLY  12          2HA       GLY  12   2.622  12.076   2.855
   63   2HA   GLY  12          1HA       GLY  12   1.646  13.518   2.594
   64    H    ARG  13           H        ARG  13  -0.382  10.994   2.232
   65    HA   ARG  13           HA       ARG  13  -1.568  11.408   4.831
   66   1HB   ARG  13          2HB       ARG  13  -3.397   9.989   3.971
   67   2HB   ARG  13          1HB       ARG  13  -3.032  11.326   2.890
   68   1HG   ARG  13          2HG       ARG  13  -1.727   9.785   1.471
   69   2HG   ARG  13          1HG       ARG  13  -2.181   8.461   2.542
   70   1HD   ARG  13          2HD       ARG  13  -4.492   8.705   1.984
   71   2HD   ARG  13          1HD       ARG  13  -4.174  10.192   1.088
   72    HE   ARG  13           HE       ARG  13  -2.640   8.324  -0.165
   73   1HH1  ARG  13          1HH1      ARG  13  -6.047   8.580   0.607
   74   2HH1  ARG  13          2HH1      ARG  13  -6.555   7.635  -0.765
   75   1HH2  ARG  13          1HH2      ARG  13  -3.306   7.101  -1.975
   76   2HH2  ARG  13          2HH2      ARG  13  -4.995   6.789  -2.217
   77    H    MET  14           H        MET  14  -1.798   9.900   6.431
   78    HA   MET  14           HA       MET  14  -0.012   7.590   6.241
   79   1HB   MET  14          2HB       MET  14  -1.327   8.915   8.616
   80   2HB   MET  14          1HB       MET  14  -0.333   7.468   8.719
   81   1HG   MET  14          2HG       MET  14   1.576   8.703   7.852
   82   2HG   MET  14          1HG       MET  14   0.584  10.150   7.711
   83   1HE   MET  14          1HE       MET  14   2.553  11.389   9.101
   84   2HE   MET  14          2HE       MET  14   3.409   9.857   9.276
   85   3HE   MET  14          3HE       MET  14   3.088  10.853  10.696
   86    H    ILE  15           H        ILE  15  -1.034   5.909   5.365
   87    HA   ILE  15           HA       ILE  15  -3.845   5.431   5.883
   88    HB   ILE  15           HB       ILE  15  -1.846   3.808   4.290
   89   1HG1  ILE  15          2HG1      ILE  15  -3.983   5.754   3.379
   90   2HG1  ILE  15          1HG1      ILE  15  -2.248   6.058   3.368
   91   1HG2  ILE  15          1HG2      ILE  15  -3.786   2.671   3.339
   92   2HG2  ILE  15          2HG2      ILE  15  -4.854   3.598   4.392
   93   3HG2  ILE  15          3HG2      ILE  15  -3.715   2.444   5.087
   94   1HD1  ILE  15          1HD1      ILE  15  -1.947   4.264   1.738
   95   2HD1  ILE  15          2HD1      ILE  15  -3.059   5.502   1.153
   96   3HD1  ILE  15          3HD1      ILE  15  -3.686   3.966   1.750
   97    H    LEU  16           H        LEU  16  -4.614   4.163   7.435
   98    HA   LEU  16           HA       LEU  16  -2.817   2.803   9.214
   99   1HB   LEU  16          2HB       LEU  16  -5.831   2.963   9.139
  100   2HB   LEU  16          1HB       LEU  16  -4.939   2.090  10.365
  101    HG   LEU  16           HG       LEU  16  -5.536   4.153  11.339
  102   1HD1  LEU  16          1HD1      LEU  16  -3.254   3.475  11.809
  103   2HD1  LEU  16          2HD1      LEU  16  -3.402   5.232  11.786
  104   3HD1  LEU  16          3HD1      LEU  16  -2.680   4.390  10.413
  105   1HD2  LEU  16          1HD2      LEU  16  -6.148   5.387   9.350
  106   2HD2  LEU  16          2HD2      LEU  16  -4.456   5.502   8.865
  107   3HD2  LEU  16          3HD2      LEU  16  -5.015   6.332  10.317
  108    H    THR  17           H        THR  17  -2.162   0.791   9.066
  109    HA   THR  17           HA       THR  17  -3.645  -1.045   7.303
  110    HB   THR  17           HB       THR  17  -1.439  -2.054   6.689
  111    HG1  THR  17           HG1      THR  17  -0.536  -0.006   8.398
  112   1HG2  THR  17          1HG2      THR  17  -1.724   0.887   6.049
  113   2HG2  THR  17          2HG2      THR  17  -2.470  -0.448   5.170
  114   3HG2  THR  17          3HG2      THR  17  -0.717  -0.257   5.165
  115    H    ASP  18           H        ASP  18  -3.468  -3.312   7.862
  116    HA   ASP  18           HA       ASP  18  -3.155  -3.867  10.664
  117   1HB   ASP  18          2HB       ASP  18  -4.711  -5.134   9.166
  118   2HB   ASP  18          1HB       ASP  18  -3.309  -5.824   8.357
  119    H    GLY  19           H        GLY  19  -1.139  -3.528   8.037
  120   1HA   GLY  19          2HA       GLY  19   1.180  -3.061   8.529
  121   2HA   GLY  19          1HA       GLY  19   1.169  -4.435   9.629
  122    H    LYS  20           H        LYS  20   3.103  -4.158   7.483
  123    HA   LYS  20           HA       LYS  20   4.119  -5.797   6.293
  124   1HB   LYS  20          2HB       LYS  20   1.743  -7.512   7.007
  125   2HB   LYS  20          1HB       LYS  20   3.237  -8.083   6.268
  126   1HG   LYS  20          2HG       LYS  20   4.431  -7.106   8.284
  127   2HG   LYS  20          1HG       LYS  20   2.840  -6.949   9.023
  128   1HD   LYS  20          2HD       LYS  20   3.782  -8.988   9.797
  129   2HD   LYS  20          1HD       LYS  20   2.524  -9.405   8.631
  130   1HE   LYS  20          2HE       LYS  20   4.077  -9.985   6.986
  131   2HE   LYS  20          1HE       LYS  20   5.393  -9.139   7.799
  132   1HZ   LYS  20          1HZ       LYS  20   5.388 -10.795   9.523
  133   2HZ   LYS  20          2HZ       LYS  20   5.542 -11.564   8.018
  134   3HZ   LYS  20          3HZ       LYS  20   4.055 -11.580   8.833
  135    HA   PRO  21           HA       PRO  21   1.607  -4.733   2.645
  136   1HB   PRO  21          2HB       PRO  21   3.448  -3.209   1.401
  137   2HB   PRO  21          1HB       PRO  21   2.412  -2.573   2.683
  138   1HG   PRO  21          2HG       PRO  21   5.273  -3.383   2.785
  139   2HG   PRO  21          1HG       PRO  21   4.439  -2.078   3.645
  140   1HD   PRO  21          2HD       PRO  21   5.098  -4.569   4.709
  141   2HD   PRO  21          1HD       PRO  21   3.914  -3.434   5.385
  142    H    GLU  22           H        GLU  22   1.491  -6.392   1.285
  143    HA   GLU  22           HA       GLU  22   3.849  -7.846   0.466
  144   1HB   GLU  22          2HB       GLU  22   1.757  -9.052   0.915
  145   2HB   GLU  22          1HB       GLU  22   0.949  -8.138  -0.350
  146   1HG   GLU  22          2HG       GLU  22   1.449 -10.255  -1.252
  147   2HG   GLU  22          1HG       GLU  22   2.584  -9.116  -1.972
  148    H    ILE  23           H        ILE  23   5.087  -6.639  -0.835
  149    HA   ILE  23           HA       ILE  23   3.904  -5.063  -2.945
  150    HB   ILE  23           HB       ILE  23   6.833  -5.596  -2.421
  151   1HG1  ILE  23          2HG1      ILE  23   5.065  -3.323  -1.485
  152   2HG1  ILE  23          1HG1      ILE  23   5.783  -4.561  -0.466
  153   1HG2  ILE  23          1HG2      ILE  23   6.379  -4.809  -4.676
  154   2HG2  ILE  23          2HG2      ILE  23   7.174  -3.545  -3.736
  155   3HG2  ILE  23          3HG2      ILE  23   5.438  -3.462  -4.035
  156   1HD1  ILE  23          1HD1      ILE  23   7.310  -2.512  -2.053
  157   2HD1  ILE  23          2HD1      ILE  23   8.005  -3.735  -0.987
  158   3HD1  ILE  23          3HD1      ILE  23   6.993  -2.454  -0.320
  159    H    ASP  24           H        ASP  24   3.146  -6.140  -4.630
  160    HA   ASP  24           HA       ASP  24   4.153  -8.649  -5.518
  161   1HB   ASP  24          2HB       ASP  24   2.216  -6.640  -6.628
  162   2HB   ASP  24          1HB       ASP  24   2.766  -7.979  -7.631
  163    H    ASP  25           H        ASP  25   5.978  -8.967  -6.559
  164    HA   ASP  25           HA       ASP  25   7.608  -6.708  -7.181
  165   1HB   ASP  25          2HB       ASP  25   8.449  -8.809  -6.118
  166   2HB   ASP  25          1HB       ASP  25   8.184  -9.640  -7.645
  167    H    ASP  26           H        ASP  26   5.644  -8.890  -9.031
  168    HA   ASP  26           HA       ASP  26   7.063  -8.338 -11.488
  169   1HB   ASP  26          2HB       ASP  26   6.111 -10.586 -11.067
  170   2HB   ASP  26          1HB       ASP  26   4.495  -9.887 -11.097
  171    H    THR  27           H        THR  27   3.777  -7.737 -10.245
  172    HA   THR  27           HA       THR  27   3.167  -6.087 -12.539
  173    HB   THR  27           HB       THR  27   1.381  -7.472 -11.674
  174    HG1  THR  27           HG1      THR  27   0.793  -5.425 -12.549
  175   1HG2  THR  27          1HG2      THR  27   2.076  -7.568  -9.329
  176   2HG2  THR  27          2HG2      THR  27   0.381  -7.105  -9.484
  177   3HG2  THR  27          3HG2      THR  27   1.600  -5.882  -9.123
  178    H    GLY  28           H        GLY  28   4.158  -5.602  -9.219
  179   1HA   GLY  28          2HA       GLY  28   5.176  -3.643  -8.425
  180   2HA   GLY  28          1HA       GLY  28   4.532  -2.776  -9.809
  181    H    LEU  29           H        LEU  29   2.431  -4.785  -7.943
  182    HA   LEU  29           HA       LEU  29   1.057  -2.384  -6.965
  183   1HB   LEU  29          2HB       LEU  29   0.032  -5.224  -7.072
  184   2HB   LEU  29          1HB       LEU  29  -0.896  -3.793  -6.671
  185    HG   LEU  29           HG       LEU  29   0.264  -4.481  -9.369
  186   1HD1  LEU  29          1HD1      LEU  29  -2.576  -4.293  -8.377
  187   2HD1  LEU  29          2HD1      LEU  29  -1.707  -5.769  -8.796
  188   3HD1  LEU  29          3HD1      LEU  29  -2.089  -4.587 -10.046
  189   1HD2  LEU  29          1HD2      LEU  29  -0.866  -2.467 -10.173
  190   2HD2  LEU  29          2HD2      LEU  29   0.391  -2.081  -8.998
  191   3HD2  LEU  29          3HD2      LEU  29  -1.306  -2.051  -8.517
  192    H    VAL  30           H        VAL  30   0.687  -2.059  -4.805
  193    HA   VAL  30           HA       VAL  30   2.136  -3.857  -2.990
  194    HB   VAL  30           HB       VAL  30   1.097  -1.072  -2.435
  195   1HG1  VAL  30          1HG1      VAL  30   1.317  -2.459  -0.427
  196   2HG1  VAL  30          2HG1      VAL  30   2.520  -1.169  -0.450
  197   3HG1  VAL  30          3HG1      VAL  30   2.988  -2.819  -0.860
  198   1HG2  VAL  30          1HG2      VAL  30   3.457  -0.383  -2.583
  199   2HG2  VAL  30          2HG2      VAL  30   2.842  -0.997  -4.117
  200   3HG2  VAL  30          3HG2      VAL  30   3.882  -2.009  -3.115
  201    H    SER  31           H        SER  31   0.791  -5.452  -2.437
  202    HA   SER  31           HA       SER  31  -2.009  -4.954  -1.856
  203   1HB   SER  31          2HB       SER  31  -0.428  -7.524  -1.590
  204   2HB   SER  31          1HB       SER  31  -2.185  -7.359  -1.669
  205    HG   SER  31           HG       SER  31  -0.288  -7.279  -3.697
  206    H    TYR  32           H        TYR  32  -2.511  -4.138   0.108
  207    HA   TYR  32           HA       TYR  32  -0.905  -5.083   2.391
  208   1HB   TYR  32          2HB       TYR  32  -1.110  -2.917   3.444
  209   2HB   TYR  32          1HB       TYR  32  -0.439  -2.708   1.831
  210    HD1  TYR  32           HD2      TYR  32  -1.994  -1.923  -0.018
  211    HD2  TYR  32           HD1      TYR  32  -3.059  -1.792   4.094
  212    HE1  TYR  32           HE2      TYR  32  -3.735  -0.264  -0.525
  213    HE2  TYR  32           HE1      TYR  32  -4.797  -0.129   3.598
  214    HH   TYR  32           HH       TYR  32  -5.326   1.522   1.915
  215    H    HIS  33           H        HIS  33  -1.994  -5.019   4.473
  216    HA   HIS  33           HA       HIS  33  -4.774  -5.846   4.196
  217   1HB   HIS  33          2HB       HIS  33  -2.863  -6.010   6.538
  218   2HB   HIS  33          1HB       HIS  33  -4.546  -6.521   6.608
  219    HD1  HIS  33           HD1      HIS  33  -1.639  -8.164   6.712
  220    HD2  HIS  33           HD2      HIS  33  -4.704  -8.311   3.902
  221    HE1  HIS  33           HE1      HIS  33  -1.404 -10.388   5.563
  222    HE2  HIS  33           HE2      HIS  33  -3.398 -10.543   4.030
  223    H    ASP  34           H        ASP  34  -6.383  -4.558   4.627
  224    HA   ASP  34           HA       ASP  34  -6.087  -1.863   5.396
  225   1HB   ASP  34          2HB       ASP  34  -8.526  -3.645   5.391
  226   2HB   ASP  34          1HB       ASP  34  -8.575  -1.909   5.641
  227    H    GLN  35           H        GLN  35  -6.972  -0.809   7.274
  228    HA   GLN  35           HA       GLN  35  -6.663  -2.204   9.753
  229   1HB   GLN  35          2HB       GLN  35  -7.546  -0.119  10.775
  230   2HB   GLN  35          1HB       GLN  35  -6.190   0.167   9.697
  231   1HG   GLN  35          2HG       GLN  35  -7.493   1.823   8.935
  232   2HG   GLN  35          1HG       GLN  35  -8.231   0.533   7.986
  233   1HE2  GLN  35          1HE2      GLN  35  -8.573   2.625  10.745
  234   2HE2  GLN  35          2HE2      GLN  35 -10.269   2.370  10.985
  235    H    GLN  36           H        GLN  36  -9.140  -1.816   7.468
  236    HA   GLN  36           HA       GLN  36 -11.320  -2.505   9.228
  237   1HB   GLN  36          2HB       GLN  36 -11.559  -1.071   7.180
  238   2HB   GLN  36          1HB       GLN  36 -11.237  -2.497   6.206
  239   1HG   GLN  36          2HG       GLN  36 -13.611  -2.040   6.317
  240   2HG   GLN  36          1HG       GLN  36 -13.230  -3.571   7.104
  241   1HE2  GLN  36          1HE2      GLN  36 -14.179  -0.258   7.584
  242   2HE2  GLN  36          2HE2      GLN  36 -14.742  -0.445   9.211
  243    H    GLY  37           H        GLY  37  -8.839  -4.144   7.621
  244   1HA   GLY  37          2HA       GLY  37  -8.369  -6.418   8.049
  245   2HA   GLY  37          1HA       GLY  37 -10.077  -6.691   8.348
  246    H    ASN  38           H        ASN  38  -8.966  -4.972   5.506
  247    HA   ASN  38           HA       ASN  38  -9.739  -7.310   3.887
  248   1HB   ASN  38          2HB       ASN  38  -9.492  -4.472   2.871
  249   2HB   ASN  38          1HB       ASN  38 -10.247  -5.838   2.066
  250   1HD2  ASN  38          1HD2      ASN  38 -10.685  -3.175   4.068
  251   2HD2  ASN  38          2HD2      ASN  38 -12.339  -3.457   4.494
  252    H    ALA  39           H        ALA  39  -8.550  -7.124   1.618
  253    HA   ALA  39           HA       ALA  39  -5.767  -6.270   2.002
  254   1HB   ALA  39          1HB       ALA  39  -5.866  -8.703   2.360
  255   2HB   ALA  39          2HB       ALA  39  -4.937  -8.279   0.922
  256   3HB   ALA  39          3HB       ALA  39  -6.581  -8.897   0.759
  257    H    MET  40           H        MET  40  -5.582  -4.647   0.577
  258    HA   MET  40           HA       MET  40  -6.365  -5.194  -2.193
  259   1HB   MET  40          2HB       MET  40  -7.174  -2.843  -2.429
  260   2HB   MET  40          1HB       MET  40  -8.188  -3.868  -1.428
  261   1HG   MET  40          2HG       MET  40  -7.290  -2.847   0.578
  262   2HG   MET  40          1HG       MET  40  -6.188  -1.865  -0.395
  263   1HE   MET  40          1HE       MET  40  -7.217   0.230   1.037
  264   2HE   MET  40          2HE       MET  40  -8.387  -0.829   1.828
  265   3HE   MET  40          3HE       MET  40  -8.930   0.649   1.026
  266    H    GLN  41           H        GLN  41  -5.471  -3.346  -3.653
  267    HA   GLN  41           HA       GLN  41  -2.623  -3.243  -2.933
  268   1HB   GLN  41          2HB       GLN  41  -3.826  -3.368  -5.700
  269   2HB   GLN  41          1HB       GLN  41  -2.118  -3.453  -5.298
  270   1HG   GLN  41          2HG       GLN  41  -2.508  -5.655  -5.575
  271   2HG   GLN  41          1HG       GLN  41  -2.955  -5.532  -3.875
  272   1HE2  GLN  41          1HE2      GLN  41  -3.790  -7.445  -5.887
  273   2HE2  GLN  41          2HE2      GLN  41  -5.516  -7.350  -5.965
  274    H    ILE  42           H        ILE  42  -1.416  -1.437  -3.313
  275    HA   ILE  42           HA       ILE  42  -2.710   0.808  -4.729
  276    HB   ILE  42           HB       ILE  42  -1.359   2.397  -3.537
  277   1HG1  ILE  42          2HG1      ILE  42  -0.188   0.257  -1.790
  278   2HG1  ILE  42          1HG1      ILE  42   0.577   0.661  -3.326
  279   1HG2  ILE  42          1HG2      ILE  42  -2.531   0.456  -1.559
  280   2HG2  ILE  42          2HG2      ILE  42  -3.426   1.699  -2.431
  281   3HG2  ILE  42          3HG2      ILE  42  -2.187   2.159  -1.261
  282   1HD1  ILE  42          1HD1      ILE  42   0.814   2.968  -2.607
  283   2HD1  ILE  42          2HD1      ILE  42   1.594   1.858  -1.477
  284   3HD1  ILE  42          3HD1      ILE  42   0.033   2.575  -1.073
  285    H    ASN  43           H        ASN  43  -0.701   2.322  -5.504
  286    HA   ASN  43           HA       ASN  43   0.813   0.613  -7.304
  287   1HB   ASN  43          2HB       ASN  43  -0.346   2.803  -7.952
  288   2HB   ASN  43          1HB       ASN  43   0.956   3.619  -7.104
  289   1HD2  ASN  43          1HD2      ASN  43   0.233   3.768  -9.880
  290   2HD2  ASN  43          2HD2      ASN  43   1.624   3.260 -10.788
  291    H    ARG  44           H        ARG  44   3.045   0.411  -7.311
  292    HA   ARG  44           HA       ARG  44   4.447   0.758  -4.872
  293   1HB   ARG  44          2HB       ARG  44   4.953  -0.961  -6.646
  294   2HB   ARG  44          1HB       ARG  44   5.639   0.329  -7.621
  295   1HG   ARG  44          2HG       ARG  44   7.323   0.743  -5.913
  296   2HG   ARG  44          1HG       ARG  44   6.621  -0.522  -4.902
  297   1HD   ARG  44          2HD       ARG  44   8.564  -1.383  -6.068
  298   2HD   ARG  44          1HD       ARG  44   7.105  -2.168  -6.672
  299    HE   ARG  44           HE       ARG  44   7.991   0.146  -8.175
  300   1HH1  ARG  44          1HH1      ARG  44   8.191  -3.341  -7.846
  301   2HH1  ARG  44          2HH1      ARG  44   8.596  -3.598  -9.513
  302   1HH2  ARG  44          1HH2      ARG  44   8.509  -0.209 -10.367
  303   2HH2  ARG  44          2HH2      ARG  44   8.783  -1.829 -10.938
  304    H    ASP  45           H        ASP  45   3.989   2.744  -7.691
  305    HA   ASP  45           HA       ASP  45   6.041   4.648  -7.103
  306   1HB   ASP  45          2HB       ASP  45   3.568   4.743  -8.829
  307   2HB   ASP  45          1HB       ASP  45   4.623   6.136  -8.633
  308    H    ASP  46           H        ASP  46   2.807   4.114  -6.000
  309    HA   ASP  46           HA       ASP  46   2.434   6.827  -5.069
  310   1HB   ASP  46          2HB       ASP  46   0.716   4.385  -5.145
  311   2HB   ASP  46          1HB       ASP  46   0.303   5.686  -4.033
  312    H    VAL  47           H        VAL  47   3.619   3.861  -3.775
  313    HA   VAL  47           HA       VAL  47   3.217   4.693  -1.032
  314    HB   VAL  47           HB       VAL  47   3.211   2.285  -1.648
  315   1HG1  VAL  47          1HG1      VAL  47   6.152   2.713  -2.122
  316   2HG1  VAL  47          2HG1      VAL  47   4.944   2.252  -3.320
  317   3HG1  VAL  47          3HG1      VAL  47   5.359   1.140  -2.017
  318   1HG2  VAL  47          1HG2      VAL  47   5.328   3.114   0.323
  319   2HG2  VAL  47          2HG2      VAL  47   4.577   1.519   0.240
  320   3HG2  VAL  47          3HG2      VAL  47   3.605   2.934   0.645
  321    H    SER  48           H        SER  48   4.815   5.488   0.358
  322    HA   SER  48           HA       SER  48   7.263   6.389  -0.996
  323   1HB   SER  48          2HB       SER  48   5.579   8.198  -0.955
  324   2HB   SER  48          1HB       SER  48   5.513   8.087   0.801
  325    HG   SER  48           HG       SER  48   7.568   9.040  -0.869
  326    H    GLN  49           H        GLN  49   5.912   6.766   2.300
  327    HA   GLN  49           HA       GLN  49   8.525   5.841   3.285
  328   1HB   GLN  49          2HB       GLN  49   6.684   7.987   4.228
  329   2HB   GLN  49          1HB       GLN  49   7.682   7.154   5.412
  330   1HG   GLN  49          2HG       GLN  49   8.772   8.481   2.943
  331   2HG   GLN  49          1HG       GLN  49   8.654   9.266   4.517
  332   1HE2  GLN  49          1HE2      GLN  49  10.859   9.536   4.706
  333   2HE2  GLN  49          2HE2      GLN  49  11.940   8.221   5.001
  334    H    ILE  50           H        ILE  50   8.428   3.856   3.975
  335    HA   ILE  50           HA       ILE  50   6.227   3.097   5.781
  336    HB   ILE  50           HB       ILE  50   7.979   1.249   4.136
  337   1HG1  ILE  50          2HG1      ILE  50   5.063   1.978   3.788
  338   2HG1  ILE  50          1HG1      ILE  50   6.382   2.510   2.750
  339   1HG2  ILE  50          1HG2      ILE  50   6.410  -0.512   4.862
  340   2HG2  ILE  50          2HG2      ILE  50   5.616   0.659   5.916
  341   3HG2  ILE  50          3HG2      ILE  50   7.295   0.205   6.210
  342   1HD1  ILE  50          1HD1      ILE  50   6.793   0.224   2.064
  343   2HD1  ILE  50          2HD1      ILE  50   5.114   0.670   1.769
  344   3HD1  ILE  50          3HD1      ILE  50   5.524  -0.347   3.147
  345    H    ILE  51           H        ILE  51   9.610   3.525   5.339
  346    HA   ILE  51           HA       ILE  51  10.226   2.060   7.809
  347    HB   ILE  51           HB       ILE  51  12.103   2.874   5.583
  348   1HG1  ILE  51          2HG1      ILE  51  11.035   0.132   6.293
  349   2HG1  ILE  51          1HG1      ILE  51  10.476   1.106   4.938
  350   1HG2  ILE  51          1HG2      ILE  51  13.720   1.410   6.708
  351   2HG2  ILE  51          2HG2      ILE  51  12.565   1.154   8.017
  352   3HG2  ILE  51          3HG2      ILE  51  13.230   2.763   7.729
  353   1HD1  ILE  51          1HD1      ILE  51  12.019  -0.594   4.188
  354   2HD1  ILE  51          2HD1      ILE  51  13.250  -0.009   5.307
  355   3HD1  ILE  51          3HD1      ILE  51  12.726   1.005   3.962
  356    H    GLU  52           H        GLU  52  11.180   5.011   6.031
  357    HA   GLU  52           HA       GLU  52  12.238   6.904   6.658
  358   1HB   GLU  52          2HB       GLU  52  10.264   7.329   8.016
  359   2HB   GLU  52          1HB       GLU  52  10.902   6.331   9.313
  360   1HG   GLU  52          2HG       GLU  52  11.090   8.751   9.748
  361   2HG   GLU  52          1HG       GLU  52  12.642   7.917   9.765
  362    H    ARG  53           H        ARG  53  12.587   5.701   9.921
  363    HA   ARG  53           HA       ARG  53  14.883   4.187   9.810
  364   1HB   ARG  53          2HB       ARG  53  15.458   7.095   9.668
  365   2HB   ARG  53          1HB       ARG  53  16.371   6.200  10.876
  366   1HG   ARG  53          2HG       ARG  53  17.180   4.679   9.146
  367   2HG   ARG  53          1HG       ARG  53  16.255   5.561   7.933
  368   1HD   ARG  53          2HD       ARG  53  17.567   7.610   8.599
  369   2HD   ARG  53          1HD       ARG  53  18.604   6.535   9.539
  370    HE   ARG  53           HE       ARG  53  18.203   6.127   6.644
  371   1HH1  ARG  53          1HH1      ARG  53  20.327   6.630   9.383
  372   2HH1  ARG  53          2HH1      ARG  53  21.782   6.354   8.467
  373   1HH2  ARG  53          1HH2      ARG  53  20.096   5.771   5.441
  374   2HH2  ARG  53          2HH2      ARG  53  21.647   5.842   6.219
  Start of MODEL    9
    1    H    ASP   4           H        ASP   4  -0.290  -1.495  14.236
    2    HA   ASP   4           HA       ASP   4   0.229  -1.434  11.400
    3   1HB   ASP   4          2HB       ASP   4  -1.888  -0.614  11.907
    4   2HB   ASP   4          1HB       ASP   4  -1.322   0.260  13.326
    5    H    TYR   5           H        TYR   5   1.476   0.053  10.298
    6    HA   TYR   5           HA       TYR   5   3.457   1.484  11.952
    7   1HB   TYR   5          2HB       TYR   5   3.892   0.201   9.244
    8   2HB   TYR   5          1HB       TYR   5   5.105   1.051  10.190
    9    HD1  TYR   5           HD1      TYR   5   5.532   0.075  12.596
   10    HD2  TYR   5           HD2      TYR   5   3.758  -2.106   9.400
   11    HE1  TYR   5           HE1      TYR   5   6.158  -2.035  13.694
   12    HE2  TYR   5           HE2      TYR   5   4.376  -4.222  10.494
   13    HH   TYR   5           HH       TYR   5   5.409  -4.396  13.706
   14    H    VAL   6           H        VAL   6   0.845   2.257  10.544
   15    HA   VAL   6           HA       VAL   6  -0.019   3.719   9.035
   16    HB   VAL   6           HB       VAL   6   0.800   6.095   9.346
   17   1HG1  VAL   6          1HG1      VAL   6  -1.095   5.230  10.558
   18   2HG1  VAL   6          2HG1      VAL   6  -0.125   6.243  11.630
   19   3HG1  VAL   6          3HG1      VAL   6  -0.032   4.486  11.755
   20   1HG2  VAL   6          1HG2      VAL   6   2.239   6.537  11.280
   21   2HG2  VAL   6          2HG2      VAL   6   3.096   5.647  10.018
   22   3HG2  VAL   6          3HG2      VAL   6   2.526   4.804  11.457
   23    H    MET   7           H        MET   7   0.524   2.809   7.104
   24    HA   MET   7           HA       MET   7   3.063   3.199   5.890
   25   1HB   MET   7          2HB       MET   7   1.509   1.259   5.458
   26   2HB   MET   7          1HB       MET   7   0.492   2.359   4.540
   27   1HG   MET   7          2HG       MET   7   3.380   2.043   3.848
   28   2HG   MET   7          1HG       MET   7   2.200   0.850   3.314
   29   1HE   MET   7          1HE       MET   7  -0.205   3.015   1.122
   30   2HE   MET   7          2HE       MET   7  -0.362   2.543   2.814
   31   3HE   MET   7          3HE       MET   7   0.213   1.377   1.622
   32    H    ALA   8           H        ALA   8   3.718   5.112   5.295
   33    HA   ALA   8           HA       ALA   8   1.863   7.198   4.543
   34   1HB   ALA   8          1HB       ALA   8   4.871   7.212   4.761
   35   2HB   ALA   8          2HB       ALA   8   3.734   7.730   6.006
   36   3HB   ALA   8          3HB       ALA   8   3.854   8.628   4.493
   37    H    THR   9           H        THR   9   1.352   7.721   2.531
   38    HA   THR   9           HA       THR   9   2.759   6.383   0.353
   39    HB   THR   9           HB       THR   9   0.866   7.286  -1.033
   40    HG1  THR   9           HG1      THR   9  -0.367   7.813   1.477
   41   1HG2  THR   9          1HG2      THR   9   0.159   5.524   1.317
   42   2HG2  THR   9          2HG2      THR   9   0.831   4.991  -0.224
   43   3HG2  THR   9          3HG2      THR   9  -0.793   5.675  -0.161
   44    H    LYS  10           H        LYS  10   3.040   7.638  -1.665
   45    HA   LYS  10           HA       LYS  10   4.783   9.795  -1.346
   46   1HB   LYS  10          2HB       LYS  10   4.806   8.350  -3.292
   47   2HB   LYS  10          1HB       LYS  10   3.183   8.860  -3.731
   48   1HG   LYS  10          2HG       LYS  10   3.953  11.049  -4.302
   49   2HG   LYS  10          1HG       LYS  10   5.563  10.699  -3.664
   50   1HD   LYS  10          2HD       LYS  10   5.445  10.556  -6.137
   51   2HD   LYS  10          1HD       LYS  10   5.931   9.036  -5.377
   52   1HE   LYS  10          2HE       LYS  10   3.615   8.227  -5.561
   53   2HE   LYS  10          1HE       LYS  10   3.158   9.735  -6.345
   54   1HZ   LYS  10          1HZ       LYS  10   3.541   7.914  -7.913
   55   2HZ   LYS  10          2HZ       LYS  10   5.159   7.820  -7.419
   56   3HZ   LYS  10          3HZ       LYS  10   4.584   9.220  -8.181
   57    H    ASP  11           H        ASP  11   1.337   9.672  -1.797
   58    HA   ASP  11           HA       ASP  11   0.937  12.381  -2.534
   59   1HB   ASP  11          2HB       ASP  11  -0.714  10.619  -2.984
   60   2HB   ASP  11          1HB       ASP  11  -0.969  10.415  -1.255
   61    H    GLY  12           H        GLY  12   1.081  10.702   0.551
   62   1HA   GLY  12          2HA       GLY  12   1.848  12.086   2.452
   63   2HA   GLY  12          1HA       GLY  12   0.711  13.307   1.903
   64    H    ARG  13           H        ARG  13  -0.997  10.729   1.293
   65    HA   ARG  13           HA       ARG  13  -2.533  10.856   3.701
   66   1HB   ARG  13          2HB       ARG  13  -3.593   8.718   2.445
   67   2HB   ARG  13          1HB       ARG  13  -4.001  10.383   2.039
   68   1HG   ARG  13          2HG       ARG  13  -2.297  10.359   0.303
   69   2HG   ARG  13          1HG       ARG  13  -1.933   8.680   0.680
   70   1HD   ARG  13          2HD       ARG  13  -4.083   7.967  -0.055
   71   2HD   ARG  13          1HD       ARG  13  -4.654   9.632  -0.189
   72    HE   ARG  13           HE       ARG  13  -3.483   9.871  -2.175
   73   1HH1  ARG  13          1HH1      ARG  13  -2.955   6.689  -0.813
   74   2HH1  ARG  13          2HH1      ARG  13  -2.052   6.120  -2.186
   75   1HH2  ARG  13          1HH2      ARG  13  -2.334   9.098  -4.002
   76   2HH2  ARG  13          2HH2      ARG  13  -1.696   7.472  -3.980
   77    H    MET  14           H        MET  14  -2.312   9.766   5.443
   78    HA   MET  14           HA       MET  14  -0.381   7.589   5.629
   79   1HB   MET  14          2HB       MET  14  -2.017   8.942   7.789
   80   2HB   MET  14          1HB       MET  14  -0.725   7.784   8.059
   81   1HG   MET  14          2HG       MET  14  -0.389  10.471   6.758
   82   2HG   MET  14          1HG       MET  14  -0.043  10.112   8.449
   83   1HE   MET  14          1HE       MET  14   2.039  11.422   6.346
   84   2HE   MET  14          2HE       MET  14   3.509  10.576   6.828
   85   3HE   MET  14          3HE       MET  14   2.380  11.153   8.055
   86    H    ILE  15           H        ILE  15  -1.006   5.518   5.465
   87    HA   ILE  15           HA       ILE  15  -3.876   4.970   5.776
   88    HB   ILE  15           HB       ILE  15  -1.804   3.362   4.272
   89   1HG1  ILE  15          2HG1      ILE  15  -4.037   5.151   3.279
   90   2HG1  ILE  15          1HG1      ILE  15  -2.314   5.506   3.183
   91   1HG2  ILE  15          1HG2      ILE  15  -3.716   2.092   3.417
   92   2HG2  ILE  15          2HG2      ILE  15  -4.795   3.019   4.456
   93   3HG2  ILE  15          3HG2      ILE  15  -3.581   1.959   5.170
   94   1HD1  ILE  15          1HD1      ILE  15  -3.710   3.221   1.800
   95   2HD1  ILE  15          2HD1      ILE  15  -2.000   3.636   1.669
   96   3HD1  ILE  15          3HD1      ILE  15  -3.225   4.744   1.050
   97    H    LEU  16           H        LEU  16  -4.535   3.872   7.457
   98    HA   LEU  16           HA       LEU  16  -2.804   2.588   9.313
   99   1HB   LEU  16          2HB       LEU  16  -5.800   2.495   8.942
  100   2HB   LEU  16          1HB       LEU  16  -4.969   1.670  10.244
  101    HG   LEU  16           HG       LEU  16  -5.900   3.704  11.102
  102   1HD1  LEU  16          1HD1      LEU  16  -2.932   4.013  10.726
  103   2HD1  LEU  16          2HD1      LEU  16  -3.731   3.062  11.979
  104   3HD1  LEU  16          3HD1      LEU  16  -3.908   4.817  11.955
  105   1HD2  LEU  16          1HD2      LEU  16  -4.360   5.175   8.970
  106   2HD2  LEU  16          2HD2      LEU  16  -5.326   5.905  10.252
  107   3HD2  LEU  16          3HD2      LEU  16  -6.107   4.940   8.999
  108    H    THR  17           H        THR  17  -1.892   0.655   9.082
  109    HA   THR  17           HA       THR  17  -3.097  -1.203   7.131
  110    HB   THR  17           HB       THR  17  -0.680  -1.708   6.439
  111    HG1  THR  17           HG1      THR  17  -0.321   0.359   8.196
  112   1HG2  THR  17          1HG2      THR  17  -2.268  -0.570   4.973
  113   2HG2  THR  17          2HG2      THR  17  -0.655   0.125   4.806
  114   3HG2  THR  17          3HG2      THR  17  -1.888   0.969   5.743
  115    H    ASP  18           H        ASP  18  -2.787  -3.359   7.456
  116    HA   ASP  18           HA       ASP  18  -1.966  -4.432   9.928
  117   1HB   ASP  18          2HB       ASP  18  -3.406  -5.682   8.451
  118   2HB   ASP  18          1HB       ASP  18  -2.218  -5.625   7.157
  119    H    GLY  19           H        GLY  19   0.032  -5.825  10.257
  120   1HA   GLY  19          2HA       GLY  19   2.246  -4.088   9.574
  121   2HA   GLY  19          1HA       GLY  19   2.308  -5.467  10.659
  122    H    LYS  20           H        LYS  20   2.328  -4.516   7.234
  123    HA   LYS  20           HA       LYS  20   3.808  -6.452   6.099
  124   1HB   LYS  20          2HB       LYS  20   2.582  -8.190   7.279
  125   2HB   LYS  20          1HB       LYS  20   1.065  -7.611   6.601
  126   1HG   LYS  20          2HG       LYS  20   1.380  -8.696   4.674
  127   2HG   LYS  20          1HG       LYS  20   3.069  -8.206   4.572
  128   1HD   LYS  20          2HD       LYS  20   3.676  -9.978   6.150
  129   2HD   LYS  20          1HD       LYS  20   1.982 -10.469   6.248
  130   1HE   LYS  20          2HE       LYS  20   1.967 -11.073   3.922
  131   2HE   LYS  20          1HE       LYS  20   3.581 -10.407   3.694
  132   1HZ   LYS  20          1HZ       LYS  20   3.038 -12.660   5.547
  133   2HZ   LYS  20          2HZ       LYS  20   4.536 -12.136   4.940
  134   3HZ   LYS  20          3HZ       LYS  20   3.423 -12.891   3.909
  135    HA   PRO  21           HA       PRO  21   1.630  -4.371   2.733
  136   1HB   PRO  21          2HB       PRO  21   3.672  -2.864   1.840
  137   2HB   PRO  21          1HB       PRO  21   2.632  -2.327   3.162
  138   1HG   PRO  21          2HG       PRO  21   5.418  -3.299   3.237
  139   2HG   PRO  21          1HG       PRO  21   4.566  -2.237   4.370
  140   1HD   PRO  21          2HD       PRO  21   5.068  -5.046   4.629
  141   2HD   PRO  21          1HD       PRO  21   4.168  -3.995   5.738
  142    H    GLU  22           H        GLU  22   1.542  -6.271   1.543
  143    HA   GLU  22           HA       GLU  22   3.969  -7.644   0.810
  144   1HB   GLU  22          2HB       GLU  22   1.717  -8.713   1.460
  145   2HB   GLU  22          1HB       GLU  22   1.198  -8.308  -0.168
  146   1HG   GLU  22          2HG       GLU  22   2.911  -9.689  -1.116
  147   2HG   GLU  22          1HG       GLU  22   3.598 -10.001   0.478
  148    H    ILE  23           H        ILE  23   5.099  -6.461  -0.600
  149    HA   ILE  23           HA       ILE  23   3.835  -5.050  -2.759
  150    HB   ILE  23           HB       ILE  23   6.785  -5.467  -2.270
  151   1HG1  ILE  23          2HG1      ILE  23   4.961  -3.227  -1.367
  152   2HG1  ILE  23          1HG1      ILE  23   5.718  -4.424  -0.323
  153   1HG2  ILE  23          1HG2      ILE  23   7.037  -3.447  -3.639
  154   2HG2  ILE  23          2HG2      ILE  23   5.294  -3.412  -3.900
  155   3HG2  ILE  23          3HG2      ILE  23   6.253  -4.749  -4.534
  156   1HD1  ILE  23          1HD1      ILE  23   7.152  -2.342  -1.959
  157   2HD1  ILE  23          2HD1      ILE  23   7.919  -3.548  -0.926
  158   3HD1  ILE  23          3HD1      ILE  23   6.889  -2.307  -0.215
  159    H    ASP  24           H        ASP  24   3.294  -5.944  -4.598
  160    HA   ASP  24           HA       ASP  24   4.834  -8.239  -5.594
  161   1HB   ASP  24          2HB       ASP  24   2.097  -7.227  -6.409
  162   2HB   ASP  24          1HB       ASP  24   2.924  -8.592  -7.152
  163    H    ASP  25           H        ASP  25   6.561  -7.287  -6.553
  164    HA   ASP  25           HA       ASP  25   6.311  -4.762  -7.901
  165   1HB   ASP  25          2HB       ASP  25   8.336  -5.481  -6.596
  166   2HB   ASP  25          1HB       ASP  25   8.697  -6.619  -7.891
  167    H    ASP  26           H        ASP  26   6.042  -8.033  -8.805
  168    HA   ASP  26           HA       ASP  26   6.768  -8.045 -11.483
  169   1HB   ASP  26          2HB       ASP  26   4.421  -9.448 -10.177
  170   2HB   ASP  26          1HB       ASP  26   5.078  -9.842 -11.762
  171    H    THR  27           H        THR  27   3.663  -7.148 -10.028
  172    HA   THR  27           HA       THR  27   2.804  -5.952 -12.547
  173    HB   THR  27           HB       THR  27   1.070  -7.189 -11.475
  174    HG1  THR  27           HG1      THR  27  -0.109  -5.566 -12.129
  175   1HG2  THR  27          1HG2      THR  27   1.968  -7.271  -9.212
  176   2HG2  THR  27          2HG2      THR  27   0.290  -6.725  -9.193
  177   3HG2  THR  27          3HG2      THR  27   1.600  -5.560  -8.991
  178    H    GLY  28           H        GLY  28   3.998  -5.096  -9.394
  179   1HA   GLY  28          2HA       GLY  28   5.033  -3.025  -8.913
  180   2HA   GLY  28          1HA       GLY  28   4.127  -2.298 -10.233
  181    H    LEU  29           H        LEU  29   2.728  -4.352  -7.764
  182    HA   LEU  29           HA       LEU  29   1.251  -2.010  -6.752
  183   1HB   LEU  29          2HB       LEU  29   0.237  -4.850  -6.858
  184   2HB   LEU  29          1HB       LEU  29  -0.663  -3.425  -6.384
  185    HG   LEU  29           HG       LEU  29   0.308  -4.087  -9.163
  186   1HD1  LEU  29          1HD1      LEU  29  -2.469  -3.907  -8.006
  187   2HD1  LEU  29          2HD1      LEU  29  -1.618  -5.393  -8.425
  188   3HD1  LEU  29          3HD1      LEU  29  -2.065  -4.249  -9.689
  189   1HD2  LEU  29          1HD2      LEU  29   0.418  -1.675  -8.730
  190   2HD2  LEU  29          2HD2      LEU  29  -1.271  -1.696  -8.222
  191   3HD2  LEU  29          3HD2      LEU  29  -0.844  -2.085  -9.890
  192    H    VAL  30           H        VAL  30   0.591  -2.119  -4.531
  193    HA   VAL  30           HA       VAL  30   2.195  -3.981  -2.894
  194    HB   VAL  30           HB       VAL  30   1.339  -1.164  -2.182
  195   1HG1  VAL  30          1HG1      VAL  30   1.283  -2.566  -0.214
  196   2HG1  VAL  30          2HG1      VAL  30   2.696  -1.514  -0.139
  197   3HG1  VAL  30          3HG1      VAL  30   2.881  -3.209  -0.585
  198   1HG2  VAL  30          1HG2      VAL  30   3.757  -0.694  -2.155
  199   2HG2  VAL  30          2HG2      VAL  30   3.186  -1.171  -3.753
  200   3HG2  VAL  30          3HG2      VAL  30   4.066  -2.324  -2.750
  201    H    SER  31           H        SER  31   0.899  -5.495  -2.150
  202    HA   SER  31           HA       SER  31  -1.928  -4.980  -1.724
  203   1HB   SER  31          2HB       SER  31  -0.360  -7.535  -1.330
  204   2HB   SER  31          1HB       SER  31  -2.108  -7.381  -1.467
  205    HG   SER  31           HG       SER  31  -0.206  -7.528  -3.428
  206    H    TYR  32           H        TYR  32  -2.363  -3.966   0.172
  207    HA   TYR  32           HA       TYR  32  -0.979  -4.967   2.578
  208   1HB   TYR  32          2HB       TYR  32  -1.269  -2.816   3.608
  209   2HB   TYR  32          1HB       TYR  32  -0.567  -2.553   2.018
  210    HD1  TYR  32           HD2      TYR  32  -1.915  -1.533   0.221
  211    HD2  TYR  32           HD1      TYR  32  -3.480  -2.022   4.145
  212    HE1  TYR  32           HE2      TYR  32  -3.718   0.057  -0.293
  213    HE2  TYR  32           HE1      TYR  32  -5.279  -0.432   3.634
  214    HH   TYR  32           HH       TYR  32  -5.856   1.286   2.145
  215    H    HIS  33           H        HIS  33  -2.401  -4.516   4.612
  216    HA   HIS  33           HA       HIS  33  -5.183  -5.256   3.986
  217   1HB   HIS  33          2HB       HIS  33  -3.652  -5.919   6.514
  218   2HB   HIS  33          1HB       HIS  33  -5.291  -6.421   6.122
  219    HD1  HIS  33           HD1      HIS  33  -2.147  -7.861   6.388
  220    HD2  HIS  33           HD2      HIS  33  -5.044  -7.941   3.394
  221    HE1  HIS  33           HE1      HIS  33  -1.660  -9.917   5.025
  222    HE2  HIS  33           HE2      HIS  33  -3.331  -9.863   3.130
  223    H    ASP  34           H        ASP  34  -6.675  -3.828   4.606
  224    HA   ASP  34           HA       ASP  34  -6.064  -1.377   5.870
  225   1HB   ASP  34          2HB       ASP  34  -8.401  -2.662   4.772
  226   2HB   ASP  34          1HB       ASP  34  -8.800  -1.889   6.301
  227    H    GLN  35           H        GLN  35  -7.052  -0.589   7.903
  228    HA   GLN  35           HA       GLN  35  -6.590  -2.218  10.146
  229   1HB   GLN  35          2HB       GLN  35  -7.804  -0.490  11.425
  230   2HB   GLN  35          1HB       GLN  35  -6.629   0.218  10.325
  231   1HG   GLN  35          2HG       GLN  35  -8.377   0.788   8.764
  232   2HG   GLN  35          1HG       GLN  35  -9.579  -0.005   9.782
  233   1HE2  GLN  35          1HE2      GLN  35  -7.558   2.762   9.356
  234   2HE2  GLN  35          2HE2      GLN  35  -8.281   3.748  10.585
  235    H    GLN  36           H        GLN  36  -9.267  -1.882   8.019
  236    HA   GLN  36           HA       GLN  36 -11.256  -3.111   9.660
  237   1HB   GLN  36          2HB       GLN  36 -11.147  -2.969   6.641
  238   2HB   GLN  36          1HB       GLN  36 -12.572  -3.241   7.631
  239   1HG   GLN  36          2HG       GLN  36 -12.449  -0.986   8.491
  240   2HG   GLN  36          1HG       GLN  36 -10.947  -0.709   7.609
  241   1HE2  GLN  36          1HE2      GLN  36 -11.769   0.982   6.400
  242   2HE2  GLN  36          2HE2      GLN  36 -12.940   0.745   5.143
  243    H    GLY  37           H        GLY  37  -8.704  -4.207   7.582
  244   1HA   GLY  37          2HA       GLY  37  -7.855  -6.444   7.843
  245   2HA   GLY  37          1HA       GLY  37  -9.502  -6.989   8.110
  246    H    ASN  38           H        ASN  38  -9.426  -4.755   5.595
  247    HA   ASN  38           HA       ASN  38 -10.030  -6.808   3.680
  248   1HB   ASN  38          2HB       ASN  38  -9.624  -3.859   3.141
  249   2HB   ASN  38          1HB       ASN  38 -10.420  -5.023   2.091
  250   1HD2  ASN  38          1HD2      ASN  38 -10.822  -2.709   4.454
  251   2HD2  ASN  38          2HD2      ASN  38 -12.478  -3.027   4.853
  252    H    ALA  39           H        ALA  39  -8.889  -7.324   1.815
  253    HA   ALA  39           HA       ALA  39  -6.031  -6.638   1.857
  254   1HB   ALA  39          1HB       ALA  39  -6.584  -9.035   1.818
  255   2HB   ALA  39          2HB       ALA  39  -5.722  -8.542   0.361
  256   3HB   ALA  39          3HB       ALA  39  -7.467  -8.800   0.309
  257    H    MET  40           H        MET  40  -5.410  -5.038   0.552
  258    HA   MET  40           HA       MET  40  -6.761  -4.631  -1.995
  259   1HB   MET  40          2HB       MET  40  -7.041  -2.162  -1.372
  260   2HB   MET  40          1HB       MET  40  -8.175  -3.309  -0.667
  261   1HG   MET  40          2HG       MET  40  -6.264  -3.303   1.226
  262   2HG   MET  40          1HG       MET  40  -6.111  -1.657   0.613
  263   1HE   MET  40          1HE       MET  40  -9.008  -0.855  -0.239
  264   2HE   MET  40          2HE       MET  40  -7.981   0.170   0.762
  265   3HE   MET  40          3HE       MET  40  -9.644  -0.165   1.252
  266    H    GLN  41           H        GLN  41  -5.605  -3.404  -3.477
  267    HA   GLN  41           HA       GLN  41  -2.730  -3.311  -2.852
  268   1HB   GLN  41          2HB       GLN  41  -4.226  -3.656  -5.453
  269   2HB   GLN  41          1HB       GLN  41  -2.501  -3.344  -5.386
  270   1HG   GLN  41          2HG       GLN  41  -2.795  -5.666  -5.690
  271   2HG   GLN  41          1HG       GLN  41  -2.256  -5.423  -4.033
  272   1HE2  GLN  41          1HE2      GLN  41  -4.946  -6.290  -6.076
  273   2HE2  GLN  41          2HE2      GLN  41  -5.900  -7.021  -4.831
  274    H    ILE  42           H        ILE  42  -1.523  -1.499  -3.244
  275    HA   ILE  42           HA       ILE  42  -2.776   0.695  -4.772
  276    HB   ILE  42           HB       ILE  42  -1.418   2.325  -3.622
  277   1HG1  ILE  42          2HG1      ILE  42  -0.443   0.282  -1.652
  278   2HG1  ILE  42          1HG1      ILE  42   0.441   0.548  -3.152
  279   1HG2  ILE  42          1HG2      ILE  42  -2.894   0.523  -1.731
  280   2HG2  ILE  42          2HG2      ILE  42  -3.548   1.889  -2.629
  281   3HG2  ILE  42          3HG2      ILE  42  -2.373   2.160  -1.341
  282   1HD1  ILE  42          1HD1      ILE  42   0.751   2.868  -2.602
  283   2HD1  ILE  42          2HD1      ILE  42   1.326   1.851  -1.276
  284   3HD1  ILE  42          3HD1      ILE  42  -0.221   2.682  -1.143
  285    H    ASN  43           H        ASN  43  -0.730   2.167  -5.571
  286    HA   ASN  43           HA       ASN  43   0.783   0.323  -7.219
  287   1HB   ASN  43          2HB       ASN  43  -0.224   2.558  -7.986
  288   2HB   ASN  43          1HB       ASN  43   1.135   3.310  -7.160
  289   1HD2  ASN  43          1HD2      ASN  43   0.160   1.329  -9.848
  290   2HD2  ASN  43          2HD2      ASN  43   1.656   1.409 -10.709
  291    H    ARG  44           H        ARG  44   2.992   0.006  -7.176
  292    HA   ARG  44           HA       ARG  44   4.237   0.173  -4.642
  293   1HB   ARG  44          2HB       ARG  44   4.769  -1.605  -6.213
  294   2HB   ARG  44          1HB       ARG  44   5.408  -0.441  -7.363
  295   1HG   ARG  44          2HG       ARG  44   6.685  -0.341  -4.733
  296   2HG   ARG  44          1HG       ARG  44   6.887  -1.875  -5.582
  297   1HD   ARG  44          2HD       ARG  44   7.492   0.841  -6.753
  298   2HD   ARG  44          1HD       ARG  44   8.694  -0.245  -6.053
  299    HE   ARG  44           HE       ARG  44   8.167  -1.831  -7.843
  300   1HH1  ARG  44          1HH1      ARG  44   7.238   1.526  -8.275
  301   2HH1  ARG  44          2HH1      ARG  44   7.068   1.390 -10.001
  302   1HH2  ARG  44          1HH2      ARG  44   7.986  -1.995 -10.114
  303   2HH2  ARG  44          2HH2      ARG  44   7.521  -0.604 -11.046
  304    H    ASP  45           H        ASP  45   4.241   2.311  -7.396
  305    HA   ASP  45           HA       ASP  45   6.521   3.806  -6.393
  306   1HB   ASP  45          2HB       ASP  45   6.099   3.477  -8.849
  307   2HB   ASP  45          1HB       ASP  45   4.694   4.527  -8.692
  308    H    ASP  46           H        ASP  46   3.351   3.609  -5.584
  309    HA   ASP  46           HA       ASP  46   2.941   6.466  -5.145
  310   1HB   ASP  46          2HB       ASP  46   1.140   4.895  -6.049
  311   2HB   ASP  46          1HB       ASP  46   1.047   4.225  -4.425
  312    H    VAL  47           H        VAL  47   4.421   3.979  -3.608
  313    HA   VAL  47           HA       VAL  47   3.590   4.581  -0.891
  314    HB   VAL  47           HB       VAL  47   5.969   2.888  -1.607
  315   1HG1  VAL  47          1HG1      VAL  47   5.522   3.391   0.751
  316   2HG1  VAL  47          2HG1      VAL  47   5.372   1.671   0.395
  317   3HG1  VAL  47          3HG1      VAL  47   3.925   2.658   0.592
  318   1HG2  VAL  47          1HG2      VAL  47   4.181   2.134  -3.079
  319   2HG2  VAL  47          2HG2      VAL  47   3.100   1.975  -1.696
  320   3HG2  VAL  47          3HG2      VAL  47   4.520   0.941  -1.828
  321    H    SER  48           H        SER  48   4.988   5.473   0.709
  322    HA   SER  48           HA       SER  48   7.349   6.861  -0.363
  323   1HB   SER  48          2HB       SER  48   5.638   8.527  -0.137
  324   2HB   SER  48          1HB       SER  48   5.225   7.973   1.482
  325    HG   SER  48           HG       SER  48   7.837   8.878   0.891
  326    H    GLN  49           H        GLN  49   5.780   6.112   2.781
  327    HA   GLN  49           HA       GLN  49   8.404   5.212   3.746
  328   1HB   GLN  49          2HB       GLN  49   7.232   7.647   4.472
  329   2HB   GLN  49          1HB       GLN  49   6.909   6.573   5.826
  330   1HG   GLN  49          2HG       GLN  49   9.617   7.131   4.636
  331   2HG   GLN  49          1HG       GLN  49   8.979   7.829   6.124
  332   1HE2  GLN  49          1HE2      GLN  49   8.885   6.589   7.971
  333   2HE2  GLN  49          2HE2      GLN  49   9.664   5.051   8.093
  334    H    ILE  50           H        ILE  50   8.359   3.636   5.330
  335    HA   ILE  50           HA       ILE  50   5.723   2.602   6.131
  336    HB   ILE  50           HB       ILE  50   7.995   0.869   5.120
  337   1HG1  ILE  50          2HG1      ILE  50   5.269   1.389   3.904
  338   2HG1  ILE  50          1HG1      ILE  50   6.784   2.065   3.313
  339   1HG2  ILE  50          1HG2      ILE  50   6.395  -0.983   5.382
  340   2HG2  ILE  50          2HG2      ILE  50   5.239   0.137   6.104
  341   3HG2  ILE  50          3HG2      ILE  50   6.767  -0.200   6.918
  342   1HD1  ILE  50          1HD1      ILE  50   7.585  -0.189   2.807
  343   2HD1  ILE  50          2HD1      ILE  50   6.079   0.178   1.964
  344   3HD1  ILE  50          3HD1      ILE  50   6.060  -0.858   3.393
  345    H    ILE  51           H        ILE  51   9.228   2.051   6.581
  346    HA   ILE  51           HA       ILE  51   8.700   1.813   9.462
  347    HB   ILE  51           HB       ILE  51  10.886   0.577   9.577
  348   1HG1  ILE  51          2HG1      ILE  51  10.537   0.419   6.574
  349   2HG1  ILE  51          1HG1      ILE  51  11.798   1.325   7.402
  350   1HG2  ILE  51          1HG2      ILE  51   9.914  -1.541   8.850
  351   2HG2  ILE  51          2HG2      ILE  51   8.695  -0.667   7.924
  352   3HG2  ILE  51          3HG2      ILE  51   8.720  -0.542   9.682
  353   1HD1  ILE  51          1HD1      ILE  51  12.603  -0.810   6.521
  354   2HD1  ILE  51          2HD1      ILE  51  11.430  -1.658   7.529
  355   3HD1  ILE  51          3HD1      ILE  51  12.728  -0.732   8.279
  356    H    GLU  52           H        GLU  52   9.416   3.389  10.689
  357    HA   GLU  52           HA       GLU  52  10.743   5.648   9.759
  358   1HB   GLU  52          2HB       GLU  52  10.419   4.556  12.550
  359   2HB   GLU  52          1HB       GLU  52  11.144   6.123  12.216
  360   1HG   GLU  52          2HG       GLU  52   8.375   5.333  11.352
  361   2HG   GLU  52          1HG       GLU  52   8.739   6.202  12.842
  362    H    ARG  53           H        ARG  53  12.164   3.422  12.161
  363    HA   ARG  53           HA       ARG  53  14.730   3.708  10.758
  364   1HB   ARG  53          2HB       ARG  53  14.333   3.790  13.758
  365   2HB   ARG  53          1HB       ARG  53  15.888   3.786  12.937
  366   1HG   ARG  53          2HG       ARG  53  13.785   5.934  12.744
  367   2HG   ARG  53          1HG       ARG  53  15.291   6.020  13.658
  368   1HD   ARG  53          2HD       ARG  53  16.590   5.925  11.639
  369   2HD   ARG  53          1HD       ARG  53  15.148   5.620  10.672
  370    HE   ARG  53           HE       ARG  53  15.378   8.133  12.177
  371   1HH1  ARG  53          1HH1      ARG  53  15.241   6.457   9.095
  372   2HH1  ARG  53          2HH1      ARG  53  14.962   7.909   8.180
  373   1HH2  ARG  53          1HH2      ARG  53  14.980  10.028  10.966
  374   2HH2  ARG  53          2HH2      ARG  53  14.803   9.920   9.240
  Start of MODEL   10
    1    H    ASP   4           H        ASP   4   5.036  -3.713  11.166
    2    HA   ASP   4           HA       ASP   4   5.120  -1.039  10.051
    3   1HB   ASP   4          2HB       ASP   4   5.454  -2.278   8.022
    4   2HB   ASP   4          1HB       ASP   4   4.187  -3.424   8.445
    5    H    TYR   5           H        TYR   5   3.131  -0.003  10.078
    6    HA   TYR   5           HA       TYR   5   0.692  -1.258  10.703
    7   1HB   TYR   5          2HB       TYR   5   0.335  -0.399  12.981
    8   2HB   TYR   5          1HB       TYR   5   1.661  -1.552  12.920
    9    HD1  TYR   5           HD1      TYR   5   4.031  -0.685  13.036
   10    HD2  TYR   5           HD2      TYR   5   0.657   1.806  13.769
   11    HE1  TYR   5           HE1      TYR   5   5.480   0.935  14.187
   12    HE2  TYR   5           HE2      TYR   5   2.098   3.431  14.915
   13    HH   TYR   5           HH       TYR   5   5.496   3.306  14.769
   14    H    VAL   6           H        VAL   6   2.581   1.318   9.811
   15    HA   VAL   6           HA       VAL   6   0.229   2.903   9.186
   16    HB   VAL   6           HB       VAL   6   2.610   4.060  10.663
   17   1HG1  VAL   6          1HG1      VAL   6   1.524   6.243  10.373
   18   2HG1  VAL   6          2HG1      VAL   6   0.308   5.494   9.340
   19   3HG1  VAL   6          3HG1      VAL   6   1.996   5.533   8.831
   20   1HG2  VAL   6          1HG2      VAL   6   0.940   3.098  12.146
   21   2HG2  VAL   6          2HG2      VAL   6  -0.331   4.014  11.341
   22   3HG2  VAL   6          3HG2      VAL   6   0.914   4.858  12.259
   23    H    MET   7           H        MET   7   0.340   3.027   7.059
   24    HA   MET   7           HA       MET   7   2.959   3.205   5.757
   25   1HB   MET   7          2HB       MET   7   1.502   1.469   4.893
   26   2HB   MET   7          1HB       MET   7   0.208   2.630   4.639
   27   1HG   MET   7          2HG       MET   7   1.636   3.790   2.983
   28   2HG   MET   7          1HG       MET   7   2.839   2.519   3.185
   29   1HE   MET   7          1HE       MET   7   2.378  -0.039   2.564
   30   2HE   MET   7          2HE       MET   7   0.859  -0.621   1.887
   31   3HE   MET   7          3HE       MET   7   0.917  -0.031   3.549
   32    H    ALA   8           H        ALA   8   3.693   5.179   5.363
   33    HA   ALA   8           HA       ALA   8   1.795   7.341   4.800
   34   1HB   ALA   8          1HB       ALA   8   3.712   8.842   5.106
   35   2HB   ALA   8          2HB       ALA   8   4.764   7.448   5.347
   36   3HB   ALA   8          3HB       ALA   8   3.484   7.795   6.507
   37    H    THR   9           H        THR   9   1.272   7.528   2.714
   38    HA   THR   9           HA       THR   9   3.056   6.419   0.697
   39    HB   THR   9           HB       THR   9   1.163   7.011  -0.863
   40    HG1  THR   9           HG1      THR   9  -0.359   7.416   1.488
   41   1HG2  THR   9          1HG2      THR   9   0.505   5.280   1.529
   42   2HG2  THR   9          2HG2      THR   9   1.379   4.767   0.087
   43   3HG2  THR   9          3HG2      THR   9  -0.318   5.231  -0.030
   44    H    LYS  10           H        LYS  10   2.895   7.722  -1.480
   45    HA   LYS  10           HA       LYS  10   4.466  10.048  -1.278
   46   1HB   LYS  10          2HB       LYS  10   4.438   8.547  -3.217
   47   2HB   LYS  10          1HB       LYS  10   2.768   8.975  -3.540
   48   1HG   LYS  10          2HG       LYS  10   3.390  11.202  -4.144
   49   2HG   LYS  10          1HG       LYS  10   5.059  10.922  -3.633
   50   1HD   LYS  10          2HD       LYS  10   4.788  10.761  -6.084
   51   2HD   LYS  10          1HD       LYS  10   5.342   9.246  -5.365
   52   1HE   LYS  10          2HE       LYS  10   2.987   8.453  -5.362
   53   2HE   LYS  10          1HE       LYS  10   2.528   9.924  -6.215
   54   1HZ   LYS  10          1HZ       LYS  10   4.405   7.850  -7.211
   55   2HZ   LYS  10          2HZ       LYS  10   3.991   9.272  -8.031
   56   3HZ   LYS  10          3HZ       LYS  10   2.812   8.091  -7.736
   57    H    ASP  11           H        ASP  11   1.024   9.521  -1.808
   58    HA   ASP  11           HA       ASP  11   0.189  12.139  -2.289
   59   1HB   ASP  11          2HB       ASP  11  -1.354  10.380  -2.696
   60   2HB   ASP  11          1HB       ASP  11  -1.204   9.763  -1.057
   61    H    GLY  12           H        GLY  12   0.767  10.441   0.727
   62   1HA   GLY  12          2HA       GLY  12   1.509  11.729   2.648
   63   2HA   GLY  12          1HA       GLY  12   0.390  12.995   2.153
   64    H    ARG  13           H        ARG  13  -1.288  10.334   1.530
   65    HA   ARG  13           HA       ARG  13  -2.905  10.496   3.849
   66   1HB   ARG  13          2HB       ARG  13  -4.028   8.443   2.893
   67   2HB   ARG  13          1HB       ARG  13  -3.990   9.845   1.836
   68   1HG   ARG  13          2HG       ARG  13  -1.988   8.843   0.733
   69   2HG   ARG  13          1HG       ARG  13  -2.272   7.389   1.682
   70   1HD   ARG  13          2HD       ARG  13  -4.342   6.984   0.620
   71   2HD   ARG  13          1HD       ARG  13  -4.378   8.598  -0.087
   72    HE   ARG  13           HE       ARG  13  -2.311   6.652  -0.882
   73   1HH1  ARG  13          1HH1      ARG  13  -4.947   8.810  -1.671
   74   2HH1  ARG  13          2HH1      ARG  13  -4.722   8.670  -3.382
   75   1HH2  ARG  13          1HH2      ARG  13  -1.956   6.490  -3.134
   76   2HH2  ARG  13          2HH2      ARG  13  -3.007   7.360  -4.215
   77    H    MET  14           H        MET  14  -2.961   9.356   5.635
   78    HA   MET  14           HA       MET  14  -0.719   7.575   6.200
   79   1HB   MET  14          2HB       MET  14  -1.932   9.591   7.642
   80   2HB   MET  14          1HB       MET  14  -2.631   8.146   8.355
   81   1HG   MET  14          2HG       MET  14  -0.712   8.770   9.614
   82   2HG   MET  14          1HG       MET  14  -0.345   7.287   8.738
   83   1HE   MET  14          1HE       MET  14   3.058   9.347   8.924
   84   2HE   MET  14          2HE       MET  14   2.264   7.837   9.376
   85   3HE   MET  14          3HE       MET  14   1.761   9.355  10.123
   86    H    ILE  15           H        ILE  15  -1.199   5.568   5.448
   87    HA   ILE  15           HA       ILE  15  -3.896   4.532   5.749
   88    HB   ILE  15           HB       ILE  15  -1.455   3.214   4.557
   89   1HG1  ILE  15          2HG1      ILE  15  -3.801   4.590   3.226
   90   2HG1  ILE  15          1HG1      ILE  15  -2.161   5.223   3.314
   91   1HG2  ILE  15          1HG2      ILE  15  -3.095   1.600   5.352
   92   2HG2  ILE  15          2HG2      ILE  15  -3.054   1.628   3.588
   93   3HG2  ILE  15          3HG2      ILE  15  -4.362   2.436   4.454
   94   1HD1  ILE  15          1HD1      ILE  15  -2.610   4.271   1.137
   95   2HD1  ILE  15          2HD1      ILE  15  -3.024   2.727   1.877
   96   3HD1  ILE  15          3HD1      ILE  15  -1.374   3.337   1.974
   97    H    LEU  16           H        LEU  16  -4.506   3.539   7.533
   98    HA   LEU  16           HA       LEU  16  -2.614   2.564   9.459
   99   1HB   LEU  16          2HB       LEU  16  -5.630   2.430   9.340
  100   2HB   LEU  16          1HB       LEU  16  -4.692   1.749  10.652
  101    HG   LEU  16           HG       LEU  16  -5.513   3.831  11.411
  102   1HD1  LEU  16          1HD1      LEU  16  -2.644   4.195  10.577
  103   2HD1  LEU  16          2HD1      LEU  16  -3.220   3.393  12.039
  104   3HD1  LEU  16          3HD1      LEU  16  -3.480   5.124  11.822
  105   1HD2  LEU  16          1HD2      LEU  16  -6.102   4.797   9.244
  106   2HD2  LEU  16          2HD2      LEU  16  -4.397   5.107   8.918
  107   3HD2  LEU  16          3HD2      LEU  16  -5.206   5.940  10.245
  108    H    THR  17           H        THR  17  -1.479   0.921   8.484
  109    HA   THR  17           HA       THR  17  -2.932  -1.258   7.262
  110    HB   THR  17           HB       THR  17  -0.528  -2.180   6.998
  111    HG1  THR  17           HG1      THR  17   1.108  -0.836   7.461
  112   1HG2  THR  17          1HG2      THR  17  -1.335   0.389   5.615
  113   2HG2  THR  17          2HG2      THR  17  -1.837  -1.234   5.149
  114   3HG2  THR  17          3HG2      THR  17  -0.142  -0.768   5.024
  115    H    ASP  18           H        ASP  18  -3.352  -3.171   8.177
  116    HA   ASP  18           HA       ASP  18  -3.075  -3.720  10.898
  117   1HB   ASP  18          2HB       ASP  18  -4.597  -4.906   9.287
  118   2HB   ASP  18          1HB       ASP  18  -3.191  -5.760   8.663
  119    H    GLY  19           H        GLY  19  -1.078  -4.709   8.153
  120   1HA   GLY  19          2HA       GLY  19   1.221  -3.658   9.017
  121   2HA   GLY  19          1HA       GLY  19   1.213  -5.206   9.853
  122    H    LYS  20           H        LYS  20   2.806  -3.938   7.384
  123    HA   LYS  20           HA       LYS  20   4.157  -5.190   6.049
  124   1HB   LYS  20          2HB       LYS  20   3.754  -7.105   7.648
  125   2HB   LYS  20          1HB       LYS  20   2.510  -7.656   6.530
  126   1HG   LYS  20          2HG       LYS  20   4.063  -8.049   4.818
  127   2HG   LYS  20          1HG       LYS  20   5.321  -7.121   5.636
  128   1HD   LYS  20          2HD       LYS  20   5.300  -8.847   7.449
  129   2HD   LYS  20          1HD       LYS  20   4.201  -9.802   6.449
  130   1HE   LYS  20          2HE       LYS  20   5.846  -9.998   4.720
  131   2HE   LYS  20          1HE       LYS  20   6.912  -8.856   5.540
  132   1HZ   LYS  20          1HZ       LYS  20   6.150 -11.554   6.537
  133   2HZ   LYS  20          2HZ       LYS  20   7.123 -10.445   7.366
  134   3HZ   LYS  20          3HZ       LYS  20   7.657 -11.109   5.902
  135    HA   PRO  21           HA       PRO  21   1.424  -4.619   2.512
  136   1HB   PRO  21          2HB       PRO  21   3.793  -3.463   1.282
  137   2HB   PRO  21          1HB       PRO  21   2.241  -2.699   1.633
  138   1HG   PRO  21          2HG       PRO  21   4.540  -2.067   2.940
  139   2HG   PRO  21          1HG       PRO  21   2.933  -1.930   3.671
  140   1HD   PRO  21          2HD       PRO  21   4.995  -4.073   4.014
  141   2HD   PRO  21          1HD       PRO  21   3.919  -3.336   5.221
  142    H    GLU  22           H        GLU  22   1.183  -6.280   1.156
  143    HA   GLU  22           HA       GLU  22   3.431  -8.008   0.543
  144   1HB   GLU  22          2HB       GLU  22   0.994  -8.759   1.023
  145   2HB   GLU  22          1HB       GLU  22   0.672  -8.262  -0.632
  146   1HG   GLU  22          2HG       GLU  22   1.078 -10.602  -0.630
  147   2HG   GLU  22          1HG       GLU  22   2.467  -9.815  -1.380
  148    H    ILE  23           H        ILE  23   4.792  -7.042  -0.856
  149    HA   ILE  23           HA       ILE  23   3.689  -5.418  -3.003
  150    HB   ILE  23           HB       ILE  23   6.593  -5.854  -2.285
  151   1HG1  ILE  23          2HG1      ILE  23   4.713  -3.613  -1.501
  152   2HG1  ILE  23          1HG1      ILE  23   5.344  -4.849  -0.419
  153   1HG2  ILE  23          1HG2      ILE  23   6.964  -3.808  -3.583
  154   2HG2  ILE  23          2HG2      ILE  23   5.246  -3.755  -3.983
  155   3HG2  ILE  23          3HG2      ILE  23   6.246  -5.082  -4.571
  156   1HD1  ILE  23          1HD1      ILE  23   7.613  -4.004  -0.808
  157   2HD1  ILE  23          2HD1      ILE  23   6.544  -2.780  -0.124
  158   3HD1  ILE  23          3HD1      ILE  23   6.948  -2.739  -1.841
  159    H    ASP  24           H        ASP  24   3.182  -6.382  -4.834
  160    HA   ASP  24           HA       ASP  24   4.727  -8.650  -5.808
  161   1HB   ASP  24          2HB       ASP  24   2.261  -7.246  -6.833
  162   2HB   ASP  24          1HB       ASP  24   3.100  -8.480  -7.768
  163    H    ASP  25           H        ASP  25   6.631  -8.131  -6.623
  164    HA   ASP  25           HA       ASP  25   7.235  -5.434  -7.333
  165   1HB   ASP  25          2HB       ASP  25   8.752  -7.053  -6.121
  166   2HB   ASP  25          1HB       ASP  25   8.993  -7.872  -7.658
  167    H    ASP  26           H        ASP  26   6.508  -8.346  -9.101
  168    HA   ASP  26           HA       ASP  26   7.687  -7.587 -11.559
  169   1HB   ASP  26          2HB       ASP  26   5.435  -9.522 -10.995
  170   2HB   ASP  26          1HB       ASP  26   6.178  -9.320 -12.575
  171    H    THR  27           H        THR  27   4.367  -7.287 -10.332
  172    HA   THR  27           HA       THR  27   3.615  -5.815 -12.736
  173    HB   THR  27           HB       THR  27   2.044  -7.506 -12.012
  174    HG1  THR  27           HG1      THR  27   1.372  -4.825 -12.073
  175   1HG2  THR  27          1HG2      THR  27   0.844  -7.343  -9.888
  176   2HG2  THR  27          2HG2      THR  27   1.829  -5.951  -9.436
  177   3HG2  THR  27          3HG2      THR  27   2.577  -7.536  -9.627
  178    H    GLY  28           H        GLY  28   4.559  -5.174  -9.492
  179   1HA   GLY  28          2HA       GLY  28   5.119  -3.083  -8.631
  180   2HA   GLY  28          1HA       GLY  28   4.338  -2.334 -10.018
  181    H    LEU  29           H        LEU  29   2.765  -4.724  -8.005
  182    HA   LEU  29           HA       LEU  29   0.915  -2.624  -7.099
  183   1HB   LEU  29          2HB       LEU  29   0.394  -5.595  -7.283
  184   2HB   LEU  29          1HB       LEU  29  -0.774  -4.360  -6.860
  185    HG   LEU  29           HG       LEU  29   0.518  -4.765  -9.556
  186   1HD1  LEU  29          1HD1      LEU  29  -1.769  -5.252 -10.283
  187   2HD1  LEU  29          2HD1      LEU  29  -2.324  -5.107  -8.618
  188   3HD1  LEU  29          3HD1      LEU  29  -1.206  -6.392  -9.066
  189   1HD2  LEU  29          1HD2      LEU  29  -1.487  -2.680  -8.715
  190   2HD2  LEU  29          2HD2      LEU  29  -0.895  -2.959 -10.352
  191   3HD2  LEU  29          3HD2      LEU  29   0.209  -2.387  -9.102
  192    H    VAL  30           H        VAL  30   0.550  -2.346  -4.956
  193    HA   VAL  30           HA       VAL  30   2.049  -4.122  -3.135
  194    HB   VAL  30           HB       VAL  30   1.332  -1.212  -2.734
  195   1HG1  VAL  30          1HG1      VAL  30   2.802  -1.370  -0.757
  196   2HG1  VAL  30          2HG1      VAL  30   2.920  -3.110  -1.014
  197   3HG1  VAL  30          3HG1      VAL  30   1.363  -2.378  -0.623
  198   1HG2  VAL  30          1HG2      VAL  30   3.742  -0.807  -2.913
  199   2HG2  VAL  30          2HG2      VAL  30   3.075  -1.479  -4.399
  200   3HG2  VAL  30          3HG2      VAL  30   3.992  -2.509  -3.302
  201    H    SER  31           H        SER  31   0.630  -5.524  -2.315
  202    HA   SER  31           HA       SER  31  -2.106  -4.734  -1.805
  203   1HB   SER  31          2HB       SER  31  -1.530  -6.981  -2.749
  204   2HB   SER  31          1HB       SER  31  -0.767  -7.383  -1.213
  205    HG   SER  31           HG       SER  31  -3.464  -6.540  -1.404
  206    H    TYR  32           H        TYR  32  -2.315  -3.454  -0.109
  207    HA   TYR  32           HA       TYR  32  -0.875  -4.065   2.360
  208   1HB   TYR  32          2HB       TYR  32  -1.566  -1.840   3.118
  209   2HB   TYR  32          1HB       TYR  32  -0.734  -1.743   1.572
  210    HD1  TYR  32           HD2      TYR  32  -2.395  -1.871  -0.523
  211    HD2  TYR  32           HD1      TYR  32  -3.485  -0.588   3.375
  212    HE1  TYR  32           HE2      TYR  32  -4.297  -0.642  -1.470
  213    HE2  TYR  32           HE1      TYR  32  -5.391   0.652   2.436
  214    HH   TYR  32           HH       TYR  32  -6.001   1.684   0.207
  215    H    HIS  33           H        HIS  33  -2.273  -3.505   4.385
  216    HA   HIS  33           HA       HIS  33  -4.897  -4.795   4.056
  217   1HB   HIS  33          2HB       HIS  33  -2.939  -5.369   6.300
  218   2HB   HIS  33          1HB       HIS  33  -4.512  -6.120   6.070
  219    HD1  HIS  33           HD1      HIS  33  -1.001  -6.661   5.406
  220    HD2  HIS  33           HD2      HIS  33  -4.573  -7.700   3.543
  221    HE1  HIS  33           HE1      HIS  33  -0.429  -8.541   3.844
  222    HE2  HIS  33           HE2      HIS  33  -2.626  -9.253   2.841
  223    H    ASP  34           H        ASP  34  -6.360  -3.333   4.656
  224    HA   ASP  34           HA       ASP  34  -5.912  -1.092   6.282
  225   1HB   ASP  34          2HB       ASP  34  -8.156  -2.298   4.954
  226   2HB   ASP  34          1HB       ASP  34  -8.626  -1.808   6.577
  227    H    GLN  35           H        GLN  35  -6.704  -0.591   8.347
  228    HA   GLN  35           HA       GLN  35  -6.461  -2.453  10.421
  229   1HB   GLN  35          2HB       GLN  35  -7.686  -0.703  11.759
  230   2HB   GLN  35          1HB       GLN  35  -6.291  -0.100  10.875
  231   1HG   GLN  35          2HG       GLN  35  -7.834   0.673   9.090
  232   2HG   GLN  35          1HG       GLN  35  -9.186   0.205  10.120
  233   1HE2  GLN  35          1HE2      GLN  35  -8.492   2.811   9.080
  234   2HE2  GLN  35          2HE2      GLN  35  -8.273   3.839  10.456
  235    H    GLN  36           H        GLN  36  -9.094  -1.597   8.334
  236    HA   GLN  36           HA       GLN  36 -11.178  -2.905   9.770
  237   1HB   GLN  36          2HB       GLN  36 -11.593  -1.131   8.117
  238   2HB   GLN  36          1HB       GLN  36 -10.949  -2.158   6.847
  239   1HG   GLN  36          2HG       GLN  36 -13.302  -2.219   6.676
  240   2HG   GLN  36          1HG       GLN  36 -12.793  -3.773   7.333
  241   1HE2  GLN  36          1HE2      GLN  36 -13.277  -4.276   9.476
  242   2HE2  GLN  36          2HE2      GLN  36 -14.456  -3.389  10.380
  243    H    GLY  37           H        GLY  37  -8.592  -3.998   7.826
  244   1HA   GLY  37          2HA       GLY  37  -8.041  -6.303   7.612
  245   2HA   GLY  37          1HA       GLY  37  -9.750  -6.695   7.748
  246    H    ASN  38           H        ASN  38  -8.949  -4.070   5.719
  247    HA   ASN  38           HA       ASN  38  -9.922  -5.486   3.404
  248   1HB   ASN  38          2HB       ASN  38  -8.870  -2.660   3.695
  249   2HB   ASN  38          1HB       ASN  38  -9.626  -3.311   2.246
  250   1HD2  ASN  38          1HD2      ASN  38 -10.345  -1.076   4.022
  251   2HD2  ASN  38          2HD2      ASN  38 -11.986  -1.390   4.499
  252    H    ALA  39           H        ALA  39  -8.590  -6.770   2.282
  253    HA   ALA  39           HA       ALA  39  -5.764  -6.097   2.060
  254   1HB   ALA  39          1HB       ALA  39  -6.416  -8.446   2.409
  255   2HB   ALA  39          2HB       ALA  39  -5.536  -8.223   0.896
  256   3HB   ALA  39          3HB       ALA  39  -7.289  -8.419   0.875
  257    H    MET  40           H        MET  40  -5.689  -4.266   0.822
  258    HA   MET  40           HA       MET  40  -6.911  -4.432  -1.855
  259   1HB   MET  40          2HB       MET  40  -6.448  -1.999  -0.115
  260   2HB   MET  40          1HB       MET  40  -7.001  -1.934  -1.785
  261   1HG   MET  40          2HG       MET  40  -8.964  -3.277  -1.141
  262   2HG   MET  40          1HG       MET  40  -8.427  -3.213   0.535
  263   1HE   MET  40          1HE       MET  40  -7.427  -0.328   1.035
  264   2HE   MET  40          2HE       MET  40  -8.591  -1.154   2.074
  265   3HE   MET  40          3HE       MET  40  -8.918   0.488   1.513
  266    H    GLN  41           H        GLN  41  -5.699  -2.649  -3.330
  267    HA   GLN  41           HA       GLN  41  -2.827  -3.165  -2.979
  268   1HB   GLN  41          2HB       GLN  41  -4.410  -3.615  -5.516
  269   2HB   GLN  41          1HB       GLN  41  -2.657  -3.700  -5.391
  270   1HG   GLN  41          2HG       GLN  41  -2.835  -5.552  -3.834
  271   2HG   GLN  41          1HG       GLN  41  -4.593  -5.461  -3.906
  272   1HE2  GLN  41          1HE2      GLN  41  -4.583  -4.884  -6.775
  273   2HE2  GLN  41          2HE2      GLN  41  -4.215  -6.383  -7.563
  274    H    ILE  42           H        ILE  42  -1.737  -1.347  -3.019
  275    HA   ILE  42           HA       ILE  42  -2.682   0.890  -4.674
  276    HB   ILE  42           HB       ILE  42  -1.048   2.289  -3.543
  277   1HG1  ILE  42          2HG1      ILE  42  -0.287  -0.007  -1.759
  278   2HG1  ILE  42          1HG1      ILE  42   0.573   0.293  -3.266
  279   1HG2  ILE  42          1HG2      ILE  42  -3.203   2.045  -2.449
  280   2HG2  ILE  42          2HG2      ILE  42  -1.916   2.234  -1.255
  281   3HG2  ILE  42          3HG2      ILE  42  -2.610   0.641  -1.559
  282   1HD1  ILE  42          1HD1      ILE  42   1.708   1.281  -1.360
  283   2HD1  ILE  42          2HD1      ILE  42   0.276   2.248  -1.005
  284   3HD1  ILE  42          3HD1      ILE  42   1.170   2.510  -2.506
  285    H    ASN  43           H        ASN  43  -0.582   2.147  -5.540
  286    HA   ASN  43           HA       ASN  43   0.833   0.231  -7.202
  287   1HB   ASN  43          2HB       ASN  43   0.346   3.151  -7.286
  288   2HB   ASN  43          1HB       ASN  43   1.882   2.603  -7.939
  289   1HD2  ASN  43          1HD2      ASN  43   0.828   0.048  -8.837
  290   2HD2  ASN  43          2HD2      ASN  43  -0.148   0.385 -10.223
  291    H    ARG  44           H        ARG  44   3.029  -0.086  -7.212
  292    HA   ARG  44           HA       ARG  44   4.462   0.210  -4.799
  293   1HB   ARG  44          2HB       ARG  44   4.838  -1.534  -6.561
  294   2HB   ARG  44          1HB       ARG  44   5.557  -0.298  -7.576
  295   1HG   ARG  44          2HG       ARG  44   6.705  -0.647  -4.874
  296   2HG   ARG  44          1HG       ARG  44   6.986  -1.934  -6.045
  297   1HD   ARG  44          2HD       ARG  44   7.684   0.986  -6.347
  298   2HD   ARG  44          1HD       ARG  44   8.808  -0.354  -6.126
  299    HE   ARG  44           HE       ARG  44   7.202   0.160  -8.547
  300   1HH1  ARG  44          1HH1      ARG  44   9.894  -1.426  -6.948
  301   2HH1  ARG  44          2HH1      ARG  44  10.642  -1.939  -8.432
  302   1HH2  ARG  44          1HH2      ARG  44   8.166  -0.530 -10.496
  303   2HH2  ARG  44          2HH2      ARG  44   9.655  -1.428 -10.456
  304    H    ASP  45           H        ASP  45   3.873   2.314  -7.386
  305    HA   ASP  45           HA       ASP  45   6.164   4.032  -6.930
  306   1HB   ASP  45          2HB       ASP  45   5.245   3.632  -9.209
  307   2HB   ASP  45          1HB       ASP  45   3.755   4.430  -8.724
  308    H    ASP  46           H        ASP  46   3.043   3.639  -5.667
  309    HA   ASP  46           HA       ASP  46   2.682   6.459  -5.013
  310   1HB   ASP  46          2HB       ASP  46   0.726   5.191  -5.792
  311   2HB   ASP  46          1HB       ASP  46   0.896   4.086  -4.431
  312    H    VAL  47           H        VAL  47   3.462   3.413  -3.472
  313    HA   VAL  47           HA       VAL  47   3.332   4.406  -0.801
  314    HB   VAL  47           HB       VAL  47   3.261   1.982  -1.330
  315   1HG1  VAL  47          1HG1      VAL  47   5.344   0.784  -1.826
  316   2HG1  VAL  47          2HG1      VAL  47   6.175   2.331  -1.998
  317   3HG1  VAL  47          3HG1      VAL  47   4.883   1.894  -3.118
  318   1HG2  VAL  47          1HG2      VAL  47   3.842   2.694   0.921
  319   2HG2  VAL  47          2HG2      VAL  47   5.543   2.779   0.469
  320   3HG2  VAL  47          3HG2      VAL  47   4.712   1.225   0.483
  321    H    SER  48           H        SER  48   5.045   5.127   0.526
  322    HA   SER  48           HA       SER  48   7.523   5.825  -0.873
  323   1HB   SER  48          2HB       SER  48   5.960   7.746  -1.047
  324   2HB   SER  48          1HB       SER  48   5.864   7.808   0.711
  325    HG   SER  48           HG       SER  48   8.093   8.332  -0.965
  326    H    GLN  49           H        GLN  49   5.980   6.418   2.311
  327    HA   GLN  49           HA       GLN  49   8.532   5.587   3.522
  328   1HB   GLN  49          2HB       GLN  49   6.548   7.693   4.361
  329   2HB   GLN  49          1HB       GLN  49   7.775   7.069   5.453
  330   1HG   GLN  49          2HG       GLN  49   8.532   8.187   2.784
  331   2HG   GLN  49          1HG       GLN  49   8.228   9.248   4.156
  332   1HE2  GLN  49          1HE2      GLN  49   9.636   6.073   4.543
  333   2HE2  GLN  49          2HE2      GLN  49  11.215   6.618   4.977
  334    H    ILE  50           H        ILE  50   8.407   3.707   4.494
  335    HA   ILE  50           HA       ILE  50   5.966   3.017   5.984
  336    HB   ILE  50           HB       ILE  50   8.365   1.265   5.340
  337   1HG1  ILE  50          2HG1      ILE  50   7.171   1.881   3.287
  338   2HG1  ILE  50          1HG1      ILE  50   6.940   0.177   3.661
  339   1HG2  ILE  50          1HG2      ILE  50   6.920  -0.598   6.011
  340   2HG2  ILE  50          2HG2      ILE  50   5.642   0.543   6.426
  341   3HG2  ILE  50          3HG2      ILE  50   7.154   0.546   7.334
  342   1HD1  ILE  50          1HD1      ILE  50   4.964   2.394   4.152
  343   2HD1  ILE  50          2HD1      ILE  50   4.727   0.702   4.588
  344   3HD1  ILE  50          3HD1      ILE  50   4.876   1.164   2.892
  345    H    ILE  51           H        ILE  51   6.416   2.187   8.253
  346    HA   ILE  51           HA       ILE  51   8.537   3.744   9.474
  347    HB   ILE  51           HB       ILE  51   6.674   1.805  10.859
  348   1HG1  ILE  51          2HG1      ILE  51   6.345   4.780  10.399
  349   2HG1  ILE  51          1HG1      ILE  51   5.405   3.517   9.614
  350   1HG2  ILE  51          1HG2      ILE  51   8.650   2.440  12.148
  351   2HG2  ILE  51          2HG2      ILE  51   7.194   3.153  12.844
  352   3HG2  ILE  51          3HG2      ILE  51   8.288   4.146  11.879
  353   1HD1  ILE  51          1HD1      ILE  51   5.434   4.109  12.563
  354   2HD1  ILE  51          2HD1      ILE  51   4.481   2.858  11.762
  355   3HD1  ILE  51          3HD1      ILE  51   4.169   4.560  11.420
  356    H    GLU  52           H        GLU  52  10.099   2.517   8.121
  357    HA   GLU  52           HA       GLU  52  10.519  -0.248   8.403
  358   1HB   GLU  52          2HB       GLU  52  12.553   1.864   7.657
  359   2HB   GLU  52          1HB       GLU  52  12.710   0.139   7.373
  360   1HG   GLU  52          2HG       GLU  52  11.965   0.664   5.329
  361   2HG   GLU  52          1HG       GLU  52  10.382   0.628   6.104
  362    H    ARG  53           H        ARG  53  11.888   2.509  10.117
  363    HA   ARG  53           HA       ARG  53  13.237   0.620  11.918
  364   1HB   ARG  53          2HB       ARG  53  14.617   2.389  10.705
  365   2HB   ARG  53          1HB       ARG  53  13.823   3.573  11.737
  366   1HG   ARG  53          2HG       ARG  53  15.940   3.013  12.700
  367   2HG   ARG  53          1HG       ARG  53  14.665   2.339  13.718
  368   1HD   ARG  53          2HD       ARG  53  14.987   0.185  12.372
  369   2HD   ARG  53          1HD       ARG  53  16.487   0.915  11.801
  370    HE   ARG  53           HE       ARG  53  15.995   0.635  14.687
  371   1HH1  ARG  53          1HH1      ARG  53  17.938  -0.001  11.847
  372   2HH1  ARG  53          2HH1      ARG  53  19.157  -0.893  12.714
  373   1HH2  ARG  53          1HH2      ARG  53  17.589  -0.542  15.845
  374   2HH2  ARG  53          2HH2      ARG  53  18.967  -1.173  14.995
  Start of MODEL   11
    1    H    ASP   4           H        ASP   4  -0.947   2.526  15.763
    2    HA   ASP   4           HA       ASP   4   0.088  -0.142  15.437
    3   1HB   ASP   4          2HB       ASP   4  -1.797  -0.385  13.806
    4   2HB   ASP   4          1HB       ASP   4  -2.304   0.107  15.418
    5    H    TYR   5           H        TYR   5   0.085  -0.907  12.988
    6    HA   TYR   5           HA       TYR   5   2.432   0.261  11.908
    7   1HB   TYR   5          2HB       TYR   5   0.590  -1.628  10.442
    8   2HB   TYR   5          1HB       TYR   5   2.324  -1.429  10.232
    9    HD1  TYR   5           HD1      TYR   5   3.879  -2.287  12.010
   10    HD2  TYR   5           HD2      TYR   5  -0.295  -3.123  12.049
   11    HE1  TYR   5           HE1      TYR   5   4.269  -4.158  13.561
   12    HE2  TYR   5           HE2      TYR   5   0.084  -4.988  13.602
   13    HH   TYR   5           HH       TYR   5   2.884  -5.432  15.325
   14    H    VAL   6           H        VAL   6   2.662   1.760  10.329
   15    HA   VAL   6           HA       VAL   6   0.237   2.695   8.979
   16    HB   VAL   6           HB       VAL   6   1.098   5.047   9.220
   17   1HG1  VAL   6          1HG1      VAL   6   0.221   5.327  11.488
   18   2HG1  VAL   6          2HG1      VAL   6   0.343   3.585  11.745
   19   3HG1  VAL   6          3HG1      VAL   6  -0.771   4.222  10.533
   20   1HG2  VAL   6          1HG2      VAL   6   2.864   3.774  11.308
   21   2HG2  VAL   6          2HG2      VAL   6   2.626   5.508  11.088
   22   3HG2  VAL   6          3HG2      VAL   6   3.401   4.556   9.820
   23    H    MET   7           H        MET   7   0.475   3.470   6.940
   24    HA   MET   7           HA       MET   7   3.185   3.571   5.816
   25   1HB   MET   7          2HB       MET   7   2.235   1.395   5.215
   26   2HB   MET   7          1HB       MET   7   0.807   2.183   4.560
   27   1HG   MET   7          2HG       MET   7   2.202   3.274   2.863
   28   2HG   MET   7          1HG       MET   7   3.616   2.442   3.509
   29   1HE   MET   7          1HE       MET   7   0.041   0.257   1.571
   30   2HE   MET   7          2HE       MET   7   0.138   2.013   1.723
   31   3HE   MET   7          3HE       MET   7  -0.030   1.009   3.163
   32    H    ALA   8           H        ALA   8   3.402   5.648   5.290
   33    HA   ALA   8           HA       ALA   8   1.116   7.161   4.306
   34   1HB   ALA   8          1HB       ALA   8   3.950   8.052   4.831
   35   2HB   ALA   8          2HB       ALA   8   2.599   8.200   5.953
   36   3HB   ALA   8          3HB       ALA   8   2.586   9.099   4.436
   37    H    THR   9           H        THR   9   0.701   7.346   2.207
   38    HA   THR   9           HA       THR   9   2.615   6.307   0.301
   39    HB   THR   9           HB       THR   9   0.767   6.692  -1.350
   40    HG1  THR   9           HG1      THR   9  -1.274   7.232  -0.489
   41   1HG2  THR   9          1HG2      THR   9   1.073   4.523  -0.255
   42   2HG2  THR   9          2HG2      THR   9  -0.638   4.863  -0.512
   43   3HG2  THR   9          3HG2      THR   9   0.067   5.056   1.092
   44    H    LYS  10           H        LYS  10   2.508   7.582  -1.903
   45    HA   LYS  10           HA       LYS  10   4.036   9.914  -1.534
   46   1HB   LYS  10          2HB       LYS  10   4.237   8.436  -3.475
   47   2HB   LYS  10          1HB       LYS  10   2.616   8.873  -3.990
   48   1HG   LYS  10          2HG       LYS  10   3.298  11.093  -4.508
   49   2HG   LYS  10          1HG       LYS  10   4.881  10.840  -3.765
   50   1HD   LYS  10          2HD       LYS  10   4.968  10.694  -6.226
   51   2HD   LYS  10          1HD       LYS  10   5.434   9.181  -5.447
   52   1HE   LYS  10          2HE       LYS  10   3.074   8.393  -5.780
   53   2HE   LYS  10          1HE       LYS  10   2.801   9.834  -6.759
   54   1HZ   LYS  10          1HZ       LYS  10   4.792   7.697  -7.306
   55   2HZ   LYS  10          2HZ       LYS  10   4.592   9.101  -8.232
   56   3HZ   LYS  10          3HZ       LYS  10   3.348   7.961  -8.151
   57    H    ASP  11           H        ASP  11   0.647   9.388  -1.805
   58    HA   ASP  11           HA       ASP  11  -0.202  11.994  -2.477
   59   1HB   ASP  11          2HB       ASP  11  -1.832  10.298  -2.651
   60   2HB   ASP  11          1HB       ASP  11  -1.498   9.690  -1.034
   61    H    GLY  12           H        GLY  12   0.779  10.505   0.540
   62   1HA   GLY  12          2HA       GLY  12   1.717  11.898   2.272
   63   2HA   GLY  12          1HA       GLY  12   0.562  13.145   1.830
   64    H    ARG  13           H        ARG  13  -1.211  10.463   1.656
   65    HA   ARG  13           HA       ARG  13  -2.447  10.881   4.209
   66   1HB   ARG  13          2HB       ARG  13  -4.012   9.115   3.509
   67   2HB   ARG  13          1HB       ARG  13  -3.825  10.345   2.266
   68   1HG   ARG  13          2HG       ARG  13  -2.260   8.861   1.077
   69   2HG   ARG  13          1HG       ARG  13  -2.541   7.620   2.298
   70   1HD   ARG  13          2HD       ARG  13  -3.899   7.215   0.318
   71   2HD   ARG  13          1HD       ARG  13  -4.916   7.578   1.713
   72    HE   ARG  13           HE       ARG  13  -4.401   9.965   0.310
   73   1HH1  ARG  13          1HH1      ARG  13  -6.102   6.932  -0.158
   74   2HH1  ARG  13          2HH1      ARG  13  -7.368   7.643  -1.121
   75   1HH2  ARG  13          1HH2      ARG  13  -6.068  10.902  -0.959
   76   2HH2  ARG  13          2HH2      ARG  13  -7.336   9.894  -1.594
   77    H    MET  14           H        MET  14  -2.203   9.754   6.027
   78    HA   MET  14           HA       MET  14  -0.184   7.659   6.095
   79   1HB   MET  14          2HB       MET  14  -0.209   9.480   7.808
   80   2HB   MET  14          1HB       MET  14  -1.762   8.879   8.374
   81   1HG   MET  14          2HG       MET  14  -0.092   8.054   9.840
   82   2HG   MET  14          1HG       MET  14  -0.653   6.699   8.861
   83   1HE   MET  14          1HE       MET  14   3.354   8.901   8.231
   84   2HE   MET  14          2HE       MET  14   2.201   9.279   9.509
   85   3HE   MET  14          3HE       MET  14   1.797   9.625   7.828
   86    H    ILE  15           H        ILE  15  -1.018   5.788   5.337
   87    HA   ILE  15           HA       ILE  15  -3.735   5.021   5.924
   88    HB   ILE  15           HB       ILE  15  -1.551   3.478   4.514
   89   1HG1  ILE  15          2HG1      ILE  15  -3.878   5.073   3.402
   90   2HG1  ILE  15          1HG1      ILE  15  -2.189   5.567   3.358
   91   1HG2  ILE  15          1HG2      ILE  15  -3.361   2.062   3.681
   92   2HG2  ILE  15          2HG2      ILE  15  -4.521   2.968   4.652
   93   3HG2  ILE  15          3HG2      ILE  15  -3.266   2.012   5.441
   94   1HD1  ILE  15          1HD1      ILE  15  -2.932   4.675   1.217
   95   2HD1  ILE  15          2HD1      ILE  15  -3.343   3.146   1.993
   96   3HD1  ILE  15          3HD1      ILE  15  -1.661   3.676   1.923
   97    H    LEU  16           H        LEU  16  -4.354   3.994   7.678
   98    HA   LEU  16           HA       LEU  16  -2.493   2.815   9.507
   99   1HB   LEU  16          2HB       LEU  16  -5.510   2.656   9.469
  100   2HB   LEU  16          1HB       LEU  16  -4.481   2.176  10.799
  101    HG   LEU  16           HG       LEU  16  -5.325   4.239  11.456
  102   1HD1  LEU  16          1HD1      LEU  16  -2.925   4.142  11.767
  103   2HD1  LEU  16          2HD1      LEU  16  -3.445   5.794  11.434
  104   3HD1  LEU  16          3HD1      LEU  16  -2.673   4.840  10.168
  105   1HD2  LEU  16          1HD2      LEU  16  -5.433   6.226  10.055
  106   2HD2  LEU  16          2HD2      LEU  16  -6.331   4.889   9.335
  107   3HD2  LEU  16          3HD2      LEU  16  -4.741   5.323   8.707
  108    H    THR  17           H        THR  17  -1.579   0.925   9.090
  109    HA   THR  17           HA       THR  17  -3.001  -0.923   7.295
  110    HB   THR  17           HB       THR  17  -0.596  -1.786   6.849
  111    HG1  THR  17           HG1      THR  17  -0.076   0.194   8.581
  112   1HG2  THR  17          1HG2      THR  17  -0.259  -0.106   5.095
  113   2HG2  THR  17          2HG2      THR  17  -1.444   0.946   5.868
  114   3HG2  THR  17          3HG2      THR  17  -1.949  -0.600   5.187
  115    H    ASP  18           H        ASP  18  -3.301  -3.020   7.885
  116    HA   ASP  18           HA       ASP  18  -2.125  -4.106  10.263
  117   1HB   ASP  18          2HB       ASP  18  -4.130  -5.173   9.390
  118   2HB   ASP  18          1HB       ASP  18  -3.353  -5.449   7.833
  119    H    GLY  19           H        GLY  19  -0.107  -4.984  10.456
  120   1HA   GLY  19          2HA       GLY  19   1.795  -3.867   8.712
  121   2HA   GLY  19          1HA       GLY  19   2.149  -5.045   9.970
  122    H    LYS  20           H        LYS  20   3.435  -4.938   7.360
  123    HA   LYS  20           HA       LYS  20   4.303  -6.714   6.179
  124   1HB   LYS  20          2HB       LYS  20   1.862  -8.257   7.026
  125   2HB   LYS  20          1HB       LYS  20   3.080  -8.882   5.924
  126   1HG   LYS  20          2HG       LYS  20   4.764  -8.764   7.626
  127   2HG   LYS  20          1HG       LYS  20   3.653  -7.943   8.725
  128   1HD   LYS  20          2HD       LYS  20   2.245  -9.910   8.827
  129   2HD   LYS  20          1HD       LYS  20   3.261 -10.731   7.639
  130   1HE   LYS  20          2HE       LYS  20   3.772 -11.489   9.888
  131   2HE   LYS  20          1HE       LYS  20   5.146 -10.640   9.183
  132   1HZ   LYS  20          1HZ       LYS  20   3.248  -9.615  11.220
  133   2HZ   LYS  20          2HZ       LYS  20   4.373  -8.638  10.422
  134   3HZ   LYS  20          3HZ       LYS  20   4.908  -9.909  11.404
  135    HA   PRO  21           HA       PRO  21   1.754  -5.274   2.731
  136   1HB   PRO  21          2HB       PRO  21   3.500  -3.538   1.673
  137   2HB   PRO  21          1HB       PRO  21   2.463  -3.100   3.034
  138   1HG   PRO  21          2HG       PRO  21   5.358  -3.738   2.987
  139   2HG   PRO  21          1HG       PRO  21   4.463  -2.645   4.054
  140   1HD   PRO  21          2HD       PRO  21   5.290  -5.286   4.640
  141   2HD   PRO  21          1HD       PRO  21   4.192  -4.279   5.601
  142    H    GLU  22           H        GLU  22   1.732  -6.555   1.034
  143    HA   GLU  22           HA       GLU  22   4.094  -8.064   0.298
  144   1HB   GLU  22          2HB       GLU  22   1.252  -8.148  -0.727
  145   2HB   GLU  22          1HB       GLU  22   2.533  -9.208  -1.289
  146   1HG   GLU  22          2HG       GLU  22   1.572  -9.039   1.559
  147   2HG   GLU  22          1HG       GLU  22   1.060 -10.256   0.388
  148    H    ILE  23           H        ILE  23   5.525  -7.003  -0.908
  149    HA   ILE  23           HA       ILE  23   4.656  -5.067  -2.892
  150    HB   ILE  23           HB       ILE  23   7.473  -5.967  -2.266
  151   1HG1  ILE  23          2HG1      ILE  23   5.898  -3.614  -1.191
  152   2HG1  ILE  23          1HG1      ILE  23   6.382  -5.034  -0.274
  153   1HG2  ILE  23          1HG2      ILE  23   7.237  -4.893  -4.442
  154   2HG2  ILE  23          2HG2      ILE  23   8.108  -3.843  -3.324
  155   3HG2  ILE  23          3HG2      ILE  23   6.411  -3.526  -3.691
  156   1HD1  ILE  23          1HD1      ILE  23   8.728  -4.434  -0.591
  157   2HD1  ILE  23          2HD1      ILE  23   7.822  -3.153   0.216
  158   3HD1  ILE  23          3HD1      ILE  23   8.233  -3.001  -1.493
  159    H    ASP  24           H        ASP  24   3.846  -5.955  -4.670
  160    HA   ASP  24           HA       ASP  24   4.936  -8.391  -5.800
  161   1HB   ASP  24          2HB       ASP  24   2.580  -8.259  -5.907
  162   2HB   ASP  24          1HB       ASP  24   2.614  -6.596  -6.481
  163    H    ASP  25           H        ASP  25   6.131  -8.564  -7.636
  164    HA   ASP  25           HA       ASP  25   7.072  -6.039  -8.814
  165   1HB   ASP  25          2HB       ASP  25   9.096  -7.296  -9.490
  166   2HB   ASP  25          1HB       ASP  25   8.861  -7.278  -7.748
  167    H    ASP  26           H        ASP  26   4.803  -8.130  -9.467
  168    HA   ASP  26           HA       ASP  26   5.430  -8.750 -12.239
  169   1HB   ASP  26          2HB       ASP  26   4.191 -10.427 -11.051
  170   2HB   ASP  26          1HB       ASP  26   3.005  -9.248 -10.504
  171    H    THR  27           H        THR  27   2.911  -6.947 -10.515
  172    HA   THR  27           HA       THR  27   2.611  -5.219 -12.887
  173    HB   THR  27           HB       THR  27   0.530  -6.338 -12.414
  174    HG1  THR  27           HG1      THR  27   0.721  -3.602 -11.812
  175   1HG2  THR  27          1HG2      THR  27   0.741  -5.251  -9.611
  176   2HG2  THR  27          2HG2      THR  27   0.940  -6.939 -10.081
  177   3HG2  THR  27          3HG2      THR  27  -0.625  -6.148 -10.272
  178    H    GLY  28           H        GLY  28   3.712  -5.404  -9.705
  179   1HA   GLY  28          2HA       GLY  28   4.962  -3.772  -8.614
  180   2HA   GLY  28          1HA       GLY  28   4.379  -2.582  -9.769
  181    H    LEU  29           H        LEU  29   2.302  -4.744  -7.938
  182    HA   LEU  29           HA       LEU  29   1.166  -2.383  -6.624
  183   1HB   LEU  29          2HB       LEU  29   0.033  -5.164  -6.914
  184   2HB   LEU  29          1HB       LEU  29  -0.775  -3.820  -6.132
  185    HG   LEU  29           HG       LEU  29  -0.117  -4.096  -9.059
  186   1HD1  LEU  29          1HD1      LEU  29  -2.073  -5.335  -8.324
  187   2HD1  LEU  29          2HD1      LEU  29  -2.540  -3.964  -9.332
  188   3HD1  LEU  29          3HD1      LEU  29  -2.732  -3.878  -7.581
  189   1HD2  LEU  29          1HD2      LEU  29   0.274  -1.791  -8.344
  190   2HD2  LEU  29          2HD2      LEU  29  -1.340  -1.739  -7.633
  191   3HD2  LEU  29          3HD2      LEU  29  -1.150  -1.918  -9.378
  192    H    VAL  30           H        VAL  30   1.037  -2.184  -4.448
  193    HA   VAL  30           HA       VAL  30   2.441  -4.223  -2.857
  194    HB   VAL  30           HB       VAL  30   1.865  -1.345  -2.117
  195   1HG1  VAL  30          1HG1      VAL  30   3.399  -1.736  -0.259
  196   2HG1  VAL  30          2HG1      VAL  30   3.604  -3.412  -0.768
  197   3HG1  VAL  30          3HG1      VAL  30   2.034  -2.854  -0.189
  198   1HG2  VAL  30          1HG2      VAL  30   4.277  -0.980  -2.461
  199   2HG2  VAL  30          2HG2      VAL  30   3.462  -1.459  -3.950
  200   3HG2  VAL  30          3HG2      VAL  30   4.429  -2.632  -3.058
  201    H    SER  31           H        SER  31   1.047  -5.610  -2.030
  202    HA   SER  31           HA       SER  31  -1.697  -4.873  -1.500
  203   1HB   SER  31          2HB       SER  31  -0.358  -7.493  -0.850
  204   2HB   SER  31          1HB       SER  31  -2.071  -7.198  -1.124
  205    HG   SER  31           HG       SER  31  -0.785  -6.373  -3.282
  206    H    TYR  32           H        TYR  32  -2.558  -4.357   0.402
  207    HA   TYR  32           HA       TYR  32  -1.127  -5.003   2.879
  208   1HB   TYR  32          2HB       TYR  32  -1.294  -2.742   3.715
  209   2HB   TYR  32          1HB       TYR  32  -0.485  -2.683   2.152
  210    HD1  TYR  32           HD2      TYR  32  -1.832  -1.970   0.117
  211    HD2  TYR  32           HD1      TYR  32  -3.290  -1.544   4.091
  212    HE1  TYR  32           HE2      TYR  32  -3.505  -0.342  -0.671
  213    HE2  TYR  32           HE1      TYR  32  -4.956   0.083   3.311
  214    HH   TYR  32           HH       TYR  32  -5.483   1.488   1.569
  215    H    HIS  33           H        HIS  33  -2.556  -4.642   4.801
  216    HA   HIS  33           HA       HIS  33  -5.385  -5.045   4.064
  217   1HB   HIS  33          2HB       HIS  33  -4.093  -5.766   6.706
  218   2HB   HIS  33          1HB       HIS  33  -5.692  -6.227   6.142
  219    HD1  HIS  33           HD1      HIS  33  -2.809  -7.849   6.888
  220    HD2  HIS  33           HD2      HIS  33  -5.033  -7.694   3.369
  221    HE1  HIS  33           HE1      HIS  33  -2.173  -9.908   5.588
  222    HE2  HIS  33           HE2      HIS  33  -3.650  -9.886   3.547
  223    H    ASP  34           H        ASP  34  -6.863  -3.605   4.735
  224    HA   ASP  34           HA       ASP  34  -6.057  -1.251   6.184
  225   1HB   ASP  34          2HB       ASP  34  -8.377  -2.125   4.679
  226   2HB   ASP  34          1HB       ASP  34  -8.858  -1.368   6.192
  227    H    GLN  35           H        GLN  35  -7.420  -0.542   8.131
  228    HA   GLN  35           HA       GLN  35  -7.128  -2.342  10.263
  229   1HB   GLN  35          2HB       GLN  35  -8.939   0.072  10.069
  230   2HB   GLN  35          1HB       GLN  35  -8.542  -0.771  11.558
  231   1HG   GLN  35          2HG       GLN  35  -6.143  -0.222  11.127
  232   2HG   GLN  35          1HG       GLN  35  -6.689   0.792   9.789
  233   1HE2  GLN  35          1HE2      GLN  35  -6.545   0.421  13.234
  234   2HE2  GLN  35          2HE2      GLN  35  -7.060   2.023  13.632
  235    H    GLN  36           H        GLN  36  -9.745  -1.795   8.054
  236    HA   GLN  36           HA       GLN  36 -11.795  -3.131   9.461
  237   1HB   GLN  36          2HB       GLN  36 -11.416  -2.815   6.479
  238   2HB   GLN  36          1HB       GLN  36 -12.915  -3.274   7.277
  239   1HG   GLN  36          2HG       GLN  36 -13.057  -1.118   8.339
  240   2HG   GLN  36          1HG       GLN  36 -11.488  -0.658   7.683
  241   1HE2  GLN  36          1HE2      GLN  36 -14.846  -1.204   6.971
  242   2HE2  GLN  36          2HE2      GLN  36 -14.843  -0.440   5.415
  243    H    GLY  37           H        GLY  37  -9.171  -4.230   7.436
  244   1HA   GLY  37          2HA       GLY  37  -8.381  -6.502   7.844
  245   2HA   GLY  37          1HA       GLY  37 -10.064  -7.001   7.907
  246    H    ASN  38           H        ASN  38 -10.077  -4.866   5.480
  247    HA   ASN  38           HA       ASN  38 -10.103  -6.940   3.498
  248   1HB   ASN  38          2HB       ASN  38 -10.720  -5.171   1.907
  249   2HB   ASN  38          1HB       ASN  38 -11.728  -5.130   3.347
  250   1HD2  ASN  38          1HD2      ASN  38 -11.722  -3.365   4.633
  251   2HD2  ASN  38          2HD2      ASN  38 -10.844  -1.913   4.268
  252    H    ALA  39           H        ALA  39  -8.826  -7.053   1.637
  253    HA   ALA  39           HA       ALA  39  -6.104  -6.040   2.058
  254   1HB   ALA  39          1HB       ALA  39  -5.392  -7.833   0.544
  255   2HB   ALA  39          2HB       ALA  39  -7.075  -8.320   0.337
  256   3HB   ALA  39          3HB       ALA  39  -6.305  -8.461   1.917
  257    H    MET  40           H        MET  40  -5.476  -4.380   0.900
  258    HA   MET  40           HA       MET  40  -6.600  -4.035  -1.798
  259   1HB   MET  40          2HB       MET  40  -6.049  -1.963   0.313
  260   2HB   MET  40          1HB       MET  40  -6.161  -1.538  -1.391
  261   1HG   MET  40          2HG       MET  40  -8.404  -2.532  -1.450
  262   2HG   MET  40          1HG       MET  40  -8.295  -2.828   0.284
  263   1HE   MET  40          1HE       MET  40  -7.026  -0.394   1.566
  264   2HE   MET  40          2HE       MET  40  -8.581  -1.026   2.108
  265   3HE   MET  40          3HE       MET  40  -8.387   0.702   1.817
  266    H    GLN  41           H        GLN  41  -5.119  -2.446  -3.107
  267    HA   GLN  41           HA       GLN  41  -2.301  -3.135  -2.595
  268   1HB   GLN  41          2HB       GLN  41  -3.799  -3.632  -5.179
  269   2HB   GLN  41          1HB       GLN  41  -2.050  -3.716  -5.021
  270   1HG   GLN  41          2HG       GLN  41  -2.236  -5.557  -3.479
  271   2HG   GLN  41          1HG       GLN  41  -3.995  -5.434  -3.497
  272   1HE2  GLN  41          1HE2      GLN  41  -5.131  -6.161  -5.269
  273   2HE2  GLN  41          2HE2      GLN  41  -4.413  -7.149  -6.496
  274    H    ILE  42           H        ILE  42  -1.233  -1.242  -2.564
  275    HA   ILE  42           HA       ILE  42  -2.128   0.957  -4.270
  276    HB   ILE  42           HB       ILE  42  -0.476   2.347  -3.177
  277   1HG1  ILE  42          2HG1      ILE  42   0.333   0.049  -1.411
  278   2HG1  ILE  42          1HG1      ILE  42   1.171   0.373  -2.923
  279   1HG2  ILE  42          1HG2      ILE  42  -1.320   2.294  -0.880
  280   2HG2  ILE  42          2HG2      ILE  42  -2.005   0.694  -1.172
  281   3HG2  ILE  42          3HG2      ILE  42  -2.615   2.092  -2.059
  282   1HD1  ILE  42          1HD1      ILE  42   0.867   2.312  -0.650
  283   2HD1  ILE  42          2HD1      ILE  42   1.749   2.592  -2.151
  284   3HD1  ILE  42          3HD1      ILE  42   2.311   1.367  -1.011
  285    H    ASN  43           H        ASN  43  -0.014   2.224  -5.172
  286    HA   ASN  43           HA       ASN  43   1.205   0.250  -6.948
  287   1HB   ASN  43          2HB       ASN  43   0.227   2.836  -7.342
  288   2HB   ASN  43          1HB       ASN  43   1.977   2.984  -7.490
  289   1HD2  ASN  43          1HD2      ASN  43   3.047   1.863  -9.142
  290   2HD2  ASN  43          2HD2      ASN  43   2.205   1.182 -10.489
  291    H    ARG  44           H        ARG  44   3.404   0.041  -7.270
  292    HA   ARG  44           HA       ARG  44   5.110   0.211  -5.093
  293   1HB   ARG  44          2HB       ARG  44   5.522  -1.253  -6.998
  294   2HB   ARG  44          1HB       ARG  44   5.774   0.137  -8.041
  295   1HG   ARG  44          2HG       ARG  44   7.875  -0.934  -7.410
  296   2HG   ARG  44          1HG       ARG  44   7.780   0.727  -6.824
  297   1HD   ARG  44          2HD       ARG  44   7.257  -0.028  -4.605
  298   2HD   ARG  44          1HD       ARG  44   7.131  -1.698  -5.156
  299    HE   ARG  44           HE       ARG  44   9.550  -1.596  -5.621
  300   1HH1  ARG  44          1HH1      ARG  44   8.174   0.801  -3.477
  301   2HH1  ARG  44          2HH1      ARG  44   9.644   1.039  -2.578
  302   1HH2  ARG  44          1HH2      ARG  44  11.492  -1.301  -4.445
  303   2HH2  ARG  44          2HH2      ARG  44  11.527  -0.171  -3.124
  304    H    ASP  45           H        ASP  45   4.610   2.481  -7.727
  305    HA   ASP  45           HA       ASP  45   6.751   4.241  -7.025
  306   1HB   ASP  45          2HB       ASP  45   4.328   4.866  -8.723
  307   2HB   ASP  45          1HB       ASP  45   5.877   5.695  -8.741
  308    H    ASP  46           H        ASP  46   4.003   3.629  -5.375
  309    HA   ASP  46           HA       ASP  46   3.519   6.458  -4.711
  310   1HB   ASP  46          2HB       ASP  46   1.640   5.092  -5.752
  311   2HB   ASP  46          1HB       ASP  46   1.598   4.176  -4.249
  312    H    VAL  47           H        VAL  47   5.086   3.829  -3.589
  313    HA   VAL  47           HA       VAL  47   4.306   3.967  -0.805
  314    HB   VAL  47           HB       VAL  47   6.796   2.649  -1.869
  315   1HG1  VAL  47          1HG1      VAL  47   6.598   2.840   0.558
  316   2HG1  VAL  47          2HG1      VAL  47   6.487   1.157   0.044
  317   3HG1  VAL  47          3HG1      VAL  47   5.029   2.038   0.498
  318   1HG2  VAL  47          1HG2      VAL  47   4.010   1.501  -1.809
  319   2HG2  VAL  47          2HG2      VAL  47   5.482   0.581  -2.119
  320   3HG2  VAL  47          3HG2      VAL  47   4.977   1.843  -3.244
  321    H    SER  48           H        SER  48   4.906   5.701   0.377
  322    HA   SER  48           HA       SER  48   7.419   7.029  -0.363
  323   1HB   SER  48          2HB       SER  48   5.424   8.402  -0.698
  324   2HB   SER  48          1HB       SER  48   4.976   8.191   0.992
  325    HG   SER  48           HG       SER  48   7.470   9.303   0.222
  326    H    GLN  49           H        GLN  49   5.456   7.097   2.636
  327    HA   GLN  49           HA       GLN  49   8.020   6.949   4.088
  328   1HB   GLN  49          2HB       GLN  49   5.429   8.163   5.058
  329   2HB   GLN  49          1HB       GLN  49   7.007   8.280   5.826
  330   1HG   GLN  49          2HG       GLN  49   6.267   9.448   3.153
  331   2HG   GLN  49          1HG       GLN  49   6.370  10.338   4.670
  332   1HE2  GLN  49          1HE2      GLN  49   7.825  10.604   2.125
  333   2HE2  GLN  49          2HE2      GLN  49   9.503  10.536   2.546
  334    H    ILE  50           H        ILE  50   8.326   4.972   4.904
  335    HA   ILE  50           HA       ILE  50   6.025   3.655   6.189
  336    HB   ILE  50           HB       ILE  50   8.605   2.369   5.268
  337   1HG1  ILE  50          2HG1      ILE  50   5.828   2.196   4.072
  338   2HG1  ILE  50          1HG1      ILE  50   7.169   3.107   3.386
  339   1HG2  ILE  50          1HG2      ILE  50   6.066   1.164   6.371
  340   2HG2  ILE  50          2HG2      ILE  50   7.629   1.239   7.185
  341   3HG2  ILE  50          3HG2      ILE  50   7.437   0.255   5.735
  342   1HD1  ILE  50          1HD1      ILE  50   8.420   1.040   3.079
  343   2HD1  ILE  50          2HD1      ILE  50   6.862   0.975   2.254
  344   3HD1  ILE  50          3HD1      ILE  50   7.087   0.125   3.783
  345    H    ILE  51           H        ILE  51   9.576   3.620   6.542
  346    HA   ILE  51           HA       ILE  51   9.184   3.947   9.439
  347    HB   ILE  51           HB       ILE  51   9.558   1.559   8.873
  348   1HG1  ILE  51          2HG1      ILE  51  11.863   2.800  10.392
  349   2HG1  ILE  51          1HG1      ILE  51  10.261   2.516  11.062
  350   1HG2  ILE  51          1HG2      ILE  51  11.815   0.853   8.143
  351   2HG2  ILE  51          2HG2      ILE  51  12.224   2.547   7.869
  352   3HG2  ILE  51          3HG2      ILE  51  10.950   1.783   6.919
  353   1HD1  ILE  51          1HD1      ILE  51  12.174   0.408  10.079
  354   2HD1  ILE  51          2HD1      ILE  51  10.563   0.110  10.730
  355   3HD1  ILE  51          3HD1      ILE  51  11.818   0.797  11.762
  356    H    GLU  52           H        GLU  52  10.791   4.982   6.641
  357    HA   GLU  52           HA       GLU  52  13.262   5.740   7.852
  358   1HB   GLU  52          2HB       GLU  52  12.204   5.751   5.223
  359   2HB   GLU  52          1HB       GLU  52  12.715   7.395   5.592
  360   1HG   GLU  52          2HG       GLU  52  14.371   4.888   5.607
  361   2HG   GLU  52          1HG       GLU  52  14.576   6.336   4.619
  362    H    ARG  53           H        ARG  53  13.972   8.102   7.773
  363    HA   ARG  53           HA       ARG  53  11.908   9.814   8.965
  364   1HB   ARG  53          2HB       ARG  53  14.472   9.067  10.390
  365   2HB   ARG  53          1HB       ARG  53  13.208  10.129  10.997
  366   1HG   ARG  53          2HG       ARG  53  11.781   8.389  11.462
  367   2HG   ARG  53          1HG       ARG  53  12.529   7.319  10.273
  368   1HD   ARG  53          2HD       ARG  53  14.579   7.333  11.760
  369   2HD   ARG  53          1HD       ARG  53  13.568   8.105  12.983
  370    HE   ARG  53           HE       ARG  53  12.159   6.109  12.938
  371   1HH1  ARG  53          1HH1      ARG  53  15.332   5.849  11.451
  372   2HH1  ARG  53          2HH1      ARG  53  15.443   4.135  11.705
  373   1HH2  ARG  53          1HH2      ARG  53  12.292   3.857  13.223
  374   2HH2  ARG  53          2HH2      ARG  53  13.696   2.989  12.673
  Start of MODEL   12
    1    H    ASP   4           H        ASP   4   3.216   2.315  16.713
    2    HA   ASP   4           HA       ASP   4   1.101   0.678  15.476
    3   1HB   ASP   4          2HB       ASP   4   1.924   3.521  14.835
    4   2HB   ASP   4          1HB       ASP   4   0.792   2.576  13.878
    5    H    TYR   5           H        TYR   5   1.367   0.575  13.058
    6    HA   TYR   5           HA       TYR   5   4.198   0.527  12.269
    7   1HB   TYR   5          2HB       TYR   5   2.163  -1.460  11.978
    8   2HB   TYR   5          1HB       TYR   5   2.586  -0.874  10.375
    9    HD1  TYR   5           HD2      TYR   5   4.893  -1.145   9.526
   10    HD2  TYR   5           HD1      TYR   5   3.697  -2.770  13.270
   11    HE1  TYR   5           HE2      TYR   5   6.882  -2.592   9.524
   12    HE2  TYR   5           HE1      TYR   5   5.679  -4.223  13.280
   13    HH   TYR   5           HH       TYR   5   8.279  -3.821  11.063
   14    H    VAL   6           H        VAL   6   1.096   0.606  10.533
   15    HA   VAL   6           HA       VAL   6   0.049   2.157   9.277
   16    HB   VAL   6           HB       VAL   6   1.254   3.710  11.178
   17   1HG1  VAL   6          1HG1      VAL   6   2.057   4.878   8.515
   18   2HG1  VAL   6          2HG1      VAL   6   3.154   4.263   9.750
   19   3HG1  VAL   6          3HG1      VAL   6   2.169   5.689  10.078
   20   1HG2  VAL   6          1HG2      VAL   6  -1.033   3.909  10.403
   21   2HG2  VAL   6          2HG2      VAL   6  -0.478   4.628   8.891
   22   3HG2  VAL   6          3HG2      VAL   6  -0.245   5.487  10.413
   23    H    MET   7           H        MET   7   0.239   3.325   7.246
   24    HA   MET   7           HA       MET   7   2.801   2.823   5.900
   25   1HB   MET   7          2HB       MET   7   1.100   1.161   5.209
   26   2HB   MET   7          1HB       MET   7   0.060   2.475   4.676
   27   1HG   MET   7          2HG       MET   7   1.760   3.147   3.047
   28   2HG   MET   7          1HG       MET   7   2.773   1.799   3.559
   29   1HE   MET   7          1HE       MET   7  -0.486   2.928   1.770
   30   2HE   MET   7          2HE       MET   7  -1.153   1.931   3.063
   31   3HE   MET   7          3HE       MET   7  -1.272   1.397   1.386
   32    H    ALA   8           H        ALA   8   3.593   4.832   5.826
   33    HA   ALA   8           HA       ALA   8   2.020   7.128   5.158
   34   1HB   ALA   8          1HB       ALA   8   5.017   6.746   5.138
   35   2HB   ALA   8          2HB       ALA   8   4.056   7.357   6.485
   36   3HB   ALA   8          3HB       ALA   8   4.180   8.292   4.994
   37    H    THR   9           H        THR   9   1.699   8.046   3.177
   38    HA   THR   9           HA       THR   9   2.756   6.533   0.866
   39    HB   THR   9           HB       THR   9   0.073   7.675   0.566
   40    HG1  THR   9           HG1      THR   9   0.665   6.146   2.740
   41   1HG2  THR   9          1HG2      THR   9   1.153   6.196  -1.094
   42   2HG2  THR   9          2HG2      THR   9  -0.380   5.551  -0.504
   43   3HG2  THR   9          3HG2      THR   9   1.143   4.899   0.101
   44    H    LYS  10           H        LYS  10   2.755   7.687  -1.136
   45    HA   LYS  10           HA       LYS  10   3.997  10.189  -0.957
   46   1HB   LYS  10          2HB       LYS  10   4.474   8.671  -2.760
   47   2HB   LYS  10          1HB       LYS  10   2.799   8.692  -3.290
   48   1HG   LYS  10          2HG       LYS  10   3.007  10.951  -4.051
   49   2HG   LYS  10          1HG       LYS  10   4.621  11.089  -3.348
   50   1HD   LYS  10          2HD       LYS  10   4.735  10.722  -5.761
   51   2HD   LYS  10          1HD       LYS  10   5.436   9.367  -4.875
   52   1HE   LYS  10          2HE       LYS  10   4.087   8.501  -6.669
   53   2HE   LYS  10          1HE       LYS  10   3.290   8.145  -5.139
   54   1HZ   LYS  10          1HZ       LYS  10   1.908  10.167  -5.533
   55   2HZ   LYS  10          2HZ       LYS  10   1.645   8.917  -6.646
   56   3HZ   LYS  10          3HZ       LYS  10   2.575  10.266  -7.087
   57    H    ASP  11           H        ASP  11   0.681   9.341  -1.906
   58    HA   ASP  11           HA       ASP  11   0.083  12.001  -2.797
   59   1HB   ASP  11          2HB       ASP  11  -0.919   9.753  -3.597
   60   2HB   ASP  11          1HB       ASP  11  -1.986   9.905  -2.206
   61    H    GLY  12           H        GLY  12   0.903  11.664   0.032
   62   1HA   GLY  12          2HA       GLY  12   0.506  12.937   1.895
   63   2HA   GLY  12          1HA       GLY  12  -0.825  13.685   1.029
   64    H    ARG  13           H        ARG  13   0.016  10.598   2.593
   65    HA   ARG  13           HA       ARG  13  -2.235  10.816   4.338
   66   1HB   ARG  13          2HB       ARG  13  -3.395   8.762   3.613
   67   2HB   ARG  13          1HB       ARG  13  -3.437  10.009   2.374
   68   1HG   ARG  13          2HG       ARG  13  -1.146   8.257   2.084
   69   2HG   ARG  13          1HG       ARG  13  -2.674   7.377   2.037
   70   1HD   ARG  13          2HD       ARG  13  -2.387   9.875   0.443
   71   2HD   ARG  13          1HD       ARG  13  -1.631   8.394  -0.143
   72    HE   ARG  13           HE       ARG  13  -3.949   7.403   0.105
   73   1HH1  ARG  13          1HH1      ARG  13  -3.455  10.818  -0.560
   74   2HH1  ARG  13          2HH1      ARG  13  -4.926  10.968  -1.462
   75   1HH2  ARG  13          1HH2      ARG  13  -5.866   7.608  -1.051
   76   2HH2  ARG  13          2HH2      ARG  13  -6.322   9.148  -1.719
   77    H    MET  14           H        MET  14  -1.972   9.592   6.131
   78    HA   MET  14           HA       MET  14   0.127   7.533   6.079
   79   1HB   MET  14          2HB       MET  14  -0.935   9.193   8.376
   80   2HB   MET  14          1HB       MET  14   0.088   7.783   8.604
   81   1HG   MET  14          2HG       MET  14   1.482   9.686   8.734
   82   2HG   MET  14          1HG       MET  14   1.812   8.906   7.190
   83   1HE   MET  14          1HE       MET  14   3.038  11.044   6.251
   84   2HE   MET  14          2HE       MET  14   2.798  11.824   7.814
   85   3HE   MET  14          3HE       MET  14   2.361  12.672   6.330
   86    H    ILE  15           H        ILE  15  -1.139   5.876   5.321
   87    HA   ILE  15           HA       ILE  15  -3.832   5.516   6.220
   88    HB   ILE  15           HB       ILE  15  -2.112   3.619   4.614
   89   1HG1  ILE  15          2HG1      ILE  15  -4.037   5.767   3.694
   90   2HG1  ILE  15          1HG1      ILE  15  -2.284   5.847   3.568
   91   1HG2  ILE  15          1HG2      ILE  15  -5.107   3.834   4.882
   92   2HG2  ILE  15          2HG2      ILE  15  -4.096   2.577   5.595
   93   3HG2  ILE  15          3HG2      ILE  15  -4.237   2.706   3.841
   94   1HD1  ILE  15          1HD1      ILE  15  -4.079   3.881   2.165
   95   2HD1  ILE  15          2HD1      ILE  15  -2.319   3.917   2.058
   96   3HD1  ILE  15          3HD1      ILE  15  -3.267   5.270   1.440
   97    H    LEU  16           H        LEU  16  -4.467   4.525   8.005
   98    HA   LEU  16           HA       LEU  16  -2.737   3.018   9.673
   99   1HB   LEU  16          2HB       LEU  16  -5.717   3.436   9.618
  100   2HB   LEU  16          1HB       LEU  16  -4.986   2.310  10.742
  101    HG   LEU  16           HG       LEU  16  -5.397   4.393  11.869
  102   1HD1  LEU  16          1HD1      LEU  16  -3.146   4.941  12.654
  103   2HD1  LEU  16          2HD1      LEU  16  -2.461   4.057  11.292
  104   3HD1  LEU  16          3HD1      LEU  16  -3.390   3.199  12.519
  105   1HD2  LEU  16          1HD2      LEU  16  -4.354   6.490  11.187
  106   2HD2  LEU  16          2HD2      LEU  16  -5.448   5.884   9.943
  107   3HD2  LEU  16          3HD2      LEU  16  -3.705   5.704   9.749
  108    H    THR  17           H        THR  17  -1.995   1.074   9.177
  109    HA   THR  17           HA       THR  17  -3.675  -0.724   7.574
  110    HB   THR  17           HB       THR  17  -1.582  -1.375   6.336
  111    HG1  THR  17           HG1      THR  17  -0.550   1.060   7.407
  112   1HG2  THR  17          1HG2      THR  17  -2.427   1.509   6.049
  113   2HG2  THR  17          2HG2      THR  17  -3.228   0.120   5.314
  114   3HG2  THR  17          3HG2      THR  17  -1.588   0.551   4.829
  115    H    ASP  18           H        ASP  18  -3.231  -2.949   7.832
  116    HA   ASP  18           HA       ASP  18  -1.877  -3.863  10.163
  117   1HB   ASP  18          2HB       ASP  18  -3.609  -5.222   9.112
  118   2HB   ASP  18          1HB       ASP  18  -2.687  -5.293   7.615
  119    H    GLY  19           H        GLY  19   0.274  -3.737  10.421
  120   1HA   GLY  19          2HA       GLY  19   1.772  -2.519   8.319
  121   2HA   GLY  19          1HA       GLY  19   2.379  -2.931   9.914
  122    H    LYS  20           H        LYS  20   2.353  -3.764   6.592
  123    HA   LYS  20           HA       LYS  20   4.015  -5.815   6.348
  124   1HB   LYS  20          2HB       LYS  20   1.908  -6.725   8.072
  125   2HB   LYS  20          1HB       LYS  20   1.893  -7.656   6.577
  126   1HG   LYS  20          2HG       LYS  20   4.156  -8.321   6.864
  127   2HG   LYS  20          1HG       LYS  20   4.385  -7.187   8.194
  128   1HD   LYS  20          2HD       LYS  20   2.632  -8.486   9.451
  129   2HD   LYS  20          1HD       LYS  20   2.729  -9.697   8.169
  130   1HE   LYS  20          2HE       LYS  20   4.154 -10.260  10.103
  131   2HE   LYS  20          1HE       LYS  20   5.078 -10.039   8.617
  132   1HZ   LYS  20          1HZ       LYS  20   5.742  -7.867   9.328
  133   2HZ   LYS  20          2HZ       LYS  20   6.087  -8.954  10.581
  134   3HZ   LYS  20          3HZ       LYS  20   4.732  -7.938  10.690
  135    HA   PRO  21           HA       PRO  21   1.315  -5.186   2.669
  136   1HB   PRO  21          2HB       PRO  21   3.154  -3.481   1.386
  137   2HB   PRO  21          1HB       PRO  21   1.642  -3.005   2.161
  138   1HG   PRO  21          2HG       PRO  21   4.235  -2.328   3.004
  139   2HG   PRO  21          1HG       PRO  21   2.739  -2.115   3.924
  140   1HD   PRO  21          2HD       PRO  21   4.801  -4.255   4.130
  141   2HD   PRO  21          1HD       PRO  21   3.758  -3.562   5.392
  142    H    GLU  22           H        GLU  22   1.658  -6.087   0.604
  143    HA   GLU  22           HA       GLU  22   4.268  -7.411   0.247
  144   1HB   GLU  22          2HB       GLU  22   1.687  -8.555   0.409
  145   2HB   GLU  22          1HB       GLU  22   2.194  -8.693  -1.270
  146   1HG   GLU  22          2HG       GLU  22   3.735  -9.666   1.126
  147   2HG   GLU  22          1HG       GLU  22   2.798 -10.666   0.019
  148    H    ILE  23           H        ILE  23   5.352  -6.364  -1.248
  149    HA   ILE  23           HA       ILE  23   3.983  -5.082  -3.465
  150    HB   ILE  23           HB       ILE  23   6.957  -5.248  -2.947
  151   1HG1  ILE  23          2HG1      ILE  23   4.991  -3.073  -2.182
  152   2HG1  ILE  23          1HG1      ILE  23   5.772  -4.184  -1.066
  153   1HG2  ILE  23          1HG2      ILE  23   6.421  -4.700  -5.244
  154   2HG2  ILE  23          2HG2      ILE  23   7.028  -3.260  -4.422
  155   3HG2  ILE  23          3HG2      ILE  23   5.298  -3.446  -4.712
  156   1HD1  ILE  23          1HD1      ILE  23   7.946  -3.246  -1.646
  157   2HD1  ILE  23          2HD1      ILE  23   6.842  -2.008  -1.042
  158   3HD1  ILE  23          3HD1      ILE  23   7.163  -2.135  -2.771
  159    H    ASP  24           H        ASP  24   3.259  -6.567  -4.885
  160    HA   ASP  24           HA       ASP  24   4.700  -8.926  -5.565
  161   1HB   ASP  24          2HB       ASP  24   2.307  -7.574  -6.812
  162   2HB   ASP  24          1HB       ASP  24   2.998  -9.061  -7.456
  163    H    ASP  25           H        ASP  25   6.217  -9.251  -7.058
  164    HA   ASP  25           HA       ASP  25   7.542  -6.904  -7.998
  165   1HB   ASP  25          2HB       ASP  25   8.190  -9.823  -8.435
  166   2HB   ASP  25          1HB       ASP  25   9.244  -8.479  -8.850
  167    H    ASP  26           H        ASP  26   5.470  -9.303  -9.431
  168    HA   ASP  26           HA       ASP  26   6.345  -8.871 -12.104
  169   1HB   ASP  26          2HB       ASP  26   5.279 -10.971 -11.484
  170   2HB   ASP  26          1HB       ASP  26   3.793 -10.116 -11.074
  171    H    THR  27           H        THR  27   3.355  -7.887 -10.401
  172    HA   THR  27           HA       THR  27   2.641  -6.158 -12.608
  173    HB   THR  27           HB       THR  27   0.850  -7.358 -11.519
  174    HG1  THR  27           HG1      THR  27   0.941  -4.641 -11.689
  175   1HG2  THR  27          1HG2      THR  27   1.813  -7.587  -9.285
  176   2HG2  THR  27          2HG2      THR  27   0.195  -6.893  -9.195
  177   3HG2  THR  27          3HG2      THR  27   1.611  -5.858  -9.007
  178    H    GLY  28           H        GLY  28   4.217  -5.858  -9.539
  179   1HA   GLY  28          2HA       GLY  28   5.392  -4.052  -8.706
  180   2HA   GLY  28          1HA       GLY  28   4.887  -3.128 -10.116
  181    H    LEU  29           H        LEU  29   2.869  -4.789  -7.742
  182    HA   LEU  29           HA       LEU  29   1.714  -2.175  -7.065
  183   1HB   LEU  29          2HB       LEU  29   0.351  -4.869  -7.045
  184   2HB   LEU  29          1HB       LEU  29  -0.394  -3.349  -6.593
  185    HG   LEU  29           HG       LEU  29   0.561  -4.124  -9.352
  186   1HD1  LEU  29          1HD1      LEU  29  -2.199  -3.672  -8.235
  187   2HD1  LEU  29          2HD1      LEU  29  -1.502  -5.221  -8.707
  188   3HD1  LEU  29          3HD1      LEU  29  -1.813  -3.986  -9.927
  189   1HD2  LEU  29          1HD2      LEU  29  -0.758  -1.574  -8.431
  190   2HD2  LEU  29          2HD2      LEU  29  -0.371  -2.005 -10.096
  191   3HD2  LEU  29          3HD2      LEU  29   0.925  -1.741  -8.931
  192    H    VAL  30           H        VAL  30   1.049  -1.832  -4.900
  193    HA   VAL  30           HA       VAL  30   2.485  -3.541  -2.975
  194    HB   VAL  30           HB       VAL  30   1.482  -0.716  -2.577
  195   1HG1  VAL  30          1HG1      VAL  30   3.265  -2.436  -0.854
  196   2HG1  VAL  30          2HG1      VAL  30   1.601  -1.973  -0.497
  197   3HG1  VAL  30          3HG1      VAL  30   2.864  -0.743  -0.552
  198   1HG2  VAL  30          1HG2      VAL  30   4.270  -1.719  -3.133
  199   2HG2  VAL  30          2HG2      VAL  30   3.856  -0.067  -2.676
  200   3HG2  VAL  30          3HG2      VAL  30   3.273  -0.730  -4.202
  201    H    SER  31           H        SER  31   1.084  -5.070  -2.359
  202    HA   SER  31           HA       SER  31  -1.705  -4.438  -1.887
  203   1HB   SER  31          2HB       SER  31  -0.245  -7.058  -1.487
  204   2HB   SER  31          1HB       SER  31  -1.990  -6.822  -1.578
  205    HG   SER  31           HG       SER  31  -0.264  -7.212  -3.576
  206    H    TYR  32           H        TYR  32  -2.138  -3.406  -0.027
  207    HA   TYR  32           HA       TYR  32  -0.724  -4.290   2.406
  208   1HB   TYR  32          2HB       TYR  32  -1.061  -2.142   3.360
  209   2HB   TYR  32          1HB       TYR  32  -0.483  -1.867   1.724
  210    HD1  TYR  32           HD1      TYR  32  -2.004  -0.955   0.012
  211    HD2  TYR  32           HD2      TYR  32  -3.272  -1.489   4.036
  212    HE1  TYR  32           HE1      TYR  32  -3.896   0.565  -0.383
  213    HE2  TYR  32           HE2      TYR  32  -5.163   0.028   3.656
  214    HH   TYR  32           HH       TYR  32  -6.221   0.941   0.654
  215    H    HIS  33           H        HIS  33  -2.059  -4.014   4.445
  216    HA   HIS  33           HA       HIS  33  -4.725  -5.137   3.921
  217   1HB   HIS  33          2HB       HIS  33  -3.055  -5.328   6.436
  218   2HB   HIS  33          1HB       HIS  33  -4.619  -6.089   6.177
  219    HD1  HIS  33           HD1      HIS  33  -1.564  -7.306   6.663
  220    HD2  HIS  33           HD2      HIS  33  -4.020  -7.532   3.299
  221    HE1  HIS  33           HE1      HIS  33  -0.755  -9.302   5.359
  222    HE2  HIS  33           HE2      HIS  33  -2.277  -9.450   3.349
  223    H    ASP  34           H        ASP  34  -6.493  -4.154   4.643
  224    HA   ASP  34           HA       ASP  34  -6.464  -1.451   5.460
  225   1HB   ASP  34          2HB       ASP  34  -8.444  -3.456   4.829
  226   2HB   ASP  34          1HB       ASP  34  -8.930  -2.558   6.260
  227    H    GLN  35           H        GLN  35  -7.169  -0.526   7.434
  228    HA   GLN  35           HA       GLN  35  -6.411  -1.727   9.862
  229   1HB   GLN  35          2HB       GLN  35  -6.778   0.737   9.430
  230   2HB   GLN  35          1HB       GLN  35  -8.507   0.425   9.490
  231   1HG   GLN  35          2HG       GLN  35  -7.893   1.264  11.607
  232   2HG   GLN  35          1HG       GLN  35  -8.164  -0.466  11.812
  233   1HE2  GLN  35          1HE2      GLN  35  -6.584   1.416  13.401
  234   2HE2  GLN  35          2HE2      GLN  35  -4.982   0.767  13.453
  235    H    GLN  36           H        GLN  36  -9.296  -1.824   7.951
  236    HA   GLN  36           HA       GLN  36 -11.005  -2.979   9.936
  237   1HB   GLN  36          2HB       GLN  36 -11.312  -3.001   6.928
  238   2HB   GLN  36          1HB       GLN  36 -12.575  -3.312   8.109
  239   1HG   GLN  36          2HG       GLN  36 -12.422  -1.017   8.898
  240   2HG   GLN  36          1HG       GLN  36 -11.134  -0.699   7.738
  241   1HE2  GLN  36          1HE2      GLN  36 -13.728   0.578   8.006
  242   2HE2  GLN  36          2HE2      GLN  36 -14.549   0.346   6.496
  243    H    GLY  37           H        GLY  37  -8.627  -4.172   7.747
  244   1HA   GLY  37          2HA       GLY  37  -7.764  -6.400   8.072
  245   2HA   GLY  37          1HA       GLY  37  -9.397  -6.927   8.452
  246    H    ASN  38           H        ASN  38  -9.019  -4.791   5.766
  247    HA   ASN  38           HA       ASN  38  -9.582  -7.008   3.936
  248   1HB   ASN  38          2HB       ASN  38  -9.564  -4.069   3.235
  249   2HB   ASN  38          1HB       ASN  38 -10.290  -5.387   2.327
  250   1HD2  ASN  38          1HD2      ASN  38 -10.750  -2.991   4.632
  251   2HD2  ASN  38          2HD2      ASN  38 -12.357  -3.413   5.116
  252    H    ALA  39           H        ALA  39  -8.568  -6.213   1.572
  253    HA   ALA  39           HA       ALA  39  -5.763  -5.474   1.993
  254   1HB   ALA  39          1HB       ALA  39  -4.983  -7.273   0.544
  255   2HB   ALA  39          2HB       ALA  39  -6.633  -7.878   0.389
  256   3HB   ALA  39          3HB       ALA  39  -5.819  -7.926   1.955
  257    H    MET  40           H        MET  40  -5.112  -3.997   0.545
  258    HA   MET  40           HA       MET  40  -6.622  -3.762  -1.984
  259   1HB   MET  40          2HB       MET  40  -5.338  -1.492  -0.457
  260   2HB   MET  40          1HB       MET  40  -6.202  -1.356  -1.976
  261   1HG   MET  40          2HG       MET  40  -8.246  -2.168  -0.762
  262   2HG   MET  40          1HG       MET  40  -7.325  -1.979   0.734
  263   1HE   MET  40          1HE       MET  40  -9.350   1.212   1.237
  264   2HE   MET  40          2HE       MET  40  -8.476  -0.101   2.026
  265   3HE   MET  40          3HE       MET  40  -9.816  -0.464   0.939
  266    H    GLN  41           H        GLN  41  -5.393  -2.885  -3.781
  267    HA   GLN  41           HA       GLN  41  -2.486  -3.327  -3.515
  268   1HB   GLN  41          2HB       GLN  41  -4.284  -3.720  -5.920
  269   2HB   GLN  41          1HB       GLN  41  -2.531  -3.832  -5.968
  270   1HG   GLN  41          2HG       GLN  41  -2.561  -5.731  -4.496
  271   2HG   GLN  41          1HG       GLN  41  -4.306  -5.580  -4.282
  272   1HE2  GLN  41          1HE2      GLN  41  -5.678  -6.217  -5.938
  273   2HE2  GLN  41          2HE2      GLN  41  -5.130  -7.182  -7.268
  274    H    ILE  42           H        ILE  42  -1.551  -1.352  -3.360
  275    HA   ILE  42           HA       ILE  42  -2.635   0.824  -5.010
  276    HB   ILE  42           HB       ILE  42  -1.431   2.385  -3.656
  277   1HG1  ILE  42          2HG1      ILE  42  -0.339   0.244  -1.867
  278   2HG1  ILE  42          1HG1      ILE  42   0.519   0.641  -3.354
  279   1HG2  ILE  42          1HG2      ILE  42  -3.556   1.651  -2.745
  280   2HG2  ILE  42          2HG2      ILE  42  -2.418   1.982  -1.438
  281   3HG2  ILE  42          3HG2      ILE  42  -2.760   0.318  -1.908
  282   1HD1  ILE  42          1HD1      ILE  42   1.381   1.852  -1.404
  283   2HD1  ILE  42          2HD1      ILE  42  -0.197   2.612  -1.196
  284   3HD1  ILE  42          3HD1      ILE  42   0.753   2.933  -2.649
  285    H    ASN  43           H        ASN  43  -0.681   2.440  -5.558
  286    HA   ASN  43           HA       ASN  43   0.902   0.972  -7.460
  287   1HB   ASN  43          2HB       ASN  43   0.686   3.903  -6.799
  288   2HB   ASN  43          1HB       ASN  43   1.821   3.284  -7.988
  289   1HD2  ASN  43          1HD2      ASN  43   0.951   4.173  -9.778
  290   2HD2  ASN  43          2HD2      ASN  43  -0.640   3.817 -10.368
  291    H    ARG  44           H        ARG  44   3.058   0.629  -7.477
  292    HA   ARG  44           HA       ARG  44   4.495   0.382  -5.091
  293   1HB   ARG  44          2HB       ARG  44   5.081  -0.881  -7.076
  294   2HB   ARG  44          1HB       ARG  44   5.458   0.592  -7.954
  295   1HG   ARG  44          2HG       ARG  44   7.187   0.917  -5.993
  296   2HG   ARG  44          1HG       ARG  44   7.032  -0.837  -5.884
  297   1HD   ARG  44          2HD       ARG  44   8.871  -0.256  -7.357
  298   2HD   ARG  44          1HD       ARG  44   7.571  -1.015  -8.276
  299    HE   ARG  44           HE       ARG  44   7.506   1.878  -8.212
  300   1HH1  ARG  44          1HH1      ARG  44   8.599  -0.961  -9.937
  301   2HH1  ARG  44          2HH1      ARG  44   8.774  -0.130 -11.452
  302   1HH2  ARG  44          1HH2      ARG  44   7.726   2.980 -10.191
  303   2HH2  ARG  44          2HH2      ARG  44   8.294   2.109 -11.591
  304    H    ASP  45           H        ASP  45   4.465   2.948  -7.507
  305    HA   ASP  45           HA       ASP  45   6.622   4.426  -6.348
  306   1HB   ASP  45          2HB       ASP  45   4.518   5.504  -8.230
  307   2HB   ASP  45          1HB       ASP  45   6.173   6.066  -8.020
  308    H    ASP  46           H        ASP  46   3.312   4.107  -5.651
  309    HA   ASP  46           HA       ASP  46   2.974   6.800  -4.664
  310   1HB   ASP  46          2HB       ASP  46   1.140   5.592  -5.834
  311   2HB   ASP  46          1HB       ASP  46   1.057   4.474  -4.477
  312    H    VAL  47           H        VAL  47   3.496   3.587  -3.332
  313    HA   VAL  47           HA       VAL  47   2.988   4.288  -0.635
  314    HB   VAL  47           HB       VAL  47   3.177   1.933  -1.460
  315   1HG1  VAL  47          1HG1      VAL  47   5.397   0.925  -1.642
  316   2HG1  VAL  47          2HG1      VAL  47   6.122   2.525  -1.475
  317   3HG1  VAL  47          3HG1      VAL  47   5.114   2.154  -2.873
  318   1HG2  VAL  47          1HG2      VAL  47   4.300   1.054   0.526
  319   2HG2  VAL  47          2HG2      VAL  47   3.241   2.408   0.921
  320   3HG2  VAL  47          3HG2      VAL  47   4.986   2.649   0.840
  321    H    SER  48           H        SER  48   4.426   4.974   1.004
  322    HA   SER  48           HA       SER  48   6.868   6.221  -0.064
  323   1HB   SER  48          2HB       SER  48   5.121   7.883   0.359
  324   2HB   SER  48          1HB       SER  48   4.970   7.326   2.024
  325    HG   SER  48           HG       SER  48   6.586   9.184   1.101
  326    H    GLN  49           H        GLN  49   5.479   5.558   3.191
  327    HA   GLN  49           HA       GLN  49   8.095   4.414   3.918
  328   1HB   GLN  49          2HB       GLN  49   6.481   6.369   5.563
  329   2HB   GLN  49          1HB       GLN  49   7.867   5.474   6.163
  330   1HG   GLN  49          2HG       GLN  49   9.275   6.582   4.470
  331   2HG   GLN  49          1HG       GLN  49   7.872   7.533   3.973
  332   1HE2  GLN  49          1HE2      GLN  49  10.255   7.010   6.437
  333   2HE2  GLN  49          2HE2      GLN  49   9.908   8.430   7.370
  334    H    ILE  50           H        ILE  50   8.084   2.790   5.424
  335    HA   ILE  50           HA       ILE  50   5.451   1.730   6.217
  336    HB   ILE  50           HB       ILE  50   8.139   0.331   6.310
  337   1HG1  ILE  50          2HG1      ILE  50   7.541   0.810   3.990
  338   2HG1  ILE  50          1HG1      ILE  50   7.375  -0.911   4.317
  339   1HG2  ILE  50          1HG2      ILE  50   6.533  -0.577   7.886
  340   2HG2  ILE  50          2HG2      ILE  50   6.802  -1.714   6.567
  341   3HG2  ILE  50          3HG2      ILE  50   5.334  -0.737   6.605
  342   1HD1  ILE  50          1HD1      ILE  50   4.963  -0.647   4.516
  343   2HD1  ILE  50          2HD1      ILE  50   5.545  -0.078   2.950
  344   3HD1  ILE  50          3HD1      ILE  50   5.121   1.082   4.210
  345    H    ILE  51           H        ILE  51   8.217   3.347   7.239
  346    HA   ILE  51           HA       ILE  51   9.027   4.112   9.199
  347    HB   ILE  51           HB       ILE  51   6.278   3.589  10.345
  348   1HG1  ILE  51          2HG1      ILE  51   7.281   5.945   8.724
  349   2HG1  ILE  51          1HG1      ILE  51   6.038   4.798   8.234
  350   1HG2  ILE  51          1HG2      ILE  51   6.820   5.566  11.738
  351   2HG2  ILE  51          2HG2      ILE  51   8.435   5.595  11.028
  352   3HG2  ILE  51          3HG2      ILE  51   7.926   4.219  12.006
  353   1HD1  ILE  51          1HD1      ILE  51   5.834   6.709  10.553
  354   2HD1  ILE  51          2HD1      ILE  51   4.586   5.591  10.005
  355   3HD1  ILE  51          3HD1      ILE  51   5.091   6.923   8.967
  356    H    GLU  52           H        GLU  52   9.742   1.594   8.712
  357    HA   GLU  52           HA       GLU  52   9.301  -0.176  10.892
  358   1HB   GLU  52          2HB       GLU  52  10.045  -0.983   8.700
  359   2HB   GLU  52          1HB       GLU  52  11.539  -0.070   8.851
  360   1HG   GLU  52          2HG       GLU  52  11.856  -2.449   9.302
  361   2HG   GLU  52          1HG       GLU  52  12.236  -1.451  10.704
  362    H    ARG  53           H        ARG  53   9.866   0.372  12.890
  363    HA   ARG  53           HA       ARG  53  11.838   2.330  13.456
  364   1HB   ARG  53          2HB       ARG  53  11.439   1.489  15.876
  365   2HB   ARG  53          1HB       ARG  53  10.146   2.317  15.029
  366   1HG   ARG  53          2HG       ARG  53   9.152   0.493  16.134
  367   2HG   ARG  53          1HG       ARG  53   9.231   0.041  14.433
  368   1HD   ARG  53          2HD       ARG  53  11.631  -0.827  15.656
  369   2HD   ARG  53          1HD       ARG  53  10.299  -1.313  16.706
  370    HE   ARG  53           HE       ARG  53  10.110  -1.917  13.839
  371   1HH1  ARG  53          1HH1      ARG  53  10.656  -3.044  17.104
  372   2HH1  ARG  53          2HH1      ARG  53  10.335  -4.708  16.732
  373   1HH2  ARG  53          1HH2      ARG  53   9.690  -4.078  13.323
  374   2HH2  ARG  53          2HH2      ARG  53   9.771  -5.304  14.559
  Start of MODEL   13
    1    H    ASP   4           H        ASP   4   5.282  -4.510  12.868
    2    HA   ASP   4           HA       ASP   4   5.652  -1.643  12.573
    3   1HB   ASP   4          2HB       ASP   4   6.918  -2.286  10.498
    4   2HB   ASP   4          1HB       ASP   4   7.582  -2.927  11.993
    5    H    TYR   5           H        TYR   5   3.796  -0.712  12.108
    6    HA   TYR   5           HA       TYR   5   2.366  -1.604   9.709
    7   1HB   TYR   5          2HB       TYR   5   0.244  -0.840  10.898
    8   2HB   TYR   5          1HB       TYR   5   0.958  -2.348  11.452
    9    HD1  TYR   5           HD2      TYR   5   1.917   1.165  12.323
   10    HD2  TYR   5           HD1      TYR   5   0.284  -2.529  13.666
   11    HE1  TYR   5           HE2      TYR   5   1.909   2.017  14.623
   12    HE2  TYR   5           HE1      TYR   5   0.277  -1.685  15.978
   13    HH   TYR   5           HH       TYR   5   0.803   1.619  16.726
   14    H    VAL   6           H        VAL   6   0.511   0.324   9.458
   15    HA   VAL   6           HA       VAL   6   0.079   2.464   8.842
   16    HB   VAL   6           HB       VAL   6   2.535   3.160  10.458
   17   1HG1  VAL   6          1HG1      VAL   6   1.814   5.480  10.298
   18   2HG1  VAL   6          2HG1      VAL   6   0.478   5.007   9.249
   19   3HG1  VAL   6          3HG1      VAL   6   2.142   4.822   8.693
   20   1HG2  VAL   6          1HG2      VAL   6  -0.414   3.430  11.041
   21   2HG2  VAL   6          2HG2      VAL   6   0.884   4.047  12.062
   22   3HG2  VAL   6          3HG2      VAL   6   0.710   2.309  11.812
   23    H    MET   7           H        MET   7   0.269   3.032   6.807
   24    HA   MET   7           HA       MET   7   2.951   3.000   5.594
   25   1HB   MET   7          2HB       MET   7   1.594   1.111   4.804
   26   2HB   MET   7          1HB       MET   7   0.332   2.223   4.296
   27   1HG   MET   7          2HG       MET   7   1.839   3.201   2.656
   28   2HG   MET   7          1HG       MET   7   3.127   2.124   3.190
   29   1HE   MET   7          1HE       MET   7  -0.388   2.352   1.436
   30   2HE   MET   7          2HE       MET   7  -0.700   1.254   2.780
   31   3HE   MET   7          3HE       MET   7  -0.733   0.651   1.122
   32    H    ALA   8           H        ALA   8   3.521   5.052   5.320
   33    HA   ALA   8           HA       ALA   8   1.553   7.076   4.645
   34   1HB   ALA   8          1HB       ALA   8   3.318   7.620   6.252
   35   2HB   ALA   8          2HB       ALA   8   3.400   8.658   4.830
   36   3HB   ALA   8          3HB       ALA   8   4.539   7.324   5.013
   37    H    THR   9           H        THR   9   1.126   7.739   2.632
   38    HA   THR   9           HA       THR   9   2.887   6.716   0.502
   39    HB   THR   9           HB       THR   9   0.803   6.626  -0.913
   40    HG1  THR   9           HG1      THR   9  -0.654   6.450   1.475
   41   1HG2  THR   9          1HG2      THR   9   1.811   4.606  -0.024
   42   2HG2  THR   9          2HG2      THR   9   0.052   4.483   0.053
   43   3HG2  THR   9          3HG2      THR   9   0.976   4.841   1.512
   44    H    LYS  10           H        LYS  10   2.037   7.792  -1.673
   45    HA   LYS  10           HA       LYS  10   3.223  10.040  -2.251
   46   1HB   LYS  10          2HB       LYS  10   1.915   8.776  -3.850
   47   2HB   LYS  10          1HB       LYS  10   0.422   9.363  -3.130
   48   1HG   LYS  10          2HG       LYS  10   0.876  11.595  -3.870
   49   2HG   LYS  10          1HG       LYS  10   2.479  11.126  -4.445
   50   1HD   LYS  10          2HD       LYS  10   0.901  11.287  -6.295
   51   2HD   LYS  10          1HD       LYS  10   1.439   9.619  -6.075
   52   1HE   LYS  10          2HE       LYS  10  -0.640   9.238  -4.716
   53   2HE   LYS  10          1HE       LYS  10  -1.181  10.838  -5.221
   54   1HZ   LYS  10          1HZ       LYS  10  -2.129   9.159  -6.636
   55   2HZ   LYS  10          2HZ       LYS  10  -0.594   8.532  -6.996
   56   3HZ   LYS  10          3HZ       LYS  10  -1.025  10.082  -7.535
   57    H    ASP  11           H        ASP  11  -0.171  10.225  -1.131
   58    HA   ASP  11           HA       ASP  11  -0.144  13.086  -1.299
   59   1HB   ASP  11          2HB       ASP  11  -2.250  11.316  -0.052
   60   2HB   ASP  11          1HB       ASP  11  -2.451  12.982  -0.572
   61    H    GLY  12           H        GLY  12   1.347  11.294   0.896
   62   1HA   GLY  12          2HA       GLY  12   2.055  11.694   3.057
   63   2HA   GLY  12          1HA       GLY  12   1.265  13.266   2.958
   64    H    ARG  13           H        ARG  13  -0.381  10.279   2.345
   65    HA   ARG  13           HA       ARG  13  -2.171  10.866   4.575
   66   1HB   ARG  13          2HB       ARG  13  -3.720   9.296   3.453
   67   2HB   ARG  13          1HB       ARG  13  -3.243  10.624   2.406
   68   1HG   ARG  13          2HG       ARG  13  -1.409   8.923   1.620
   69   2HG   ARG  13          1HG       ARG  13  -2.552   7.740   2.250
   70   1HD   ARG  13          2HD       ARG  13  -3.205   9.855   0.205
   71   2HD   ARG  13          1HD       ARG  13  -2.838   8.175  -0.163
   72    HE   ARG  13           HE       ARG  13  -4.926   8.103   1.634
   73   1HH1  ARG  13          1HH1      ARG  13  -4.324   9.505  -1.524
   74   2HH1  ARG  13          2HH1      ARG  13  -5.973   9.331  -2.063
   75   1HH2  ARG  13          1HH2      ARG  13  -7.100   7.856   0.930
   76   2HH2  ARG  13          2HH2      ARG  13  -7.556   8.415  -0.655
   77    H    MET  14           H        MET  14  -2.264   9.624   6.320
   78    HA   MET  14           HA       MET  14  -0.324   7.484   6.575
   79   1HB   MET  14          2HB       MET  14  -2.213   8.594   8.663
   80   2HB   MET  14          1HB       MET  14  -0.801   7.588   8.950
   81   1HG   MET  14          2HG       MET  14  -0.728  10.367   7.800
   82   2HG   MET  14          1HG       MET  14  -0.438   9.961   9.489
   83   1HE   MET  14          1HE       MET  14   1.700   8.831  10.408
   84   2HE   MET  14          2HE       MET  14   2.889   8.009   9.402
   85   3HE   MET  14          3HE       MET  14   1.240   7.389   9.502
   86    H    ILE  15           H        ILE  15  -1.147   5.721   5.493
   87    HA   ILE  15           HA       ILE  15  -3.887   4.907   5.874
   88    HB   ILE  15           HB       ILE  15  -1.617   3.434   4.523
   89   1HG1  ILE  15          2HG1      ILE  15  -3.824   5.161   3.367
   90   2HG1  ILE  15          1HG1      ILE  15  -2.119   5.588   3.453
   91   1HG2  ILE  15          1HG2      ILE  15  -4.598   2.958   4.408
   92   2HG2  ILE  15          2HG2      ILE  15  -3.417   1.940   5.232
   93   3HG2  ILE  15          3HG2      ILE  15  -3.375   2.093   3.476
   94   1HD1  ILE  15          1HD1      ILE  15  -2.748   4.874   1.221
   95   2HD1  ILE  15          2HD1      ILE  15  -3.287   3.320   1.857
   96   3HD1  ILE  15          3HD1      ILE  15  -1.582   3.762   1.937
   97    H    LEU  16           H        LEU  16  -4.496   4.023   7.715
   98    HA   LEU  16           HA       LEU  16  -2.644   2.702   9.458
   99   1HB   LEU  16          2HB       LEU  16  -5.632   3.074   9.630
  100   2HB   LEU  16          1HB       LEU  16  -4.668   2.294  10.871
  101    HG   LEU  16           HG       LEU  16  -4.459   5.175   9.994
  102   1HD1  LEU  16          1HD1      LEU  16  -5.401   3.929  12.573
  103   2HD1  LEU  16          2HD1      LEU  16  -6.417   4.705  11.358
  104   3HD1  LEU  16          3HD1      LEU  16  -5.236   5.656  12.259
  105   1HD2  LEU  16          1HD2      LEU  16  -2.816   5.415  11.783
  106   2HD2  LEU  16          2HD2      LEU  16  -2.264   4.261  10.570
  107   3HD2  LEU  16          3HD2      LEU  16  -2.904   3.683  12.109
  108    H    THR  17           H        THR  17  -1.903   0.904   8.534
  109    HA   THR  17           HA       THR  17  -3.770  -1.103   7.537
  110    HB   THR  17           HB       THR  17  -1.589  -2.262   6.863
  111    HG1  THR  17           HG1      THR  17  -0.096  -0.059   6.758
  112   1HG2  THR  17          1HG2      THR  17  -1.230  -0.776   4.920
  113   2HG2  THR  17          2HG2      THR  17  -2.202   0.466   5.710
  114   3HG2  THR  17          3HG2      THR  17  -2.944  -1.060   5.231
  115    H    ASP  18           H        ASP  18  -3.574  -3.324   8.257
  116    HA   ASP  18           HA       ASP  18  -3.114  -3.792  11.001
  117   1HB   ASP  18          2HB       ASP  18  -4.441  -5.310   9.552
  118   2HB   ASP  18          1HB       ASP  18  -2.973  -5.755   8.687
  119    H    GLY  19           H        GLY  19  -1.145  -4.270   8.130
  120   1HA   GLY  19          2HA       GLY  19   1.038  -2.948   8.646
  121   2HA   GLY  19          1HA       GLY  19   1.296  -4.294   9.751
  122    H    LYS  20           H        LYS  20   3.134  -3.816   7.613
  123    HA   LYS  20           HA       LYS  20   4.330  -5.309   6.421
  124   1HB   LYS  20          2HB       LYS  20   2.352  -7.254   7.578
  125   2HB   LYS  20          1HB       LYS  20   3.737  -7.743   6.601
  126   1HG   LYS  20          2HG       LYS  20   5.205  -6.525   8.196
  127   2HG   LYS  20          1HG       LYS  20   3.792  -6.243   9.205
  128   1HD   LYS  20          2HD       LYS  20   3.507  -8.614   9.540
  129   2HD   LYS  20          1HD       LYS  20   4.839  -8.961   8.431
  130   1HE   LYS  20          2HE       LYS  20   6.366  -7.735   9.909
  131   2HE   LYS  20          1HE       LYS  20   5.034  -7.430  11.018
  132   1HZ   LYS  20          1HZ       LYS  20   6.457  -9.286  11.691
  133   2HZ   LYS  20          2HZ       LYS  20   6.030 -10.127  10.287
  134   3HZ   LYS  20          3HZ       LYS  20   4.848  -9.757  11.452
  135    HA   PRO  21           HA       PRO  21   1.572  -5.111   2.796
  136   1HB   PRO  21          2HB       PRO  21   2.913  -3.257   1.415
  137   2HB   PRO  21          1HB       PRO  21   1.817  -2.814   2.728
  138   1HG   PRO  21          2HG       PRO  21   4.799  -2.961   2.717
  139   2HG   PRO  21          1HG       PRO  21   3.734  -1.776   3.495
  140   1HD   PRO  21          2HD       PRO  21   4.929  -3.932   4.770
  141   2HD   PRO  21          1HD       PRO  21   3.507  -3.053   5.364
  142    H    GLU  22           H        GLU  22   1.856  -6.180   0.905
  143    HA   GLU  22           HA       GLU  22   4.465  -7.439   0.463
  144   1HB   GLU  22          2HB       GLU  22   2.596  -8.986   0.641
  145   2HB   GLU  22          1HB       GLU  22   1.709  -8.099  -0.591
  146   1HG   GLU  22          2HG       GLU  22   3.593  -8.659  -2.172
  147   2HG   GLU  22          1HG       GLU  22   4.181  -9.767  -0.935
  148    H    ILE  23           H        ILE  23   5.726  -6.311  -0.902
  149    HA   ILE  23           HA       ILE  23   4.557  -4.796  -3.069
  150    HB   ILE  23           HB       ILE  23   7.475  -5.379  -2.543
  151   1HG1  ILE  23          2HG1      ILE  23   5.742  -3.042  -1.708
  152   2HG1  ILE  23          1HG1      ILE  23   6.479  -4.227  -0.640
  153   1HG2  ILE  23          1HG2      ILE  23   7.867  -3.432  -3.984
  154   2HG2  ILE  23          2HG2      ILE  23   6.129  -3.288  -4.253
  155   3HG2  ILE  23          3HG2      ILE  23   7.000  -4.708  -4.838
  156   1HD1  ILE  23          1HD1      ILE  23   8.695  -3.423  -1.294
  157   2HD1  ILE  23          2HD1      ILE  23   7.706  -2.152  -0.578
  158   3HD1  ILE  23          3HD1      ILE  23   7.938  -2.208  -2.326
  159    H    ASP  24           H        ASP  24   3.703  -5.982  -4.639
  160    HA   ASP  24           HA       ASP  24   4.568  -8.621  -5.234
  161   1HB   ASP  24          2HB       ASP  24   2.263  -8.124  -5.542
  162   2HB   ASP  24          1HB       ASP  24   2.624  -6.756  -6.591
  163    H    ASP  25           H        ASP  25   5.592  -9.436  -6.977
  164    HA   ASP  25           HA       ASP  25   7.480  -7.648  -8.271
  165   1HB   ASP  25          2HB       ASP  25   8.390  -9.622  -7.236
  166   2HB   ASP  25          1HB       ASP  25   7.260 -10.657  -8.097
  167    H    ASP  26           H        ASP  26   4.602  -9.391  -9.013
  168    HA   ASP  26           HA       ASP  26   5.069  -9.748 -11.806
  169   1HB   ASP  26          2HB       ASP  26   3.451 -11.144 -10.619
  170   2HB   ASP  26          1HB       ASP  26   2.479  -9.724 -10.241
  171    H    THR  27           H        THR  27   2.777  -7.573 -10.125
  172    HA   THR  27           HA       THR  27   2.892  -5.849 -12.517
  173    HB   THR  27           HB       THR  27   0.669  -6.694 -12.179
  174    HG1  THR  27           HG1      THR  27   1.122  -3.974 -11.605
  175   1HG2  THR  27          1HG2      THR  27   0.818  -5.541  -9.399
  176   2HG2  THR  27          2HG2      THR  27   0.781  -7.253  -9.819
  177   3HG2  THR  27          3HG2      THR  27  -0.619  -6.236 -10.149
  178    H    GLY  28           H        GLY  28   3.989  -6.020  -9.391
  179   1HA   GLY  28          2HA       GLY  28   5.310  -4.490  -8.284
  180   2HA   GLY  28          1HA       GLY  28   4.990  -3.343  -9.578
  181    H    LEU  29           H        LEU  29   2.417  -4.916  -7.836
  182    HA   LEU  29           HA       LEU  29   1.674  -2.304  -6.775
  183   1HB   LEU  29          2HB       LEU  29   0.016  -4.817  -6.990
  184   2HB   LEU  29          1HB       LEU  29  -0.557  -3.262  -6.415
  185    HG   LEU  29           HG       LEU  29   0.302  -3.961  -9.221
  186   1HD1  LEU  29          1HD1      LEU  29  -2.009  -3.345  -9.766
  187   2HD1  LEU  29          2HD1      LEU  29  -2.337  -3.100  -8.051
  188   3HD1  LEU  29          3HD1      LEU  29  -1.926  -4.708  -8.651
  189   1HD2  LEU  29          1HD2      LEU  29   1.097  -1.725  -8.687
  190   2HD2  LEU  29          2HD2      LEU  29  -0.507  -1.280  -8.104
  191   3HD2  LEU  29          3HD2      LEU  29  -0.259  -1.655  -9.811
  192    H    VAL  30           H        VAL  30   1.312  -1.952  -4.620
  193    HA   VAL  30           HA       VAL  30   2.612  -3.870  -2.847
  194    HB   VAL  30           HB       VAL  30   1.708  -1.044  -2.268
  195   1HG1  VAL  30          1HG1      VAL  30   3.156  -1.204  -0.311
  196   2HG1  VAL  30          2HG1      VAL  30   3.521  -2.881  -0.715
  197   3HG1  VAL  30          3HG1      VAL  30   1.880  -2.420  -0.266
  198   1HG2  VAL  30          1HG2      VAL  30   3.427  -1.075  -3.985
  199   2HG2  VAL  30          2HG2      VAL  30   4.444  -2.097  -2.967
  200   3HG2  VAL  30          3HG2      VAL  30   4.074  -0.445  -2.469
  201    H    SER  31           H        SER  31   1.222  -5.411  -2.298
  202    HA   SER  31           HA       SER  31  -1.563  -4.968  -1.791
  203   1HB   SER  31          2HB       SER  31   0.035  -7.397  -0.996
  204   2HB   SER  31          1HB       SER  31  -1.668  -7.315  -1.430
  205    HG   SER  31           HG       SER  31   0.222  -7.984  -3.019
  206    H    TYR  32           H        TYR  32  -2.305  -4.058   0.038
  207    HA   TYR  32           HA       TYR  32  -0.825  -4.609   2.516
  208   1HB   TYR  32          2HB       TYR  32  -1.391  -2.378   3.324
  209   2HB   TYR  32          1HB       TYR  32  -0.499  -2.278   1.812
  210    HD1  TYR  32           HD1      TYR  32  -1.739  -1.746  -0.302
  211    HD2  TYR  32           HD2      TYR  32  -3.564  -1.488   3.526
  212    HE1  TYR  32           HE1      TYR  32  -3.512  -0.333  -1.248
  213    HE2  TYR  32           HE2      TYR  32  -5.339  -0.072   2.594
  214    HH   TYR  32           HH       TYR  32  -5.819   1.308   0.768
  215    H    HIS  33           H        HIS  33  -2.283  -4.015   4.474
  216    HA   HIS  33           HA       HIS  33  -4.961  -5.153   4.023
  217   1HB   HIS  33          2HB       HIS  33  -3.203  -5.735   6.419
  218   2HB   HIS  33          1HB       HIS  33  -4.775  -6.441   6.068
  219    HD1  HIS  33           HD1      HIS  33  -1.223  -7.026   5.679
  220    HD2  HIS  33           HD2      HIS  33  -4.686  -8.183   3.693
  221    HE1  HIS  33           HE1      HIS  33  -0.571  -9.015   4.296
  222    HE2  HIS  33           HE2      HIS  33  -2.734  -9.837   3.291
  223    H    ASP  34           H        ASP  34  -6.314  -3.488   4.445
  224    HA   ASP  34           HA       ASP  34  -5.839  -1.394   6.271
  225   1HB   ASP  34          2HB       ASP  34  -8.307  -2.541   5.019
  226   2HB   ASP  34          1HB       ASP  34  -8.472  -1.385   6.332
  227    H    GLN  35           H        GLN  35  -6.595  -1.087   8.407
  228    HA   GLN  35           HA       GLN  35  -6.670  -3.330  10.111
  229   1HB   GLN  35          2HB       GLN  35  -7.622  -1.710  11.796
  230   2HB   GLN  35          1HB       GLN  35  -6.097  -1.224  11.074
  231   1HG   GLN  35          2HG       GLN  35  -7.142   0.399   9.718
  232   2HG   GLN  35          1HG       GLN  35  -8.746  -0.248  10.051
  233   1HE2  GLN  35          1HE2      GLN  35  -9.758   0.246  11.962
  234   2HE2  GLN  35          2HE2      GLN  35  -9.194   1.490  13.031
  235    H    GLN  36           H        GLN  36  -9.023  -1.947   8.085
  236    HA   GLN  36           HA       GLN  36 -11.313  -2.962   9.530
  237   1HB   GLN  36          2HB       GLN  36 -11.218  -1.835   6.729
  238   2HB   GLN  36          1HB       GLN  36 -12.633  -2.007   7.759
  239   1HG   GLN  36          2HG       GLN  36 -10.305  -0.149   8.198
  240   2HG   GLN  36          1HG       GLN  36 -11.934   0.297   7.689
  241   1HE2  GLN  36          1HE2      GLN  36 -13.583   0.351   9.188
  242   2HE2  GLN  36          2HE2      GLN  36 -13.297   0.264  10.893
  243    H    GLY  37           H        GLY  37  -8.998  -4.427   7.751
  244   1HA   GLY  37          2HA       GLY  37  -9.002  -6.726   7.247
  245   2HA   GLY  37          1HA       GLY  37 -10.756  -6.691   7.183
  246    H    ASN  38           H        ASN  38  -9.306  -4.152   5.462
  247    HA   ASN  38           HA       ASN  38 -10.254  -5.282   2.979
  248   1HB   ASN  38          2HB       ASN  38  -8.967  -2.618   3.603
  249   2HB   ASN  38          1HB       ASN  38  -9.549  -3.084   2.010
  250   1HD2  ASN  38          1HD2      ASN  38 -10.344  -0.920   3.857
  251   2HD2  ASN  38          2HD2      ASN  38 -12.060  -1.121   4.062
  252    H    ALA  39           H        ALA  39  -9.028  -6.666   1.902
  253    HA   ALA  39           HA       ALA  39  -6.123  -6.325   1.877
  254   1HB   ALA  39          1HB       ALA  39  -6.983  -8.572   2.318
  255   2HB   ALA  39          2HB       ALA  39  -6.063  -8.525   0.814
  256   3HB   ALA  39          3HB       ALA  39  -7.826  -8.555   0.768
  257    H    MET  40           H        MET  40  -5.438  -4.888   0.411
  258    HA   MET  40           HA       MET  40  -6.102  -5.269  -2.365
  259   1HB   MET  40          2HB       MET  40  -6.809  -2.867  -2.689
  260   2HB   MET  40          1HB       MET  40  -7.986  -3.911  -1.909
  261   1HG   MET  40          2HG       MET  40  -7.186  -3.001   0.284
  262   2HG   MET  40          1HG       MET  40  -6.246  -1.824  -0.633
  263   1HE   MET  40          1HE       MET  40  -9.305   0.242   0.799
  264   2HE   MET  40          2HE       MET  40  -7.549   0.109   0.753
  265   3HE   MET  40          3HE       MET  40  -8.503  -1.119   1.587
  266    H    GLN  41           H        GLN  41  -5.056  -3.105  -3.562
  267    HA   GLN  41           HA       GLN  41  -2.313  -3.108  -2.463
  268   1HB   GLN  41          2HB       GLN  41  -3.057  -3.489  -5.370
  269   2HB   GLN  41          1HB       GLN  41  -1.430  -3.454  -4.706
  270   1HG   GLN  41          2HG       GLN  41  -1.586  -5.669  -4.647
  271   2HG   GLN  41          1HG       GLN  41  -2.617  -5.432  -3.241
  272   1HE2  GLN  41          1HE2      GLN  41  -4.738  -4.242  -4.941
  273   2HE2  GLN  41          2HE2      GLN  41  -5.499  -5.588  -5.719
  274    H    ILE  42           H        ILE  42  -0.957  -1.346  -3.136
  275    HA   ILE  42           HA       ILE  42  -2.300   0.754  -4.715
  276    HB   ILE  42           HB       ILE  42  -0.957   2.469  -3.711
  277   1HG1  ILE  42          2HG1      ILE  42   0.273   0.598  -1.734
  278   2HG1  ILE  42          1HG1      ILE  42   0.999   0.746  -3.331
  279   1HG2  ILE  42          1HG2      ILE  42  -2.992   1.864  -2.497
  280   2HG2  ILE  42          2HG2      ILE  42  -1.738   2.457  -1.408
  281   3HG2  ILE  42          3HG2      ILE  42  -2.063   0.728  -1.516
  282   1HD1  ILE  42          1HD1      ILE  42   1.294   3.114  -3.007
  283   2HD1  ILE  42          2HD1      ILE  42   2.032   2.215  -1.678
  284   3HD1  ILE  42          3HD1      ILE  42   0.482   3.022  -1.443
  285    H    ASN  43           H        ASN  43  -0.369   2.207  -5.687
  286    HA   ASN  43           HA       ASN  43   1.200   0.343  -7.279
  287   1HB   ASN  43          2HB       ASN  43  -0.027   2.255  -8.296
  288   2HB   ASN  43          1HB       ASN  43   1.040   3.355  -7.444
  289   1HD2  ASN  43          1HD2      ASN  43   1.795   4.246  -9.335
  290   2HD2  ASN  43          2HD2      ASN  43   2.872   3.404 -10.402
  291    H    ARG  44           H        ARG  44   3.450   0.266  -7.344
  292    HA   ARG  44           HA       ARG  44   4.781   0.842  -4.908
  293   1HB   ARG  44          2HB       ARG  44   6.787   0.002  -5.983
  294   2HB   ARG  44          1HB       ARG  44   5.425  -1.039  -6.361
  295   1HG   ARG  44          2HG       ARG  44   5.250  -0.086  -8.570
  296   2HG   ARG  44          1HG       ARG  44   6.517   1.085  -8.197
  297   1HD   ARG  44          2HD       ARG  44   8.098  -0.772  -7.863
  298   2HD   ARG  44          1HD       ARG  44   6.830  -1.913  -8.302
  299    HE   ARG  44           HE       ARG  44   6.813  -0.754 -10.522
  300   1HH1  ARG  44          1HH1      ARG  44   9.636  -0.650  -8.462
  301   2HH1  ARG  44          2HH1      ARG  44  10.758  -0.499  -9.777
  302   1HH2  ARG  44          1HH2      ARG  44   8.298  -0.580 -12.279
  303   2HH2  ARG  44          2HH2      ARG  44  10.003  -0.458 -11.942
  304    H    ASP  45           H        ASP  45   4.194   2.717  -7.681
  305    HA   ASP  45           HA       ASP  45   6.448   4.489  -7.338
  306   1HB   ASP  45          2HB       ASP  45   5.511   4.088  -9.575
  307   2HB   ASP  45          1HB       ASP  45   3.967   4.751  -9.056
  308    H    ASP  46           H        ASP  46   3.368   4.105  -5.966
  309    HA   ASP  46           HA       ASP  46   3.122   6.942  -5.268
  310   1HB   ASP  46          2HB       ASP  46   1.171   4.639  -5.123
  311   2HB   ASP  46          1HB       ASP  46   0.832   6.235  -4.460
  312    H    VAL  47           H        VAL  47   4.777   4.552  -4.042
  313    HA   VAL  47           HA       VAL  47   3.905   4.671  -1.273
  314    HB   VAL  47           HB       VAL  47   6.466   3.448  -2.306
  315   1HG1  VAL  47          1HG1      VAL  47   4.796   2.836   0.126
  316   2HG1  VAL  47          2HG1      VAL  47   6.305   3.751   0.115
  317   3HG1  VAL  47          3HG1      VAL  47   6.304   2.043  -0.328
  318   1HG2  VAL  47          1HG2      VAL  47   5.321   1.328  -2.514
  319   2HG2  VAL  47          2HG2      VAL  47   4.563   2.529  -3.563
  320   3HG2  VAL  47          3HG2      VAL  47   3.799   2.078  -2.040
  321    H    SER  48           H        SER  48   4.666   6.107   0.194
  322    HA   SER  48           HA       SER  48   6.767   7.939  -0.652
  323   1HB   SER  48          2HB       SER  48   4.761   8.954   0.271
  324   2HB   SER  48          1HB       SER  48   4.903   7.993   1.740
  325    HG   SER  48           HG       SER  48   6.918   9.802   0.881
  326    H    GLN  49           H        GLN  49   6.039   6.393   2.494
  327    HA   GLN  49           HA       GLN  49   8.356   4.836   2.642
  328   1HB   GLN  49          2HB       GLN  49   9.515   7.030   2.702
  329   2HB   GLN  49          1HB       GLN  49   8.587   7.463   4.132
  330   1HG   GLN  49          2HG       GLN  49   9.638   5.728   5.411
  331   2HG   GLN  49          1HG       GLN  49  10.457   5.111   3.979
  332   1HE2  GLN  49          1HE2      GLN  49  12.225   6.202   3.165
  333   2HE2  GLN  49          2HE2      GLN  49  13.062   7.414   4.072
  334    H    ILE  50           H        ILE  50   8.380   3.585   4.525
  335    HA   ILE  50           HA       ILE  50   6.013   3.730   6.182
  336    HB   ILE  50           HB       ILE  50   8.406   1.893   6.449
  337   1HG1  ILE  50          2HG1      ILE  50   7.381   1.603   4.253
  338   2HG1  ILE  50          1HG1      ILE  50   7.023   0.213   5.273
  339   1HG2  ILE  50          1HG2      ILE  50   6.852   0.453   7.710
  340   2HG2  ILE  50          2HG2      ILE  50   5.617   1.705   7.581
  341   3HG2  ILE  50          3HG2      ILE  50   7.098   2.020   8.483
  342   1HD1  ILE  50          1HD1      ILE  50   5.080   0.846   3.993
  343   2HD1  ILE  50          2HD1      ILE  50   5.159   2.488   4.633
  344   3HD1  ILE  50          3HD1      ILE  50   4.792   1.140   5.709
  345    H    ILE  51           H        ILE  51   5.928   4.991   7.940
  346    HA   ILE  51           HA       ILE  51   8.472   5.861   9.124
  347    HB   ILE  51           HB       ILE  51   7.352   7.734   8.151
  348   1HG1  ILE  51          2HG1      ILE  51   6.898   7.762  11.142
  349   2HG1  ILE  51          1HG1      ILE  51   8.424   8.114  10.338
  350   1HG2  ILE  51          1HG2      ILE  51   5.108   6.839   7.974
  351   2HG2  ILE  51          2HG2      ILE  51   5.075   8.412   8.773
  352   3HG2  ILE  51          3HG2      ILE  51   4.909   6.936   9.724
  353   1HD1  ILE  51          1HD1      ILE  51   5.881   9.714  10.178
  354   2HD1  ILE  51          2HD1      ILE  51   7.333  10.042   9.232
  355   3HD1  ILE  51          3HD1      ILE  51   7.381  10.166  10.991
  356    H    GLU  52           H        GLU  52   8.904   5.199  11.086
  357    HA   GLU  52           HA       GLU  52   6.889   3.812  12.643
  358   1HB   GLU  52          2HB       GLU  52   9.187   2.897  12.287
  359   2HB   GLU  52          1HB       GLU  52   9.833   4.236  13.223
  360   1HG   GLU  52          2HG       GLU  52   8.629   3.460  15.190
  361   2HG   GLU  52          1HG       GLU  52   7.932   2.138  14.255
  362    H    ARG  53           H        ARG  53   6.143   6.397  12.529
  363    HA   ARG  53           HA       ARG  53   6.097   7.147  15.275
  364   1HB   ARG  53          2HB       ARG  53   8.354   8.044  14.382
  365   2HB   ARG  53          1HB       ARG  53   7.380   9.207  13.489
  366   1HG   ARG  53          2HG       ARG  53   6.510  10.141  15.488
  367   2HG   ARG  53          1HG       ARG  53   7.190   8.839  16.463
  368   1HD   ARG  53          2HD       ARG  53   9.466   9.625  15.671
  369   2HD   ARG  53          1HD       ARG  53   8.645  11.055  15.043
  370    HE   ARG  53           HE       ARG  53   7.965  10.581  17.770
  371   1HH1  ARG  53          1HH1      ARG  53  10.518  11.867  15.730
  372   2HH1  ARG  53          2HH1      ARG  53  11.158  12.895  16.977
  373   1HH2  ARG  53          1HH2      ARG  53   8.832  11.921  19.411
  374   2HH2  ARG  53          2HH2      ARG  53  10.206  12.925  19.059
  Start of MODEL   14
    1    H    ASP   4           H        ASP   4   7.379  -1.454   9.975
    2    HA   ASP   4           HA       ASP   4   5.491  -2.390   9.138
    3   1HB   ASP   4          2HB       ASP   4   6.700  -4.476   9.735
    4   2HB   ASP   4          1HB       ASP   4   5.914  -4.462  11.308
    5    H    TYR   5           H        TYR   5   4.650  -0.344  10.226
    6    HA   TYR   5           HA       TYR   5   2.164  -0.984  11.510
    7   1HB   TYR   5          2HB       TYR   5   3.676  -0.932  13.461
    8   2HB   TYR   5          1HB       TYR   5   4.211   0.681  13.007
    9    HD1  TYR   5           HD2      TYR   5   1.362  -1.282  14.293
   10    HD2  TYR   5           HD1      TYR   5   2.907   2.609  13.534
   11    HE1  TYR   5           HE2      TYR   5  -0.449  -0.306  15.639
   12    HE2  TYR   5           HE1      TYR   5   1.100   3.596  14.880
   13    HH   TYR   5           HH       TYR   5  -1.203   2.977  15.606
   14    H    VAL   6           H        VAL   6   0.838   0.174  10.319
   15    HA   VAL   6           HA       VAL   6  -0.142   1.828   9.139
   16    HB   VAL   6           HB       VAL   6   0.745   3.139  11.337
   17   1HG1  VAL   6          1HG1      VAL   6   2.818   3.899  10.294
   18   2HG1  VAL   6          2HG1      VAL   6   1.759   5.256  10.682
   19   3HG1  VAL   6          3HG1      VAL   6   1.891   4.686   9.018
   20   1HG2  VAL   6          1HG2      VAL   6  -0.678   4.329   8.966
   21   2HG2  VAL   6          2HG2      VAL   6  -0.659   5.017  10.590
   22   3HG2  VAL   6          3HG2      VAL   6  -1.410   3.446  10.307
   23    H    MET   7           H        MET   7   0.115   3.202   7.260
   24    HA   MET   7           HA       MET   7   2.823   3.141   6.112
   25   1HB   MET   7          2HB       MET   7   1.602   1.268   5.150
   26   2HB   MET   7          1HB       MET   7   0.279   2.333   4.692
   27   1HG   MET   7          2HG       MET   7   1.720   3.495   3.131
   28   2HG   MET   7          1HG       MET   7   3.093   2.514   3.636
   29   1HE   MET   7          1HE       MET   7  -0.577   0.808   1.417
   30   2HE   MET   7          2HE       MET   7  -0.384   2.522   1.779
   31   3HE   MET   7          3HE       MET   7  -0.626   1.367   3.090
   32    H    ALA   8           H        ALA   8   3.462   4.990   5.231
   33    HA   ALA   8           HA       ALA   8   1.447   7.080   4.739
   34   1HB   ALA   8          1HB       ALA   8   3.106   7.657   6.451
   35   2HB   ALA   8          2HB       ALA   8   3.252   8.699   5.035
   36   3HB   ALA   8          3HB       ALA   8   4.403   7.386   5.286
   37    H    THR   9           H        THR   9   1.032   7.520   2.685
   38    HA   THR   9           HA       THR   9   2.829   6.434   0.663
   39    HB   THR   9           HB       THR   9   0.941   6.960  -0.906
   40    HG1  THR   9           HG1      THR   9  -1.070   7.444   0.059
   41   1HG2  THR   9          1HG2      THR   9   0.299   5.184   1.453
   42   2HG2  THR   9          2HG2      THR   9   1.252   4.728   0.040
   43   3HG2  THR   9          3HG2      THR   9  -0.461   5.104  -0.136
   44    H    LYS  10           H        LYS  10   2.553   7.838  -1.486
   45    HA   LYS  10           HA       LYS  10   4.418   9.837  -1.350
   46   1HB   LYS  10          2HB       LYS  10   3.845   8.782  -3.429
   47   2HB   LYS  10          1HB       LYS  10   2.199   9.390  -3.346
   48   1HG   LYS  10          2HG       LYS  10   2.940  11.631  -3.742
   49   2HG   LYS  10          1HG       LYS  10   4.632  11.139  -3.622
   50   1HD   LYS  10          2HD       LYS  10   3.944  11.418  -5.954
   51   2HD   LYS  10          1HD       LYS  10   4.371   9.742  -5.607
   52   1HE   LYS  10          2HE       LYS  10   2.373   9.749  -6.931
   53   2HE   LYS  10          1HE       LYS  10   1.952   9.256  -5.293
   54   1HZ   LYS  10          1HZ       LYS  10   1.337  11.672  -4.925
   55   2HZ   LYS  10          2HZ       LYS  10   0.313  10.775  -5.928
   56   3HZ   LYS  10          3HZ       LYS  10   1.426  11.860  -6.610
   57    H    ASP  11           H        ASP  11   0.896  10.250  -1.399
   58    HA   ASP  11           HA       ASP  11   0.970  13.066  -1.607
   59   1HB   ASP  11          2HB       ASP  11  -0.939  11.420  -2.149
   60   2HB   ASP  11          1HB       ASP  11  -1.341  11.544  -0.440
   61    H    GLY  12           H        GLY  12   1.336  10.961   1.079
   62   1HA   GLY  12          2HA       GLY  12   2.200  11.777   3.147
   63   2HA   GLY  12          1HA       GLY  12   1.368  13.300   2.857
   64    H    ARG  13           H        ARG  13  -0.615  10.736   2.059
   65    HA   ARG  13           HA       ARG  13  -2.204  11.137   4.444
   66   1HB   ARG  13          2HB       ARG  13  -3.926   9.866   3.309
   67   2HB   ARG  13          1HB       ARG  13  -3.261  11.050   2.194
   68   1HG   ARG  13          2HG       ARG  13  -1.806   9.198   1.288
   69   2HG   ARG  13          1HG       ARG  13  -2.791   8.083   2.237
   70   1HD   ARG  13          2HD       ARG  13  -3.702   9.912   0.023
   71   2HD   ARG  13          1HD       ARG  13  -3.642   8.153  -0.003
   72    HE   ARG  13           HE       ARG  13  -5.354   9.302   2.039
   73   1HH1  ARG  13          1HH1      ARG  13  -5.129   7.951  -1.201
   74   2HH1  ARG  13          2HH1      ARG  13  -6.842   7.681  -1.341
   75   1HH2  ARG  13          1HH2      ARG  13  -7.609   8.962   1.835
   76   2HH2  ARG  13          2HH2      ARG  13  -8.247   8.260   0.377
   77    H    MET  14           H        MET  14  -2.667   9.583   5.973
   78    HA   MET  14           HA       MET  14  -0.744   7.362   6.033
   79   1HB   MET  14          2HB       MET  14  -2.257   8.731   8.262
   80   2HB   MET  14          1HB       MET  14  -1.240   7.314   8.487
   81   1HG   MET  14          2HG       MET  14   0.692   8.578   7.680
   82   2HG   MET  14          1HG       MET  14  -0.330  10.000   7.481
   83   1HE   MET  14          1HE       MET  14   1.197   7.448  10.070
   84   2HE   MET  14          2HE       MET  14  -0.535   7.353  10.393
   85   3HE   MET  14          3HE       MET  14   0.547   8.069  11.588
   86    H    ILE  15           H        ILE  15  -1.524   5.498   5.415
   87    HA   ILE  15           HA       ILE  15  -4.383   4.968   5.581
   88    HB   ILE  15           HB       ILE  15  -2.171   3.292   4.377
   89   1HG1  ILE  15          2HG1      ILE  15  -4.202   5.116   3.064
   90   2HG1  ILE  15          1HG1      ILE  15  -2.484   5.457   3.240
   91   1HG2  ILE  15          1HG2      ILE  15  -4.093   1.943   5.029
   92   2HG2  ILE  15          2HG2      ILE  15  -3.987   2.065   3.272
   93   3HG2  ILE  15          3HG2      ILE  15  -5.169   3.033   4.154
   94   1HD1  ILE  15          1HD1      ILE  15  -3.673   3.203   1.641
   95   2HD1  ILE  15          2HD1      ILE  15  -1.955   3.573   1.797
   96   3HD1  ILE  15          3HD1      ILE  15  -3.035   4.713   0.992
   97    H    LEU  16           H        LEU  16  -5.310   3.589   6.989
   98    HA   LEU  16           HA       LEU  16  -3.694   2.730   9.217
   99   1HB   LEU  16          2HB       LEU  16  -6.655   2.635   8.685
  100   2HB   LEU  16          1HB       LEU  16  -5.933   1.913  10.108
  101    HG   LEU  16           HG       LEU  16  -6.795   4.035  10.744
  102   1HD1  LEU  16          1HD1      LEU  16  -3.806   4.226  10.400
  103   2HD1  LEU  16          2HD1      LEU  16  -4.665   3.481  11.748
  104   3HD1  LEU  16          3HD1      LEU  16  -4.778   5.220  11.485
  105   1HD2  LEU  16          1HD2      LEU  16  -6.988   5.070   8.566
  106   2HD2  LEU  16          2HD2      LEU  16  -5.232   5.193   8.441
  107   3HD2  LEU  16          3HD2      LEU  16  -6.097   6.129   9.662
  108    H    THR  17           H        THR  17  -2.422   1.175   8.247
  109    HA   THR  17           HA       THR  17  -3.589  -1.115   6.967
  110    HB   THR  17           HB       THR  17  -1.185  -1.927   6.953
  111    HG1  THR  17           HG1      THR  17  -0.456  -0.750   8.775
  112   1HG2  THR  17          1HG2      THR  17  -0.440  -0.287   5.293
  113   2HG2  THR  17          2HG2      THR  17  -1.682   0.840   5.833
  114   3HG2  THR  17          3HG2      THR  17  -2.144  -0.675   5.062
  115    H    ASP  18           H        ASP  18  -3.474  -3.245   7.699
  116    HA   ASP  18           HA       ASP  18  -3.304  -3.761  10.533
  117   1HB   ASP  18          2HB       ASP  18  -4.789  -5.161   9.256
  118   2HB   ASP  18          1HB       ASP  18  -3.534  -5.517   8.076
  119    H    GLY  19           H        GLY  19  -1.346  -3.686   7.758
  120   1HA   GLY  19          2HA       GLY  19   1.050  -3.128   8.357
  121   2HA   GLY  19          1HA       GLY  19   1.021  -4.675   9.209
  122    H    LYS  20           H        LYS  20   2.918  -4.934   7.463
  123    HA   LYS  20           HA       LYS  20   3.445  -6.602   6.013
  124   1HB   LYS  20          2HB       LYS  20   0.518  -7.242   6.270
  125   2HB   LYS  20          1HB       LYS  20   1.591  -8.170   5.234
  126   1HG   LYS  20          2HG       LYS  20   1.490  -9.374   7.235
  127   2HG   LYS  20          1HG       LYS  20   3.031  -8.522   7.303
  128   1HD   LYS  20          2HD       LYS  20   1.878  -6.749   8.654
  129   2HD   LYS  20          1HD       LYS  20   0.472  -7.813   8.726
  130   1HE   LYS  20          2HE       LYS  20   1.738  -8.110  10.730
  131   2HE   LYS  20          1HE       LYS  20   1.932  -9.557   9.741
  132   1HZ   LYS  20          1HZ       LYS  20   4.028  -8.794  10.715
  133   2HZ   LYS  20          2HZ       LYS  20   3.882  -7.319   9.894
  134   3HZ   LYS  20          3HZ       LYS  20   4.078  -8.764   9.019
  135    HA   PRO  21           HA       PRO  21   2.155  -4.232   2.322
  136   1HB   PRO  21          2HB       PRO  21   4.447  -2.935   1.824
  137   2HB   PRO  21          1HB       PRO  21   3.278  -2.334   3.005
  138   1HG   PRO  21          2HG       PRO  21   5.881  -3.687   3.433
  139   2HG   PRO  21          1HG       PRO  21   5.062  -2.479   4.435
  140   1HD   PRO  21          2HD       PRO  21   5.109  -5.280   4.840
  141   2HD   PRO  21          1HD       PRO  21   4.105  -4.099   5.700
  142    H    GLU  22           H        GLU  22   2.047  -6.214   1.216
  143    HA   GLU  22           HA       GLU  22   4.479  -7.577   0.457
  144   1HB   GLU  22          2HB       GLU  22   2.369  -8.812   0.955
  145   2HB   GLU  22          1HB       GLU  22   1.637  -8.072  -0.460
  146   1HG   GLU  22          2HG       GLU  22   3.453  -9.124  -1.828
  147   2HG   GLU  22          1HG       GLU  22   3.924 -10.015  -0.381
  148    H    ILE  23           H        ILE  23   5.641  -6.238  -0.836
  149    HA   ILE  23           HA       ILE  23   4.527  -4.824  -3.038
  150    HB   ILE  23           HB       ILE  23   7.419  -5.629  -2.669
  151   1HG1  ILE  23          2HG1      ILE  23   5.925  -3.193  -1.673
  152   2HG1  ILE  23          1HG1      ILE  23   6.627  -4.456  -0.677
  153   1HG2  ILE  23          1HG2      ILE  23   6.118  -3.410  -4.247
  154   2HG2  ILE  23          2HG2      ILE  23   6.891  -4.852  -4.909
  155   3HG2  ILE  23          3HG2      ILE  23   7.857  -3.645  -4.061
  156   1HD1  ILE  23          1HD1      ILE  23   8.018  -2.481  -0.658
  157   2HD1  ILE  23          2HD1      ILE  23   8.144  -2.529  -2.416
  158   3HD1  ILE  23          3HD1      ILE  23   8.859  -3.816  -1.446
  159    H    ASP  24           H        ASP  24   3.530  -5.924  -4.570
  160    HA   ASP  24           HA       ASP  24   4.125  -8.633  -5.204
  161   1HB   ASP  24          2HB       ASP  24   1.859  -7.599  -5.363
  162   2HB   ASP  24          1HB       ASP  24   2.422  -6.653  -6.734
  163    H    ASP  25           H        ASP  25   5.550  -9.405  -6.604
  164    HA   ASP  25           HA       ASP  25   7.349  -7.579  -7.898
  165   1HB   ASP  25          2HB       ASP  25   8.151  -9.616  -6.769
  166   2HB   ASP  25          1HB       ASP  25   7.274 -10.604  -7.930
  167    H    ASP  26           H        ASP  26   4.604  -9.437  -8.841
  168    HA   ASP  26           HA       ASP  26   5.291  -9.522 -11.635
  169   1HB   ASP  26          2HB       ASP  26   2.755 -10.195 -10.145
  170   2HB   ASP  26          1HB       ASP  26   2.891 -10.303 -11.895
  171    H    THR  27           H        THR  27   2.766  -7.849  -9.757
  172    HA   THR  27           HA       THR  27   2.092  -6.204 -12.046
  173    HB   THR  27           HB       THR  27   0.444  -5.148 -10.477
  174    HG1  THR  27           HG1      THR  27   1.401  -7.169  -8.688
  175   1HG2  THR  27          1HG2      THR  27  -1.011  -7.112 -10.328
  176   2HG2  THR  27          2HG2      THR  27   0.372  -8.164 -10.631
  177   3HG2  THR  27          3HG2      THR  27  -0.181  -7.053 -11.884
  178    H    GLY  28           H        GLY  28   3.952  -5.921  -9.106
  179   1HA   GLY  28          2HA       GLY  28   5.584  -4.281  -8.696
  180   2HA   GLY  28          1HA       GLY  28   4.884  -3.299  -9.975
  181    H    LEU  29           H        LEU  29   2.459  -4.467  -8.040
  182    HA   LEU  29           HA       LEU  29   2.252  -1.866  -6.713
  183   1HB   LEU  29          2HB       LEU  29   0.249  -3.883  -7.628
  184   2HB   LEU  29          1HB       LEU  29  -0.172  -2.820  -6.302
  185    HG   LEU  29           HG       LEU  29   0.329  -0.873  -7.800
  186   1HD1  LEU  29          1HD1      LEU  29   0.405  -1.235 -10.198
  187   2HD1  LEU  29          2HD1      LEU  29   0.417  -2.981  -9.942
  188   3HD1  LEU  29          3HD1      LEU  29   1.776  -2.001  -9.396
  189   1HD2  LEU  29          1HD2      LEU  29  -1.947  -1.635  -7.391
  190   2HD2  LEU  29          2HD2      LEU  29  -1.815  -2.771  -8.736
  191   3HD2  LEU  29          3HD2      LEU  29  -1.759  -1.032  -9.037
  192    H    VAL  30           H        VAL  30   1.555  -1.739  -4.515
  193    HA   VAL  30           HA       VAL  30   2.718  -3.888  -2.920
  194    HB   VAL  30           HB       VAL  30   1.783  -1.135  -2.086
  195   1HG1  VAL  30          1HG1      VAL  30   2.944  -1.579   0.024
  196   2HG1  VAL  30          2HG1      VAL  30   3.306  -3.218  -0.519
  197   3HG1  VAL  30          3HG1      VAL  30   1.634  -2.729  -0.244
  198   1HG2  VAL  30          1HG2      VAL  30   4.156  -0.605  -1.895
  199   2HG2  VAL  30          2HG2      VAL  30   3.737  -1.066  -3.546
  200   3HG2  VAL  30          3HG2      VAL  30   4.570  -2.212  -2.492
  201    H    SER  31           H        SER  31   1.397  -5.464  -2.360
  202    HA   SER  31           HA       SER  31  -1.447  -5.049  -1.970
  203   1HB   SER  31          2HB       SER  31   0.134  -7.566  -1.436
  204   2HB   SER  31          1HB       SER  31  -1.578  -7.427  -1.815
  205    HG   SER  31           HG       SER  31   0.582  -7.533  -3.486
  206    H    TYR  32           H        TYR  32  -2.049  -4.128  -0.072
  207    HA   TYR  32           HA       TYR  32  -0.564  -4.963   2.339
  208   1HB   TYR  32          2HB       TYR  32  -0.725  -2.788   3.252
  209   2HB   TYR  32          1HB       TYR  32  -0.244  -2.544   1.578
  210    HD1  TYR  32           HD2      TYR  32  -1.873  -1.650  -0.062
  211    HD2  TYR  32           HD1      TYR  32  -2.832  -2.018   4.067
  212    HE1  TYR  32           HE2      TYR  32  -3.785  -0.134  -0.369
  213    HE2  TYR  32           HE1      TYR  32  -4.738  -0.503   3.771
  214    HH   TYR  32           HH       TYR  32  -5.574   1.121   2.344
  215    H    HIS  33           H        HIS  33  -1.832  -4.718   4.367
  216    HA   HIS  33           HA       HIS  33  -4.654  -5.438   3.923
  217   1HB   HIS  33          2HB       HIS  33  -2.905  -5.931   6.350
  218   2HB   HIS  33          1HB       HIS  33  -4.581  -6.431   6.182
  219    HD1  HIS  33           HD1      HIS  33  -1.745  -8.129   6.474
  220    HD2  HIS  33           HD2      HIS  33  -4.393  -7.923   3.280
  221    HE1  HIS  33           HE1      HIS  33  -1.363 -10.228   5.144
  222    HE2  HIS  33           HE2      HIS  33  -3.120 -10.173   3.338
  223    H    ASP  34           H        ASP  34  -6.199  -4.072   4.644
  224    HA   ASP  34           HA       ASP  34  -5.503  -1.734   6.201
  225   1HB   ASP  34          2HB       ASP  34  -8.010  -2.807   4.984
  226   2HB   ASP  34          1HB       ASP  34  -8.168  -1.706   6.345
  227    H    GLN  35           H        GLN  35  -5.977  -1.426   8.429
  228    HA   GLN  35           HA       GLN  35  -6.455  -3.820   9.962
  229   1HB   GLN  35          2HB       GLN  35  -6.397  -2.403  11.934
  230   2HB   GLN  35          1HB       GLN  35  -5.052  -2.009  10.876
  231   1HG   GLN  35          2HG       GLN  35  -6.279  -0.049  10.070
  232   2HG   GLN  35          1HG       GLN  35  -7.604  -0.440  11.167
  233   1HE2  GLN  35          1HE2      GLN  35  -4.225  -0.882  11.962
  234   2HE2  GLN  35          2HE2      GLN  35  -4.153   0.350  13.175
  235    H    GLN  36           H        GLN  36  -8.306  -1.660   8.266
  236    HA   GLN  36           HA       GLN  36 -10.794  -1.854   9.584
  237   1HB   GLN  36          2HB       GLN  36 -10.503  -0.177   7.918
  238   2HB   GLN  36          1HB       GLN  36  -9.969  -1.348   6.727
  239   1HG   GLN  36          2HG       GLN  36 -12.191  -2.261   6.573
  240   2HG   GLN  36          1HG       GLN  36 -12.751  -1.189   7.851
  241   1HE2  GLN  36          1HE2      GLN  36 -10.485  -0.110   5.458
  242   2HE2  GLN  36          2HE2      GLN  36 -11.573   0.910   4.580
  243    H    GLY  37           H        GLY  37  -8.948  -4.021   7.612
  244   1HA   GLY  37          2HA       GLY  37  -9.477  -6.393   7.814
  245   2HA   GLY  37          1HA       GLY  37 -11.176  -5.959   7.704
  246    H    ASN  38           H        ASN  38  -8.917  -4.354   5.635
  247    HA   ASN  38           HA       ASN  38 -10.057  -5.840   3.365
  248   1HB   ASN  38          2HB       ASN  38  -8.968  -3.024   3.496
  249   2HB   ASN  38          1HB       ASN  38  -9.493  -3.818   2.016
  250   1HD2  ASN  38          1HD2      ASN  38 -10.464  -1.408   3.350
  251   2HD2  ASN  38          2HD2      ASN  38 -12.155  -1.668   3.602
  252    H    ALA  39           H        ALA  39  -8.690  -6.090   1.481
  253    HA   ALA  39           HA       ALA  39  -5.807  -5.822   1.907
  254   1HB   ALA  39          1HB       ALA  39  -7.140  -8.336   0.882
  255   2HB   ALA  39          2HB       ALA  39  -6.340  -8.156   2.444
  256   3HB   ALA  39          3HB       ALA  39  -5.400  -8.047   0.955
  257    H    MET  40           H        MET  40  -5.000  -4.700   0.230
  258    HA   MET  40           HA       MET  40  -6.032  -5.088  -2.446
  259   1HB   MET  40          2HB       MET  40  -6.763  -2.829  -2.814
  260   2HB   MET  40          1HB       MET  40  -7.611  -3.453  -1.406
  261   1HG   MET  40          2HG       MET  40  -5.878  -2.294   0.004
  262   2HG   MET  40          1HG       MET  40  -5.325  -1.506  -1.472
  263   1HE   MET  40          1HE       MET  40  -8.859  -2.416   0.049
  264   2HE   MET  40          2HE       MET  40  -9.341  -0.834   0.661
  265   3HE   MET  40          3HE       MET  40  -7.936  -1.655   1.347
  266    H    GLN  41           H        GLN  41  -4.888  -3.527  -3.994
  267    HA   GLN  41           HA       GLN  41  -2.066  -3.391  -3.149
  268   1HB   GLN  41          2HB       GLN  41  -3.176  -3.814  -5.932
  269   2HB   GLN  41          1HB       GLN  41  -1.475  -3.797  -5.490
  270   1HG   GLN  41          2HG       GLN  41  -1.839  -5.779  -4.090
  271   2HG   GLN  41          1HG       GLN  41  -3.525  -5.811  -4.601
  272   1HE2  GLN  41          1HE2      GLN  41  -0.924  -4.929  -6.744
  273   2HE2  GLN  41          2HE2      GLN  41  -0.998  -6.335  -7.742
  274    H    ILE  42           H        ILE  42  -1.170  -1.431  -3.100
  275    HA   ILE  42           HA       ILE  42  -2.385   0.716  -4.702
  276    HB   ILE  42           HB       ILE  42  -1.175   2.315  -3.375
  277   1HG1  ILE  42          2HG1      ILE  42  -0.083   0.320  -1.474
  278   2HG1  ILE  42          1HG1      ILE  42   0.725   0.429  -3.038
  279   1HG2  ILE  42          1HG2      ILE  42  -3.280   1.573  -2.450
  280   2HG2  ILE  42          2HG2      ILE  42  -2.136   1.903  -1.150
  281   3HG2  ILE  42          3HG2      ILE  42  -2.479   0.239  -1.622
  282   1HD1  ILE  42          1HD1      ILE  42   1.798   1.871  -1.426
  283   2HD1  ILE  42          2HD1      ILE  42   0.269   2.693  -1.113
  284   3HD1  ILE  42          3HD1      ILE  42   1.035   2.829  -2.699
  285    H    ASN  43           H        ASN  43  -0.703   2.290  -5.613
  286    HA   ASN  43           HA       ASN  43   0.875   0.713  -7.414
  287   1HB   ASN  43          2HB       ASN  43  -0.449   2.765  -8.021
  288   2HB   ASN  43          1HB       ASN  43   0.777   3.721  -7.205
  289   1HD2  ASN  43          1HD2      ASN  43   1.159   4.752  -9.213
  290   2HD2  ASN  43          2HD2      ASN  43   2.130   3.990 -10.427
  291    H    ARG  44           H        ARG  44   3.119   0.904  -7.815
  292    HA   ARG  44           HA       ARG  44   4.802   0.951  -5.567
  293   1HB   ARG  44          2HB       ARG  44   5.270  -0.167  -7.777
  294   2HB   ARG  44          1HB       ARG  44   5.624   1.421  -8.440
  295   1HG   ARG  44          2HG       ARG  44   7.694   0.410  -7.908
  296   2HG   ARG  44          1HG       ARG  44   7.405   1.647  -6.683
  297   1HD   ARG  44          2HD       ARG  44   6.615  -0.048  -5.133
  298   2HD   ARG  44          1HD       ARG  44   6.826  -1.291  -6.363
  299    HE   ARG  44           HE       ARG  44   9.020   0.201  -5.062
  300   1HH1  ARG  44          1HH1      ARG  44   7.857  -2.553  -6.882
  301   2HH1  ARG  44          2HH1      ARG  44   9.277  -3.519  -6.591
  302   1HH2  ARG  44          1HH2      ARG  44  10.898  -1.065  -4.669
  303   2HH2  ARG  44          2HH2      ARG  44  10.996  -2.673  -5.332
  304    H    ASP  45           H        ASP  45   3.926   3.395  -7.908
  305    HA   ASP  45           HA       ASP  45   5.797   5.346  -6.930
  306   1HB   ASP  45          2HB       ASP  45   3.454   5.601  -8.826
  307   2HB   ASP  45          1HB       ASP  45   4.593   6.894  -8.470
  308    H    ASP  46           H        ASP  46   2.889   4.179  -5.808
  309    HA   ASP  46           HA       ASP  46   1.913   6.734  -4.822
  310   1HB   ASP  46          2HB       ASP  46   0.347   4.999  -5.745
  311   2HB   ASP  46          1HB       ASP  46   0.730   3.993  -4.351
  312    H    VAL  47           H        VAL  47   3.343   3.750  -3.621
  313    HA   VAL  47           HA       VAL  47   3.164   4.493  -0.866
  314    HB   VAL  47           HB       VAL  47   3.394   2.137  -1.569
  315   1HG1  VAL  47          1HG1      VAL  47   5.545   1.251  -2.291
  316   2HG1  VAL  47          2HG1      VAL  47   6.209   2.885  -2.327
  317   3HG1  VAL  47          3HG1      VAL  47   4.919   2.432  -3.441
  318   1HG2  VAL  47          1HG2      VAL  47   5.651   3.118   0.170
  319   2HG2  VAL  47          2HG2      VAL  47   5.076   1.453   0.083
  320   3HG2  VAL  47          3HG2      VAL  47   4.015   2.722   0.696
  321    H    SER  48           H        SER  48   4.794   5.368   0.475
  322    HA   SER  48           HA       SER  48   7.053   6.565  -0.967
  323   1HB   SER  48          2HB       SER  48   5.154   8.187  -0.630
  324   2HB   SER  48          1HB       SER  48   5.413   8.034   1.106
  325    HG   SER  48           HG       SER  48   7.193   9.056  -0.853
  326    H    GLN  49           H        GLN  49   5.778   6.322   2.402
  327    HA   GLN  49           HA       GLN  49   8.491   5.550   3.225
  328   1HB   GLN  49          2HB       GLN  49   6.862   7.813   4.373
  329   2HB   GLN  49          1HB       GLN  49   8.258   7.118   5.185
  330   1HG   GLN  49          2HG       GLN  49   8.260   8.462   2.493
  331   2HG   GLN  49          1HG       GLN  49   8.844   9.153   4.007
  332   1HE2  GLN  49          1HE2      GLN  49  10.237   8.642   1.489
  333   2HE2  GLN  49          2HE2      GLN  49  11.587   7.634   1.892
  334    H    ILE  50           H        ILE  50   8.637   4.145   4.837
  335    HA   ILE  50           HA       ILE  50   6.214   3.471   6.373
  336    HB   ILE  50           HB       ILE  50   8.752   1.848   6.015
  337   1HG1  ILE  50          2HG1      ILE  50   7.424   1.901   3.960
  338   2HG1  ILE  50          1HG1      ILE  50   7.358   0.305   4.698
  339   1HG2  ILE  50          1HG2      ILE  50   6.172   1.095   7.382
  340   2HG2  ILE  50          2HG2      ILE  50   7.689   1.488   8.190
  341   3HG2  ILE  50          3HG2      ILE  50   7.581   0.055   7.168
  342   1HD1  ILE  50          1HD1      ILE  50   5.188   0.976   3.843
  343   2HD1  ILE  50          2HD1      ILE  50   5.217   2.414   4.865
  344   3HD1  ILE  50          3HD1      ILE  50   5.149   0.812   5.599
  345    H    ILE  51           H        ILE  51   6.360   3.560   8.653
  346    HA   ILE  51           HA       ILE  51   8.320   5.447   9.569
  347    HB   ILE  51           HB       ILE  51   6.078   5.728  10.380
  348   1HG1  ILE  51          2HG1      ILE  51   7.891   4.762  12.601
  349   2HG1  ILE  51          1HG1      ILE  51   7.896   6.374  11.892
  350   1HG2  ILE  51          1HG2      ILE  51   4.990   4.093  11.855
  351   2HG2  ILE  51          2HG2      ILE  51   6.324   2.974  11.573
  352   3HG2  ILE  51          3HG2      ILE  51   5.277   3.454  10.237
  353   1HD1  ILE  51          1HD1      ILE  51   5.620   6.732  12.725
  354   2HD1  ILE  51          2HD1      ILE  51   6.755   6.369  14.024
  355   3HD1  ILE  51          3HD1      ILE  51   5.645   5.126  13.452
  356    H    GLU  52           H        GLU  52  10.285   4.820  10.044
  357    HA   GLU  52           HA       GLU  52  10.794   2.222  11.252
  358   1HB   GLU  52          2HB       GLU  52  12.572   4.397  10.164
  359   2HB   GLU  52          1HB       GLU  52  13.217   3.033  11.067
  360   1HG   GLU  52          2HG       GLU  52  11.594   2.810   8.543
  361   2HG   GLU  52          1HG       GLU  52  13.353   2.745   8.627
  362    H    ARG  53           H        ARG  53  12.805   2.532  12.936
  363    HA   ARG  53           HA       ARG  53  11.491   3.718  15.194
  364   1HB   ARG  53          2HB       ARG  53  12.802   1.594  15.330
  365   2HB   ARG  53          1HB       ARG  53  14.267   2.533  15.074
  366   1HG   ARG  53          2HG       ARG  53  13.660   3.853  17.122
  367   2HG   ARG  53          1HG       ARG  53  12.380   2.675  17.411
  368   1HD   ARG  53          2HD       ARG  53  14.267   2.037  18.723
  369   2HD   ARG  53          1HD       ARG  53  14.129   0.893  17.389
  370    HE   ARG  53           HE       ARG  53  15.891   2.485  16.318
  371   1HH1  ARG  53          1HH1      ARG  53  15.663   1.556  19.686
  372   2HH1  ARG  53          2HH1      ARG  53  17.365   1.718  19.995
  373   1HH2  ARG  53          1HH2      ARG  53  18.153   2.707  16.713
  374   2HH2  ARG  53          2HH2      ARG  53  18.780   2.366  18.299
  Start of MODEL   15
    1    H    ASP   4           H        ASP   4   0.906  -0.780  15.507
    2    HA   ASP   4           HA       ASP   4   3.710  -0.625  15.986
    3   1HB   ASP   4          2HB       ASP   4   2.285  -2.567  16.647
    4   2HB   ASP   4          1HB       ASP   4   2.133  -2.986  14.945
    5    H    TYR   5           H        TYR   5   1.708  -1.157  13.142
    6    HA   TYR   5           HA       TYR   5   4.051  -0.430  11.523
    7   1HB   TYR   5          2HB       TYR   5   1.888  -2.426  10.846
    8   2HB   TYR   5          1HB       TYR   5   3.021  -1.783   9.665
    9    HD1  TYR   5           HD2      TYR   5   5.573  -2.032  10.366
   10    HD2  TYR   5           HD1      TYR   5   2.399  -4.438  11.869
   11    HE1  TYR   5           HE2      TYR   5   7.189  -3.789  10.956
   12    HE2  TYR   5           HE1      TYR   5   4.009  -6.201  12.458
   13    HH   TYR   5           HH       TYR   5   7.362  -5.690  12.519
   14    H    VAL   6           H        VAL   6   3.432   0.569   9.434
   15    HA   VAL   6           HA       VAL   6   0.900   1.785   9.086
   16    HB   VAL   6           HB       VAL   6   1.749   3.077  11.066
   17   1HG1  VAL   6          1HG1      VAL   6   3.839   4.060   9.133
   18   2HG1  VAL   6          2HG1      VAL   6   4.121   3.050  10.551
   19   3HG1  VAL   6          3HG1      VAL   6   3.543   4.705  10.748
   20   1HG2  VAL   6          1HG2      VAL   6   1.410   4.687   8.541
   21   2HG2  VAL   6          2HG2      VAL   6   1.214   5.289  10.187
   22   3HG2  VAL   6          3HG2      VAL   6   0.110   4.065   9.559
   23    H    MET   7           H        MET   7   0.992   3.336   7.208
   24    HA   MET   7           HA       MET   7   3.477   3.205   5.677
   25   1HB   MET   7          2HB       MET   7   2.222   1.228   4.972
   26   2HB   MET   7          1HB       MET   7   0.823   2.229   4.612
   27   1HG   MET   7          2HG       MET   7   2.116   3.387   2.878
   28   2HG   MET   7          1HG       MET   7   3.488   2.338   3.223
   29   1HE   MET   7          1HE       MET   7  -0.354   1.361   3.122
   30   2HE   MET   7          2HE       MET   7  -0.506   0.908   1.424
   31   3HE   MET   7          3HE       MET   7  -0.147   2.577   1.862
   32    H    ALA   8           H        ALA   8   3.909   5.243   5.152
   33    HA   ALA   8           HA       ALA   8   1.721   7.124   4.683
   34   1HB   ALA   8          1HB       ALA   8   3.501   8.821   4.569
   35   2HB   ALA   8          2HB       ALA   8   4.711   7.552   4.756
   36   3HB   ALA   8          3HB       ALA   8   3.578   7.891   6.065
   37    H    THR   9           H        THR   9   0.987   7.513   2.682
   38    HA   THR   9           HA       THR   9   2.433   6.305   0.461
   39    HB   THR   9           HB       THR   9   0.374   6.755  -0.840
   40    HG1  THR   9           HG1      THR   9  -1.278   7.816   0.022
   41   1HG2  THR   9          1HG2      THR   9  -0.063   5.269   1.758
   42   2HG2  THR   9          2HG2      THR   9   0.679   4.608   0.300
   43   3HG2  THR   9          3HG2      THR   9  -1.019   5.080   0.288
   44    H    LYS  10           H        LYS  10   1.835   7.600  -1.675
   45    HA   LYS  10           HA       LYS  10   3.656   9.531  -2.139
   46   1HB   LYS  10          2HB       LYS  10   2.144   8.376  -3.785
   47   2HB   LYS  10          1HB       LYS  10   0.893   9.531  -3.356
   48   1HG   LYS  10          2HG       LYS  10   2.227  11.351  -4.191
   49   2HG   LYS  10          1HG       LYS  10   3.576  10.261  -4.505
   50   1HD   LYS  10          2HD       LYS  10   2.436  10.723  -6.575
   51   2HD   LYS  10          1HD       LYS  10   2.165   9.041  -6.129
   52   1HE   LYS  10          2HE       LYS  10   0.203  11.266  -5.573
   53   2HE   LYS  10          1HE       LYS  10   0.152  10.258  -7.011
   54   1HZ   LYS  10          1HZ       LYS  10  -0.073   9.224  -4.234
   55   2HZ   LYS  10          2HZ       LYS  10  -0.269   8.332  -5.660
   56   3HZ   LYS  10          3HZ       LYS  10  -1.383   9.539  -5.249
   57    H    ASP  11           H        ASP  11   0.343  10.088  -1.043
   58    HA   ASP  11           HA       ASP  11   0.560  12.941  -1.365
   59   1HB   ASP  11          2HB       ASP  11  -1.671  11.256  -0.208
   60   2HB   ASP  11          1HB       ASP  11  -1.780  12.967  -0.613
   61    H    GLY  12           H        GLY  12   1.783  11.014   0.917
   62   1HA   GLY  12          2HA       GLY  12   2.774  11.641   2.921
   63   2HA   GLY  12          1HA       GLY  12   1.927  13.179   2.827
   64    H    ARG  13           H        ARG  13  -0.300  10.800   2.331
   65    HA   ARG  13           HA       ARG  13  -1.355  11.134   5.001
   66   1HB   ARG  13          2HB       ARG  13  -3.323   9.921   4.149
   67   2HB   ARG  13          1HB       ARG  13  -2.898  11.285   3.124
   68   1HG   ARG  13          2HG       ARG  13  -1.770   9.724   1.583
   69   2HG   ARG  13          1HG       ARG  13  -2.324   8.384   2.585
   70   1HD   ARG  13          2HD       ARG  13  -4.098  10.381   1.191
   71   2HD   ARG  13          1HD       ARG  13  -3.758   8.748   0.626
   72    HE   ARG  13           HE       ARG  13  -4.787   8.684   3.269
   73   1HH1  ARG  13          1HH1      ARG  13  -5.746   9.167  -0.072
   74   2HH1  ARG  13          2HH1      ARG  13  -7.398   8.695   0.199
   75   1HH2  ARG  13          1HH2      ARG  13  -6.958   8.038   3.626
   76   2HH2  ARG  13          2HH2      ARG  13  -8.092   8.068   2.305
   77    H    MET  14           H        MET  14  -1.458   9.605   6.568
   78    HA   MET  14           HA       MET  14   0.192   7.236   6.140
   79   1HB   MET  14          2HB       MET  14  -1.002   8.391   8.664
   80   2HB   MET  14          1HB       MET  14   0.041   6.980   8.604
   81   1HG   MET  14          2HG       MET  14   1.856   8.360   7.723
   82   2HG   MET  14          1HG       MET  14   0.807   9.775   7.790
   83   1HE   MET  14          1HE       MET  14   2.629  11.081   9.204
   84   2HE   MET  14          2HE       MET  14   3.694   9.675   9.146
   85   3HE   MET  14          3HE       MET  14   3.352  10.458  10.689
   86    H    ILE  15           H        ILE  15  -0.709   5.409   5.576
   87    HA   ILE  15           HA       ILE  15  -3.534   4.908   5.999
   88    HB   ILE  15           HB       ILE  15  -1.412   3.097   4.821
   89   1HG1  ILE  15          2HG1      ILE  15  -1.639   5.182   3.535
   90   2HG1  ILE  15          1HG1      ILE  15  -2.244   3.799   2.630
   91   1HG2  ILE  15          1HG2      ILE  15  -3.372   1.888   5.593
   92   2HG2  ILE  15          2HG2      ILE  15  -3.299   1.891   3.831
   93   3HG2  ILE  15          3HG2      ILE  15  -4.419   2.965   4.669
   94   1HD1  ILE  15          1HD1      ILE  15  -3.906   5.852   4.081
   95   2HD1  ILE  15          2HD1      ILE  15  -4.540   4.441   3.233
   96   3HD1  ILE  15          3HD1      ILE  15  -3.697   5.703   2.336
   97    H    LEU  16           H        LEU  16  -4.360   3.722   7.627
   98    HA   LEU  16           HA       LEU  16  -2.575   2.847   9.721
   99   1HB   LEU  16          2HB       LEU  16  -5.577   2.860   9.470
  100   2HB   LEU  16          1HB       LEU  16  -4.750   2.168  10.851
  101    HG   LEU  16           HG       LEU  16  -5.466   4.342  11.483
  102   1HD1  LEU  16          1HD1      LEU  16  -3.357   5.491  11.964
  103   2HD1  LEU  16          2HD1      LEU  16  -2.527   4.428  10.826
  104   3HD1  LEU  16          3HD1      LEU  16  -3.263   3.760  12.283
  105   1HD2  LEU  16          1HD2      LEU  16  -4.092   5.419   9.025
  106   2HD2  LEU  16          2HD2      LEU  16  -4.910   6.371  10.266
  107   3HD2  LEU  16          3HD2      LEU  16  -5.833   5.263   9.250
  108    H    THR  17           H        THR  17  -1.650   1.317   8.054
  109    HA   THR  17           HA       THR  17  -3.058  -1.091   7.470
  110    HB   THR  17           HB       THR  17  -0.774  -1.936   6.838
  111    HG1  THR  17           HG1      THR  17   0.132  -0.194   8.431
  112   1HG2  THR  17          1HG2      THR  17  -1.584   0.736   5.688
  113   2HG2  THR  17          2HG2      THR  17  -2.192  -0.841   5.187
  114   3HG2  THR  17          3HG2      THR  17  -0.500  -0.425   4.921
  115    H    ASP  18           H        ASP  18  -3.229  -2.919   8.675
  116    HA   ASP  18           HA       ASP  18  -2.347  -3.131  11.317
  117   1HB   ASP  18          2HB       ASP  18  -3.099  -5.236   9.288
  118   2HB   ASP  18          1HB       ASP  18  -2.643  -5.651  10.938
  119    H    GLY  19           H        GLY  19  -0.861  -4.240   8.304
  120   1HA   GLY  19          2HA       GLY  19   1.541  -3.135   8.652
  121   2HA   GLY  19          1HA       GLY  19   1.706  -4.581   9.641
  122    H    LYS  20           H        LYS  20   3.444  -4.304   7.485
  123    HA   LYS  20           HA       LYS  20   4.294  -5.919   6.145
  124   1HB   LYS  20          2HB       LYS  20   1.818  -7.483   6.854
  125   2HB   LYS  20          1HB       LYS  20   3.193  -8.120   5.958
  126   1HG   LYS  20          2HG       LYS  20   4.560  -7.306   8.024
  127   2HG   LYS  20          1HG       LYS  20   2.992  -7.359   8.834
  128   1HD   LYS  20          2HD       LYS  20   4.178  -9.449   9.154
  129   2HD   LYS  20          1HD       LYS  20   2.743  -9.709   8.158
  130   1HE   LYS  20          2HE       LYS  20   4.069  -9.782   6.159
  131   2HE   LYS  20          1HE       LYS  20   5.514  -9.291   7.043
  132   1HZ   LYS  20          1HZ       LYS  20   5.444 -11.367   8.255
  133   2HZ   LYS  20          2HZ       LYS  20   5.495 -11.661   6.585
  134   3HZ   LYS  20          3HZ       LYS  20   4.036 -11.840   7.431
  135    HA   PRO  21           HA       PRO  21   1.740  -4.627   2.573
  136   1HB   PRO  21          2HB       PRO  21   3.855  -2.943   1.663
  137   2HB   PRO  21          1HB       PRO  21   2.281  -2.453   2.289
  138   1HG   PRO  21          2HG       PRO  21   4.721  -1.995   3.531
  139   2HG   PRO  21          1HG       PRO  21   3.138  -1.933   4.325
  140   1HD   PRO  21          2HD       PRO  21   5.181  -4.113   4.333
  141   2HD   PRO  21          1HD       PRO  21   4.066  -3.600   5.619
  142    H    GLU  22           H        GLU  22   1.927  -6.490   1.437
  143    HA   GLU  22           HA       GLU  22   4.514  -7.490   0.620
  144   1HB   GLU  22          2HB       GLU  22   1.721  -8.492   0.053
  145   2HB   GLU  22          1HB       GLU  22   3.194  -9.316  -0.435
  146   1HG   GLU  22          2HG       GLU  22   3.818  -9.376   2.006
  147   2HG   GLU  22          1HG       GLU  22   2.172  -8.842   2.344
  148    H    ILE  23           H        ILE  23   5.496  -6.539  -1.009
  149    HA   ILE  23           HA       ILE  23   4.037  -5.159  -3.059
  150    HB   ILE  23           HB       ILE  23   7.001  -5.719  -2.867
  151   1HG1  ILE  23          2HG1      ILE  23   5.380  -3.301  -2.036
  152   2HG1  ILE  23          1HG1      ILE  23   6.174  -4.430  -0.950
  153   1HG2  ILE  23          1HG2      ILE  23   7.242  -3.884  -4.464
  154   2HG2  ILE  23          2HG2      ILE  23   5.488  -3.721  -4.552
  155   3HG2  ILE  23          3HG2      ILE  23   6.267  -5.189  -5.141
  156   1HD1  ILE  23          1HD1      ILE  23   7.531  -2.579  -2.894
  157   2HD1  ILE  23          2HD1      ILE  23   8.349  -3.740  -1.849
  158   3HD1  ILE  23          3HD1      ILE  23   7.455  -2.396  -1.140
  159    H    ASP  24           H        ASP  24   3.131  -6.160  -4.681
  160    HA   ASP  24           HA       ASP  24   3.878  -8.740  -5.637
  161   1HB   ASP  24          2HB       ASP  24   2.165  -6.588  -6.916
  162   2HB   ASP  24          1HB       ASP  24   2.287  -8.251  -7.478
  163    H    ASP  25           H        ASP  25   5.956  -8.822  -6.331
  164    HA   ASP  25           HA       ASP  25   7.292  -6.641  -7.533
  165   1HB   ASP  25          2HB       ASP  25   9.170  -8.158  -7.796
  166   2HB   ASP  25          1HB       ASP  25   8.442  -8.397  -6.212
  167    H    ASP  26           H        ASP  26   5.289  -9.107  -8.794
  168    HA   ASP  26           HA       ASP  26   6.329  -9.395 -11.368
  169   1HB   ASP  26          2HB       ASP  26   4.595 -10.873 -10.519
  170   2HB   ASP  26          1HB       ASP  26   3.455  -9.535 -10.447
  171    H    THR  27           H        THR  27   3.941  -7.078 -10.136
  172    HA   THR  27           HA       THR  27   4.139  -5.644 -12.699
  173    HB   THR  27           HB       THR  27   1.922  -6.576 -12.402
  174    HG1  THR  27           HG1      THR  27   1.460  -4.759 -13.375
  175   1HG2  THR  27          1HG2      THR  27   1.823  -5.025  -9.823
  176   2HG2  THR  27          2HG2      THR  27   1.896  -6.780  -9.977
  177   3HG2  THR  27          3HG2      THR  27   0.476  -5.904 -10.547
  178    H    GLY  28           H        GLY  28   4.367  -5.394  -9.241
  179   1HA   GLY  28          2HA       GLY  28   5.582  -3.633  -8.213
  180   2HA   GLY  28          1HA       GLY  28   5.136  -2.580  -9.547
  181    H    LEU  29           H        LEU  29   2.869  -4.653  -7.842
  182    HA   LEU  29           HA       LEU  29   1.539  -2.245  -6.810
  183   1HB   LEU  29          2HB       LEU  29   0.501  -5.080  -6.980
  184   2HB   LEU  29          1HB       LEU  29  -0.412  -3.691  -6.427
  185    HG   LEU  29           HG       LEU  29   0.571  -4.218  -9.228
  186   1HD1  LEU  29          1HD1      LEU  29  -1.392  -5.489  -8.625
  187   2HD1  LEU  29          2HD1      LEU  29  -1.827  -4.207  -9.756
  188   3HD1  LEU  29          3HD1      LEU  29  -2.190  -4.031  -8.039
  189   1HD2  LEU  29          1HD2      LEU  29  -0.887  -1.803  -8.168
  190   2HD2  LEU  29          2HD2      LEU  29  -0.519  -2.137  -9.860
  191   3HD2  LEU  29          3HD2      LEU  29   0.789  -1.846  -8.715
  192    H    VAL  30           H        VAL  30   0.687  -2.350  -4.572
  193    HA   VAL  30           HA       VAL  30   2.364  -4.082  -2.870
  194    HB   VAL  30           HB       VAL  30   1.375  -1.297  -2.219
  195   1HG1  VAL  30          1HG1      VAL  30   2.769  -1.487  -0.229
  196   2HG1  VAL  30          2HG1      VAL  30   3.179  -3.145  -0.668
  197   3HG1  VAL  30          3HG1      VAL  30   1.516  -2.728  -0.255
  198   1HG2  VAL  30          1HG2      VAL  30   3.152  -1.218  -3.869
  199   2HG2  VAL  30          2HG2      VAL  30   4.150  -2.282  -2.876
  200   3HG2  VAL  30          3HG2      VAL  30   3.751  -0.661  -2.306
  201    H    SER  31           H        SER  31   1.127  -5.630  -2.084
  202    HA   SER  31           HA       SER  31  -1.687  -5.285  -1.608
  203   1HB   SER  31          2HB       SER  31   0.208  -7.555  -0.969
  204   2HB   SER  31          1HB       SER  31  -1.537  -7.624  -0.737
  205    HG   SER  31           HG       SER  31  -0.191  -7.190  -3.220
  206    H    TYR  32           H        TYR  32  -2.202  -3.940   0.020
  207    HA   TYR  32           HA       TYR  32  -0.810  -4.311   2.590
  208   1HB   TYR  32          2HB       TYR  32  -1.164  -1.965   3.067
  209   2HB   TYR  32          1HB       TYR  32  -0.343  -2.127   1.523
  210    HD1  TYR  32           HD2      TYR  32  -2.027  -2.163  -0.581
  211    HD2  TYR  32           HD1      TYR  32  -2.890  -0.451   3.215
  212    HE1  TYR  32           HE2      TYR  32  -3.731  -0.733  -1.623
  213    HE2  TYR  32           HE1      TYR  32  -4.592   0.990   2.180
  214    HH   TYR  32           HH       TYR  32  -5.166   1.911   0.018
  215    H    HIS  33           H        HIS  33  -2.065  -4.041   4.516
  216    HA   HIS  33           HA       HIS  33  -4.908  -4.702   4.100
  217   1HB   HIS  33          2HB       HIS  33  -3.088  -5.327   6.440
  218   2HB   HIS  33          1HB       HIS  33  -4.811  -5.672   6.402
  219    HD1  HIS  33           HD1      HIS  33  -2.172  -7.649   6.501
  220    HD2  HIS  33           HD2      HIS  33  -4.914  -7.092   3.429
  221    HE1  HIS  33           HE1      HIS  33  -2.064  -9.738   5.115
  222    HE2  HIS  33           HE2      HIS  33  -3.911  -9.477   3.417
  223    H    ASP  34           H        ASP  34  -6.321  -3.194   4.625
  224    HA   ASP  34           HA       ASP  34  -5.558  -1.026   6.428
  225   1HB   ASP  34          2HB       ASP  34  -7.391  -1.271   4.235
  226   2HB   ASP  34          1HB       ASP  34  -8.275  -0.762   5.670
  227    H    GLN  35           H        GLN  35  -7.142  -0.344   8.085
  228    HA   GLN  35           HA       GLN  35  -7.739  -2.547   9.806
  229   1HB   GLN  35          2HB       GLN  35  -8.600  -0.763  11.343
  230   2HB   GLN  35          1HB       GLN  35  -6.930  -0.555  10.832
  231   1HG   GLN  35          2HG       GLN  35  -7.615   1.121   9.214
  232   2HG   GLN  35          1HG       GLN  35  -9.302   0.888   9.669
  233   1HE2  GLN  35          1HE2      GLN  35  -6.701   0.841  11.984
  234   2HE2  GLN  35          2HE2      GLN  35  -7.111   2.326  12.768
  235    H    GLN  36           H        GLN  36  -9.130  -3.222   7.824
  236    HA   GLN  36           HA       GLN  36 -11.875  -3.047   8.770
  237   1HB   GLN  36          2HB       GLN  36 -11.565  -1.292   6.954
  238   2HB   GLN  36          1HB       GLN  36 -11.202  -2.606   5.850
  239   1HG   GLN  36          2HG       GLN  36 -13.511  -1.821   5.655
  240   2HG   GLN  36          1HG       GLN  36 -13.418  -3.515   6.133
  241   1HE2  GLN  36          1HE2      GLN  36 -14.097  -4.123   8.188
  242   2HE2  GLN  36          2HE2      GLN  36 -14.977  -3.052   9.232
  243    H    GLY  37           H        GLY  37  -9.364  -4.890   8.262
  244   1HA   GLY  37          2HA       GLY  37  -8.934  -7.027   7.498
  245   2HA   GLY  37          1HA       GLY  37 -10.681  -7.263   7.405
  246    H    ASN  38           H        ASN  38  -8.490  -4.999   5.809
  247    HA   ASN  38           HA       ASN  38  -9.937  -5.558   3.307
  248   1HB   ASN  38          2HB       ASN  38 -10.008  -3.255   4.634
  249   2HB   ASN  38          1HB       ASN  38  -8.488  -2.990   3.789
  250   1HD2  ASN  38          1HD2      ASN  38 -10.953  -1.563   3.527
  251   2HD2  ASN  38          2HD2      ASN  38 -11.449  -1.710   1.885
  252    H    ALA  39           H        ALA  39  -8.714  -6.649   1.911
  253    HA   ALA  39           HA       ALA  39  -5.809  -6.196   1.900
  254   1HB   ALA  39          1HB       ALA  39  -5.669  -8.293   0.622
  255   2HB   ALA  39          2HB       ALA  39  -7.426  -8.443   0.694
  256   3HB   ALA  39          3HB       ALA  39  -6.472  -8.521   2.175
  257    H    MET  40           H        MET  40  -5.258  -4.632   0.534
  258    HA   MET  40           HA       MET  40  -6.532  -4.579  -2.124
  259   1HB   MET  40          2HB       MET  40  -5.804  -2.221  -0.377
  260   2HB   MET  40          1HB       MET  40  -6.294  -2.094  -2.061
  261   1HG   MET  40          2HG       MET  40  -8.459  -2.998  -1.544
  262   2HG   MET  40          1HG       MET  40  -7.980  -3.283   0.128
  263   1HE   MET  40          1HE       MET  40  -7.668   0.296   1.577
  264   2HE   MET  40          2HE       MET  40  -6.382  -0.727   0.927
  265   3HE   MET  40          3HE       MET  40  -7.658  -1.433   1.922
  266    H    GLN  41           H        GLN  41  -5.196  -3.491  -3.785
  267    HA   GLN  41           HA       GLN  41  -2.314  -3.807  -3.211
  268   1HB   GLN  41          2HB       GLN  41  -3.793  -4.427  -5.779
  269   2HB   GLN  41          1HB       GLN  41  -2.044  -4.463  -5.594
  270   1HG   GLN  41          2HG       GLN  41  -2.222  -6.250  -3.974
  271   2HG   GLN  41          1HG       GLN  41  -3.982  -6.181  -4.066
  272   1HE2  GLN  41          1HE2      GLN  41  -1.060  -7.180  -5.638
  273   2HE2  GLN  41          2HE2      GLN  41  -1.819  -8.123  -6.878
  274    H    ILE  42           H        ILE  42  -1.405  -1.882  -3.161
  275    HA   ILE  42           HA       ILE  42  -2.506   0.263  -4.847
  276    HB   ILE  42           HB       ILE  42  -2.553   0.730  -2.460
  277   1HG1  ILE  42          2HG1      ILE  42  -1.282   2.858  -2.458
  278   2HG1  ILE  42          1HG1      ILE  42  -0.462   2.337  -3.931
  279   1HG2  ILE  42          1HG2      ILE  42  -0.497   0.959  -1.156
  280   2HG2  ILE  42          2HG2      ILE  42   0.428   0.330  -2.520
  281   3HG2  ILE  42          3HG2      ILE  42  -0.762  -0.693  -1.712
  282   1HD1  ILE  42          1HD1      ILE  42  -3.421   2.736  -3.629
  283   2HD1  ILE  42          2HD1      ILE  42  -2.573   2.243  -5.096
  284   3HD1  ILE  42          3HD1      ILE  42  -2.300   3.849  -4.416
  285    H    ASN  43           H        ASN  43  -1.148   1.455  -6.222
  286    HA   ASN  43           HA       ASN  43   0.992   0.016  -7.354
  287   1HB   ASN  43          2HB       ASN  43  -0.391   1.625  -8.615
  288   2HB   ASN  43          1HB       ASN  43   0.323   2.947  -7.696
  289   1HD2  ASN  43          1HD2      ASN  43   1.171   3.935  -9.503
  290   2HD2  ASN  43          2HD2      ASN  43   2.515   3.281 -10.380
  291    H    ARG  44           H        ARG  44   3.188   0.333  -7.366
  292    HA   ARG  44           HA       ARG  44   4.439   1.006  -4.961
  293   1HB   ARG  44          2HB       ARG  44   6.561   0.935  -6.342
  294   2HB   ARG  44          1HB       ARG  44   5.552  -0.503  -6.401
  295   1HG   ARG  44          2HG       ARG  44   4.632   0.252  -8.548
  296   2HG   ARG  44          1HG       ARG  44   5.696   1.656  -8.493
  297   1HD   ARG  44          2HD       ARG  44   7.602   0.382  -8.826
  298   2HD   ARG  44          1HD       ARG  44   6.829  -1.103  -8.270
  299    HE   ARG  44           HE       ARG  44   5.415  -0.579 -10.461
  300   1HH1  ARG  44          1HH1      ARG  44   8.884  -0.440  -9.994
  301   2HH1  ARG  44          2HH1      ARG  44   9.250  -0.951 -11.613
  302   1HH2  ARG  44          1HH2      ARG  44   5.896  -1.284 -12.571
  303   2HH2  ARG  44          2HH2      ARG  44   7.548  -1.441 -13.069
  304    H    ASP  45           H        ASP  45   3.630   3.009  -7.686
  305    HA   ASP  45           HA       ASP  45   5.370   5.159  -6.851
  306   1HB   ASP  45          2HB       ASP  45   3.323   4.879  -9.034
  307   2HB   ASP  45          1HB       ASP  45   4.028   6.445  -8.638
  308    H    ASP  46           H        ASP  46   2.413   3.996  -5.848
  309    HA   ASP  46           HA       ASP  46   1.471   6.631  -5.008
  310   1HB   ASP  46          2HB       ASP  46   0.141   3.946  -5.167
  311   2HB   ASP  46          1HB       ASP  46  -0.540   5.227  -4.167
  312    H    VAL  47           H        VAL  47   2.924   3.737  -3.764
  313    HA   VAL  47           HA       VAL  47   2.597   4.612  -1.018
  314    HB   VAL  47           HB       VAL  47   4.129   2.758  -0.437
  315   1HG1  VAL  47          1HG1      VAL  47   1.742   2.345  -0.551
  316   2HG1  VAL  47          2HG1      VAL  47   2.647   0.923  -1.074
  317   3HG1  VAL  47          3HG1      VAL  47   1.874   1.968  -2.268
  318   1HG2  VAL  47          1HG2      VAL  47   5.514   2.753  -2.442
  319   2HG2  VAL  47          2HG2      VAL  47   4.140   2.194  -3.397
  320   3HG2  VAL  47          3HG2      VAL  47   4.827   1.156  -2.145
  321    H    SER  48           H        SER  48   4.627   4.975   0.328
  322    HA   SER  48           HA       SER  48   6.839   6.072  -1.181
  323   1HB   SER  48          2HB       SER  48   5.224   7.912  -1.204
  324   2HB   SER  48          1HB       SER  48   5.108   7.854   0.553
  325    HG   SER  48           HG       SER  48   7.584   8.157   0.294
  326    H    GLN  49           H        GLN  49   5.633   6.683   2.127
  327    HA   GLN  49           HA       GLN  49   8.381   6.140   2.997
  328   1HB   GLN  49          2HB       GLN  49   6.235   7.861   4.229
  329   2HB   GLN  49          1HB       GLN  49   7.811   7.574   4.951
  330   1HG   GLN  49          2HG       GLN  49   7.127   9.115   2.482
  331   2HG   GLN  49          1HG       GLN  49   8.032   9.633   3.902
  332   1HE2  GLN  49          1HE2      GLN  49  10.160   8.778   4.209
  333   2HE2  GLN  49          2HE2      GLN  49  11.098   8.284   2.829
  334    H    ILE  50           H        ILE  50   8.721   4.304   3.977
  335    HA   ILE  50           HA       ILE  50   6.871   3.410   6.062
  336    HB   ILE  50           HB       ILE  50   8.110   1.388   4.203
  337   1HG1  ILE  50          2HG1      ILE  50   5.334   2.569   3.914
  338   2HG1  ILE  50          1HG1      ILE  50   6.683   2.890   2.830
  339   1HG2  ILE  50          1HG2      ILE  50   6.312  -0.043   5.060
  340   2HG2  ILE  50          2HG2      ILE  50   5.720   1.298   6.040
  341   3HG2  ILE  50          3HG2      ILE  50   7.308   0.604   6.363
  342   1HD1  ILE  50          1HD1      ILE  50   5.343   0.238   3.286
  343   2HD1  ILE  50          2HD1      ILE  50   6.749   0.498   2.255
  344   3HD1  ILE  50          3HD1      ILE  50   5.209   1.261   1.855
  345    H    ILE  51           H        ILE  51   9.633   4.700   5.755
  346    HA   ILE  51           HA       ILE  51  11.178   2.672   7.243
  347    HB   ILE  51           HB       ILE  51  12.335   4.584   5.195
  348   1HG1  ILE  51          2HG1      ILE  51  13.073   2.261   4.204
  349   2HG1  ILE  51          1HG1      ILE  51  11.688   1.654   5.107
  350   1HG2  ILE  51          1HG2      ILE  51  14.460   3.457   5.627
  351   2HG2  ILE  51          2HG2      ILE  51  13.693   2.481   6.879
  352   3HG2  ILE  51          3HG2      ILE  51  13.831   4.226   7.084
  353   1HD1  ILE  51          1HD1      ILE  51  11.071   2.102   2.819
  354   2HD1  ILE  51          2HD1      ILE  51  11.641   3.765   2.959
  355   3HD1  ILE  51          3HD1      ILE  51  10.243   3.230   3.893
  356    H    GLU  52           H        GLU  52  11.551   6.086   6.308
  357    HA   GLU  52           HA       GLU  52  12.002   7.966   7.471
  358   1HB   GLU  52          2HB       GLU  52  10.127   6.488   9.281
  359   2HB   GLU  52          1HB       GLU  52  10.808   8.029   9.788
  360   1HG   GLU  52          2HG       GLU  52   8.508   7.814   8.434
  361   2HG   GLU  52          1HG       GLU  52   9.568   9.218   8.327
  362    H    ARG  53           H        ARG  53  13.899   5.878   7.608
  363    HA   ARG  53           HA       ARG  53  15.983   5.630   8.409
  364   1HB   ARG  53          2HB       ARG  53  15.610   8.204   8.744
  365   2HB   ARG  53          1HB       ARG  53  15.598   7.776  10.450
  366   1HG   ARG  53          2HG       ARG  53  17.811   6.848  10.287
  367   2HG   ARG  53          1HG       ARG  53  17.824   7.100   8.538
  368   1HD   ARG  53          2HD       ARG  53  17.728   9.224  10.678
  369   2HD   ARG  53          1HD       ARG  53  19.087   8.851   9.620
  370    HE   ARG  53           HE       ARG  53  17.650   9.613   7.749
  371   1HH1  ARG  53          1HH1      ARG  53  16.964  10.638  11.014
  372   2HH1  ARG  53          2HH1      ARG  53  16.128  12.088  10.532
  373   1HH2  ARG  53          1HH2      ARG  53  16.525  11.517   7.088
  374   2HH2  ARG  53          2HH2      ARG  53  15.862  12.577   8.297
  Start of MODEL   16
    1    H    ASP   4           H        ASP   4   6.438  -1.900  11.468
    2    HA   ASP   4           HA       ASP   4   4.334  -1.156  13.231
    3   1HB   ASP   4          2HB       ASP   4   6.116   0.426  11.376
    4   2HB   ASP   4          1HB       ASP   4   4.868   1.189  12.353
    5    H    TYR   5           H        TYR   5   2.238  -1.079  12.746
    6    HA   TYR   5           HA       TYR   5   1.439  -1.399  10.001
    7   1HB   TYR   5          2HB       TYR   5  -0.880  -1.592  10.993
    8   2HB   TYR   5          1HB       TYR   5   0.285  -2.809  11.489
    9    HD1  TYR   5           HD2      TYR   5   1.282  -2.677  13.787
   10    HD2  TYR   5           HD1      TYR   5  -1.930  -0.166  12.570
   11    HE1  TYR   5           HE2      TYR   5   0.766  -2.204  16.144
   12    HE2  TYR   5           HE1      TYR   5  -2.460   0.309  14.921
   13    HH   TYR   5           HH       TYR   5  -0.350  -0.495  17.483
   14    H    VAL   6           H        VAL   6   2.348   0.758   9.507
   15    HA   VAL   6           HA       VAL   6   0.143   2.502   9.016
   16    HB   VAL   6           HB       VAL   6   0.655   3.324  11.236
   17   1HG1  VAL   6          1HG1      VAL   6   2.835   4.286  11.798
   18   2HG1  VAL   6          2HG1      VAL   6   3.469   3.750  10.243
   19   3HG1  VAL   6          3HG1      VAL   6   2.954   2.563  11.440
   20   1HG2  VAL   6          1HG2      VAL   6   1.144   5.679  10.717
   21   2HG2  VAL   6          2HG2      VAL   6  -0.030   4.977   9.603
   22   3HG2  VAL   6          3HG2      VAL   6   1.644   5.203   9.095
   23    H    MET   7           H        MET   7   0.437   3.446   7.084
   24    HA   MET   7           HA       MET   7   3.171   3.528   6.004
   25   1HB   MET   7          2HB       MET   7   2.138   1.518   5.148
   26   2HB   MET   7          1HB       MET   7   0.710   2.415   4.656
   27   1HG   MET   7          2HG       MET   7   2.019   3.619   2.999
   28   2HG   MET   7          1HG       MET   7   3.472   2.759   3.509
   29   1HE   MET   7          1HE       MET   7  -0.158   1.265   3.216
   30   2HE   MET   7          2HE       MET   7  -0.161   0.682   1.553
   31   3HE   MET   7          3HE       MET   7  -0.092   2.413   1.879
   32    H    ALA   8           H        ALA   8   3.695   5.410   5.119
   33    HA   ALA   8           HA       ALA   8   1.577   7.343   4.519
   34   1HB   ALA   8          1HB       ALA   8   4.563   7.742   4.728
   35   2HB   ALA   8          2HB       ALA   8   3.389   8.089   5.998
   36   3HB   ALA   8          3HB       ALA   8   3.361   9.012   4.495
   37    H    THR   9           H        THR   9   1.058   7.848   2.494
   38    HA   THR   9           HA       THR   9   2.742   6.722   0.356
   39    HB   THR   9           HB       THR   9   0.698   6.630  -1.025
   40    HG1  THR   9           HG1      THR   9  -1.214   7.256  -0.245
   41   1HG2  THR   9          1HG2      THR   9   1.439   4.656   0.221
   42   2HG2  THR   9          2HG2      THR   9  -0.321   4.713   0.106
   43   3HG2  THR   9          3HG2      THR   9   0.480   5.171   1.609
   44    H    LYS  10           H        LYS  10   1.998   7.809  -1.827
   45    HA   LYS  10           HA       LYS  10   3.059  10.113  -2.487
   46   1HB   LYS  10          2HB       LYS  10   1.673   8.716  -3.968
   47   2HB   LYS  10          1HB       LYS  10   0.226   9.357  -3.211
   48   1HG   LYS  10          2HG       LYS  10   0.698  11.554  -4.076
   49   2HG   LYS  10          1HG       LYS  10   2.231  10.993  -4.743
   50   1HD   LYS  10          2HD       LYS  10   0.598  11.108  -6.513
   51   2HD   LYS  10          1HD       LYS  10   0.984   9.421  -6.191
   52   1HE   LYS  10          2HE       LYS  10  -1.464  10.878  -5.177
   53   2HE   LYS  10          1HE       LYS  10  -1.431   9.809  -6.571
   54   1HZ   LYS  10          1HZ       LYS  10  -2.200   8.430  -4.927
   55   2HZ   LYS  10          2HZ       LYS  10  -1.263   9.140  -3.710
   56   3HZ   LYS  10          3HZ       LYS  10  -0.538   8.100  -4.841
   57    H    ASP  11           H        ASP  11  -0.218  10.004  -1.161
   58    HA   ASP  11           HA       ASP  11  -0.692  12.782  -1.378
   59   1HB   ASP  11          2HB       ASP  11  -2.134  10.702   0.272
   60   2HB   ASP  11          1HB       ASP  11  -2.759  12.289  -0.159
   61    H    GLY  12           H        GLY  12   1.215  11.161   0.815
   62   1HA   GLY  12          2HA       GLY  12   2.182  11.850   2.798
   63   2HA   GLY  12          1HA       GLY  12   1.307  13.370   2.645
   64    H    ARG  13           H        ARG  13  -0.574  10.575   2.347
   65    HA   ARG  13           HA       ARG  13  -1.896  11.146   4.864
   66   1HB   ARG  13          2HB       ARG  13  -3.628   9.594   4.087
   67   2HB   ARG  13          1HB       ARG  13  -3.289  10.807   2.861
   68   1HG   ARG  13          2HG       ARG  13  -2.101   9.271   1.525
   69   2HG   ARG  13          1HG       ARG  13  -2.028   8.082   2.823
   70   1HD   ARG  13          2HD       ARG  13  -3.680   7.356   1.265
   71   2HD   ARG  13          1HD       ARG  13  -4.514   7.915   2.710
   72    HE   ARG  13           HE       ARG  13  -4.326   9.450   0.196
   73   1HH1  ARG  13          1HH1      ARG  13  -5.979   8.606   3.158
   74   2HH1  ARG  13          2HH1      ARG  13  -7.413   9.505   2.780
   75   1HH2  ARG  13          1HH2      ARG  13  -6.228  10.607  -0.349
   76   2HH2  ARG  13          2HH2      ARG  13  -7.556  10.646   0.775
   77    H    MET  14           H        MET  14  -2.039   9.734   6.544
   78    HA   MET  14           HA       MET  14  -0.107   7.537   6.556
   79   1HB   MET  14          2HB       MET  14  -1.602   8.871   8.829
   80   2HB   MET  14          1HB       MET  14  -0.447   7.559   9.018
   81   1HG   MET  14          2HG       MET  14   0.186  10.273   7.880
   82   2HG   MET  14          1HG       MET  14   0.500   9.762   9.539
   83   1HE   MET  14          1HE       MET  14   2.708  10.981   7.573
   84   2HE   MET  14          2HE       MET  14   4.075   9.918   7.907
   85   3HE   MET  14          3HE       MET  14   3.062  10.494   9.231
   86    H    ILE  15           H        ILE  15  -1.023   5.761   5.740
   87    HA   ILE  15           HA       ILE  15  -3.811   5.153   6.244
   88    HB   ILE  15           HB       ILE  15  -1.739   3.457   4.827
   89   1HG1  ILE  15          2HG1      ILE  15  -3.739   5.418   3.678
   90   2HG1  ILE  15          1HG1      ILE  15  -1.995   5.656   3.749
   91   1HG2  ILE  15          1HG2      ILE  15  -3.673   2.177   5.555
   92   2HG2  ILE  15          2HG2      ILE  15  -3.696   2.362   3.799
   93   3HG2  ILE  15          3HG2      ILE  15  -4.757   3.352   4.804
   94   1HD1  ILE  15          1HD1      ILE  15  -1.680   3.746   2.260
   95   2HD1  ILE  15          2HD1      ILE  15  -2.695   4.990   1.528
   96   3HD1  ILE  15          3HD1      ILE  15  -3.428   3.524   2.183
   97    H    LEU  16           H        LEU  16  -4.338   4.349   8.152
   98    HA   LEU  16           HA       LEU  16  -2.518   2.896   9.806
   99   1HB   LEU  16          2HB       LEU  16  -5.493   3.359  10.032
  100   2HB   LEU  16          1HB       LEU  16  -4.565   2.468  11.219
  101    HG   LEU  16           HG       LEU  16  -4.850   4.616  12.115
  102   1HD1  LEU  16          1HD1      LEU  16  -2.587   3.771  12.366
  103   2HD1  LEU  16          2HD1      LEU  16  -2.593   5.530  12.241
  104   3HD1  LEU  16          3HD1      LEU  16  -2.115   4.550  10.855
  105   1HD2  LEU  16          1HD2      LEU  16  -4.337   6.685  10.935
  106   2HD2  LEU  16          2HD2      LEU  16  -5.580   5.763  10.091
  107   3HD2  LEU  16          3HD2      LEU  16  -3.922   5.768   9.489
  108    H    THR  17           H        THR  17  -1.938   1.285   8.273
  109    HA   THR  17           HA       THR  17  -3.786  -0.587   7.224
  110    HB   THR  17           HB       THR  17  -1.788  -1.918   6.651
  111    HG1  THR  17           HG1      THR  17  -0.740  -0.673   8.730
  112   1HG2  THR  17          1HG2      THR  17  -1.269   1.013   6.157
  113   2HG2  THR  17          2HG2      THR  17  -2.469   0.068   5.281
  114   3HG2  THR  17          3HG2      THR  17  -0.760  -0.348   5.156
  115    H    ASP  18           H        ASP  18  -4.088  -2.801   7.845
  116    HA   ASP  18           HA       ASP  18  -4.007  -3.393  10.624
  117   1HB   ASP  18          2HB       ASP  18  -5.504  -4.509   8.902
  118   2HB   ASP  18          1HB       ASP  18  -4.088  -5.412   8.371
  119    H    GLY  19           H        GLY  19  -1.934  -4.070   7.892
  120   1HA   GLY  19          2HA       GLY  19   0.439  -3.442   8.855
  121   2HA   GLY  19          1HA       GLY  19   0.231  -5.025   9.604
  122    H    LYS  20           H        LYS  20   2.367  -4.540   7.722
  123    HA   LYS  20           HA       LYS  20   3.309  -6.063   6.332
  124   1HB   LYS  20          2HB       LYS  20   0.671  -7.472   6.590
  125   2HB   LYS  20          1HB       LYS  20   2.019  -8.107   5.653
  126   1HG   LYS  20          2HG       LYS  20   3.384  -7.845   7.806
  127   2HG   LYS  20          1HG       LYS  20   1.821  -7.677   8.609
  128   1HD   LYS  20          2HD       LYS  20   1.129  -9.851   7.789
  129   2HD   LYS  20          1HD       LYS  20   2.634 -10.014   6.881
  130   1HE   LYS  20          2HE       LYS  20   3.861  -9.845   9.048
  131   2HE   LYS  20          1HE       LYS  20   2.302  -9.910   9.869
  132   1HZ   LYS  20          1HZ       LYS  20   1.899 -12.068   8.890
  133   2HZ   LYS  20          2HZ       LYS  20   3.358 -12.087   9.749
  134   3HZ   LYS  20          3HZ       LYS  20   3.373 -12.003   8.054
  135    HA   PRO  21           HA       PRO  21   1.719  -4.413   2.453
  136   1HB   PRO  21          2HB       PRO  21   3.924  -3.066   1.736
  137   2HB   PRO  21          1HB       PRO  21   2.754  -2.393   2.876
  138   1HG   PRO  21          2HG       PRO  21   5.449  -3.514   3.374
  139   2HG   PRO  21          1HG       PRO  21   4.558  -2.278   4.275
  140   1HD   PRO  21          2HD       PRO  21   4.815  -5.037   4.921
  141   2HD   PRO  21          1HD       PRO  21   3.800  -3.830   5.732
  142    H    GLU  22           H        GLU  22   1.672  -6.216   1.208
  143    HA   GLU  22           HA       GLU  22   4.141  -7.652   0.637
  144   1HB   GLU  22          2HB       GLU  22   1.252  -8.222  -0.013
  145   2HB   GLU  22          1HB       GLU  22   2.580  -9.214  -0.596
  146   1HG   GLU  22          2HG       GLU  22   1.933  -8.707   2.300
  147   2HG   GLU  22          1HG       GLU  22   1.498 -10.154   1.392
  148    H    ILE  23           H        ILE  23   5.351  -6.732  -0.865
  149    HA   ILE  23           HA       ILE  23   4.247  -5.122  -2.963
  150    HB   ILE  23           HB       ILE  23   7.089  -6.087  -2.628
  151   1HG1  ILE  23          2HG1      ILE  23   5.791  -3.509  -1.713
  152   2HG1  ILE  23          1HG1      ILE  23   6.273  -4.830  -0.659
  153   1HG2  ILE  23          1HG2      ILE  23   7.656  -4.168  -4.043
  154   2HG2  ILE  23          2HG2      ILE  23   5.939  -3.794  -4.213
  155   3HG2  ILE  23          3HG2      ILE  23   6.584  -5.294  -4.880
  156   1HD1  ILE  23          1HD1      ILE  23   8.603  -4.477  -1.274
  157   2HD1  ILE  23          2HD1      ILE  23   7.883  -3.011  -0.608
  158   3HD1  ILE  23          3HD1      ILE  23   8.122  -3.163  -2.348
  159    H    ASP  24           H        ASP  24   3.329  -5.951  -4.685
  160    HA   ASP  24           HA       ASP  24   3.885  -8.647  -5.549
  161   1HB   ASP  24          2HB       ASP  24   2.021  -6.526  -6.637
  162   2HB   ASP  24          1HB       ASP  24   2.153  -8.157  -7.292
  163    H    ASP  25           H        ASP  25   5.695  -8.969  -6.616
  164    HA   ASP  25           HA       ASP  25   7.070  -7.027  -8.143
  165   1HB   ASP  25          2HB       ASP  25   8.152  -8.981  -7.069
  166   2HB   ASP  25          1HB       ASP  25   7.331 -10.044  -8.206
  167    H    ASP  26           H        ASP  26   4.534  -9.204  -8.808
  168    HA   ASP  26           HA       ASP  26   4.751  -9.625 -11.547
  169   1HB   ASP  26          2HB       ASP  26   2.228  -9.315  -9.908
  170   2HB   ASP  26          1HB       ASP  26   2.334 -10.068 -11.494
  171    H    THR  27           H        THR  27   2.539  -7.334  -9.977
  172    HA   THR  27           HA       THR  27   2.263  -5.941 -12.527
  173    HB   THR  27           HB       THR  27   0.182  -6.606 -11.573
  174    HG1  THR  27           HG1      THR  27   0.806  -3.900 -11.639
  175   1HG2  THR  27          1HG2      THR  27   0.887  -6.921  -9.270
  176   2HG2  THR  27          2HG2      THR  27  -0.555  -5.911  -9.344
  177   3HG2  THR  27          3HG2      THR  27   1.020  -5.174  -9.059
  178    H    GLY  28           H        GLY  28   3.999  -5.573  -9.668
  179   1HA   GLY  28          2HA       GLY  28   5.331  -3.811  -8.990
  180   2HA   GLY  28          1HA       GLY  28   4.710  -2.870 -10.343
  181    H    LEU  29           H        LEU  29   2.813  -4.477  -7.869
  182    HA   LEU  29           HA       LEU  29   1.980  -1.846  -6.859
  183   1HB   LEU  29          2HB       LEU  29   0.247  -4.310  -7.111
  184   2HB   LEU  29          1HB       LEU  29  -0.260  -2.766  -6.456
  185    HG   LEU  29           HG       LEU  29   0.400  -3.421  -9.324
  186   1HD1  LEU  29          1HD1      LEU  29  -1.825  -4.054  -8.615
  187   2HD1  LEU  29          2HD1      LEU  29  -1.902  -2.675  -9.709
  188   3HD1  LEU  29          3HD1      LEU  29  -2.106  -2.436  -7.976
  189   1HD2  LEU  29          1HD2      LEU  29  -0.177  -0.721  -8.120
  190   2HD2  LEU  29          2HD2      LEU  29  -0.084  -1.082  -9.843
  191   3HD2  LEU  29          3HD2      LEU  29   1.349  -1.248  -8.831
  192    H    VAL  30           H        VAL  30   0.770  -2.260  -4.620
  193    HA   VAL  30           HA       VAL  30   2.344  -4.219  -3.075
  194    HB   VAL  30           HB       VAL  30   1.639  -1.414  -2.183
  195   1HG1  VAL  30          1HG1      VAL  30   2.962  -1.941  -0.188
  196   2HG1  VAL  30          2HG1      VAL  30   3.153  -3.597  -0.763
  197   3HG1  VAL  30          3HG1      VAL  30   1.554  -2.990  -0.342
  198   1HG2  VAL  30          1HG2      VAL  30   4.062  -1.034  -2.162
  199   2HG2  VAL  30          2HG2      VAL  30   3.462  -1.394  -3.780
  200   3HG2  VAL  30          3HG2      VAL  30   4.311  -2.636  -2.857
  201    H    SER  31           H        SER  31   0.982  -5.690  -2.320
  202    HA   SER  31           HA       SER  31  -1.789  -5.100  -1.776
  203   1HB   SER  31          2HB       SER  31  -0.137  -7.590  -1.270
  204   2HB   SER  31          1HB       SER  31  -1.880  -7.475  -1.034
  205    HG   SER  31           HG       SER  31  -0.443  -7.193  -3.485
  206    H    TYR  32           H        TYR  32  -2.020  -3.728  -0.086
  207    HA   TYR  32           HA       TYR  32  -0.677  -4.398   2.440
  208   1HB   TYR  32          2HB       TYR  32  -0.989  -2.182   3.137
  209   2HB   TYR  32          1HB       TYR  32  -0.620  -2.017   1.426
  210    HD1  TYR  32           HD1      TYR  32  -2.691  -1.799  -0.173
  211    HD2  TYR  32           HD2      TYR  32  -2.858  -1.164   4.027
  212    HE1  TYR  32           HE1      TYR  32  -4.758  -0.495  -0.456
  213    HE2  TYR  32           HE2      TYR  32  -4.921   0.142   3.758
  214    HH   TYR  32           HH       TYR  32  -6.793   0.096   1.066
  215    H    HIS  33           H        HIS  33  -2.217  -3.732   4.389
  216    HA   HIS  33           HA       HIS  33  -4.821  -5.005   3.876
  217   1HB   HIS  33          2HB       HIS  33  -3.066  -5.184   6.338
  218   2HB   HIS  33          1HB       HIS  33  -4.729  -5.756   6.277
  219    HD1  HIS  33           HD1      HIS  33  -1.272  -6.715   5.434
  220    HD2  HIS  33           HD2      HIS  33  -5.123  -8.007   4.526
  221    HE1  HIS  33           HE1      HIS  33  -1.003  -9.009   4.437
  222    HE2  HIS  33           HE2      HIS  33  -3.338  -9.738   3.806
  223    H    ASP  34           H        ASP  34  -6.479  -3.722   4.137
  224    HA   ASP  34           HA       ASP  34  -6.474  -1.090   4.995
  225   1HB   ASP  34          2HB       ASP  34  -8.438  -3.030   4.235
  226   2HB   ASP  34          1HB       ASP  34  -9.021  -2.138   5.635
  227    H    GLN  35           H        GLN  35  -7.887  -0.216   6.742
  228    HA   GLN  35           HA       GLN  35  -7.158  -0.994   9.347
  229   1HB   GLN  35          2HB       GLN  35  -9.634   0.512   8.451
  230   2HB   GLN  35          1HB       GLN  35  -8.958   0.503  10.073
  231   1HG   GLN  35          2HG       GLN  35  -7.061   1.734   9.396
  232   2HG   GLN  35          1HG       GLN  35  -7.440   1.509   7.688
  233   1HE2  GLN  35          1HE2      GLN  35  -8.301   3.174  10.625
  234   2HE2  GLN  35          2HE2      GLN  35  -9.238   4.424   9.870
  235    H    GLN  36           H        GLN  36  -9.689  -1.910   7.159
  236    HA   GLN  36           HA       GLN  36 -11.138  -3.499   9.089
  237   1HB   GLN  36          2HB       GLN  36 -11.438  -3.463   6.081
  238   2HB   GLN  36          1HB       GLN  36 -12.612  -4.037   7.255
  239   1HG   GLN  36          2HG       GLN  36 -11.744  -1.203   6.774
  240   2HG   GLN  36          1HG       GLN  36 -13.324  -1.912   6.459
  241   1HE2  GLN  36          1HE2      GLN  36 -12.531   0.383   8.104
  242   2HE2  GLN  36          2HE2      GLN  36 -13.164   0.065   9.680
  243    H    GLY  37           H        GLY  37  -8.401  -3.916   7.150
  244   1HA   GLY  37          2HA       GLY  37  -7.027  -5.859   7.424
  245   2HA   GLY  37          1HA       GLY  37  -8.486  -6.814   7.641
  246    H    ASN  38           H        ASN  38  -9.091  -4.768   5.151
  247    HA   ASN  38           HA       ASN  38  -9.304  -6.734   3.194
  248   1HB   ASN  38          2HB       ASN  38  -8.949  -3.755   2.813
  249   2HB   ASN  38          1HB       ASN  38  -9.501  -4.873   1.575
  250   1HD2  ASN  38          1HD2      ASN  38 -10.723  -2.507   2.835
  251   2HD2  ASN  38          2HD2      ASN  38 -12.274  -3.053   3.386
  252    H    ALA  39           H        ALA  39  -7.851  -7.725   1.919
  253    HA   ALA  39           HA       ALA  39  -5.144  -6.726   1.708
  254   1HB   ALA  39          1HB       ALA  39  -5.517  -9.132   1.839
  255   2HB   ALA  39          2HB       ALA  39  -4.750  -8.705   0.309
  256   3HB   ALA  39          3HB       ALA  39  -6.473  -9.077   0.359
  257    H    MET  40           H        MET  40  -4.953  -4.928   0.499
  258    HA   MET  40           HA       MET  40  -6.237  -4.908  -2.153
  259   1HB   MET  40          2HB       MET  40  -6.194  -2.719  -0.081
  260   2HB   MET  40          1HB       MET  40  -6.566  -2.420  -1.776
  261   1HG   MET  40          2HG       MET  40  -8.518  -3.683  -1.697
  262   2HG   MET  40          1HG       MET  40  -8.040  -4.488  -0.205
  263   1HE   MET  40          1HE       MET  40  -8.700  -0.821  -1.605
  264   2HE   MET  40          2HE       MET  40  -7.427  -0.630  -0.392
  265   3HE   MET  40          3HE       MET  40  -9.041   0.014  -0.088
  266    H    GLN  41           H        GLN  41  -5.153  -3.777  -3.794
  267    HA   GLN  41           HA       GLN  41  -2.275  -3.580  -3.249
  268   1HB   GLN  41          2HB       GLN  41  -3.715  -3.895  -5.887
  269   2HB   GLN  41          1HB       GLN  41  -1.971  -3.892  -5.662
  270   1HG   GLN  41          2HG       GLN  41  -2.125  -5.927  -4.343
  271   2HG   GLN  41          1HG       GLN  41  -3.877  -5.926  -4.525
  272   1HE2  GLN  41          1HE2      GLN  41  -1.702  -5.002  -7.082
  273   2HE2  GLN  41          2HE2      GLN  41  -1.986  -6.375  -8.093
  274    H    ILE  42           H        ILE  42  -1.379  -1.638  -3.145
  275    HA   ILE  42           HA       ILE  42  -2.596   0.559  -4.687
  276    HB   ILE  42           HB       ILE  42  -1.481   2.141  -3.303
  277   1HG1  ILE  42          2HG1      ILE  42  -0.170  -0.031  -1.677
  278   2HG1  ILE  42          1HG1      ILE  42   0.628   0.665  -3.085
  279   1HG2  ILE  42          1HG2      ILE  42  -2.373   1.632  -1.078
  280   2HG2  ILE  42          2HG2      ILE  42  -2.618  -0.042  -1.575
  281   3HG2  ILE  42          3HG2      ILE  42  -3.520   1.253  -2.365
  282   1HD1  ILE  42          1HD1      ILE  42   1.309   1.696  -0.960
  283   2HD1  ILE  42          2HD1      ILE  42  -0.353   2.239  -0.723
  284   3HD1  ILE  42          3HD1      ILE  42   0.587   2.841  -2.090
  285    H    ASN  43           H        ASN  43  -0.674   2.204  -5.279
  286    HA   ASN  43           HA       ASN  43   0.867   0.757  -7.208
  287   1HB   ASN  43          2HB       ASN  43  -0.177   3.064  -7.499
  288   2HB   ASN  43          1HB       ASN  43   1.129   3.679  -6.498
  289   1HD2  ASN  43          1HD2      ASN  43   3.096   4.019  -7.382
  290   2HD2  ASN  43          2HD2      ASN  43   3.486   3.709  -9.046
  291    H    ARG  44           H        ARG  44   2.911   0.036  -7.022
  292    HA   ARG  44           HA       ARG  44   4.286  -0.121  -4.613
  293   1HB   ARG  44          2HB       ARG  44   4.778  -1.597  -6.453
  294   2HB   ARG  44          1HB       ARG  44   5.322  -0.255  -7.444
  295   1HG   ARG  44          2HG       ARG  44   7.118   0.090  -5.654
  296   2HG   ARG  44          1HG       ARG  44   6.678  -1.527  -5.100
  297   1HD   ARG  44          2HD       ARG  44   8.552  -1.621  -6.656
  298   2HD   ARG  44          1HD       ARG  44   7.128  -2.418  -7.328
  299    HE   ARG  44           HE       ARG  44   7.394   0.352  -8.097
  300   1HH1  ARG  44          1HH1      ARG  44   8.233  -2.961  -8.901
  301   2HH1  ARG  44          2HH1      ARG  44   8.558  -2.593 -10.574
  302   1HH2  ARG  44          1HH2      ARG  44   7.776   0.816 -10.283
  303   2HH2  ARG  44          2HH2      ARG  44   8.292  -0.452 -11.357
  304    H    ASP  45           H        ASP  45   4.666   2.200  -7.244
  305    HA   ASP  45           HA       ASP  45   6.840   3.544  -5.878
  306   1HB   ASP  45          2HB       ASP  45   5.431   4.140  -8.487
  307   2HB   ASP  45          1HB       ASP  45   6.826   5.026  -7.878
  308    H    ASP  46           H        ASP  46   3.712   3.511  -5.268
  309    HA   ASP  46           HA       ASP  46   3.355   6.405  -4.932
  310   1HB   ASP  46          2HB       ASP  46   1.524   4.772  -5.780
  311   2HB   ASP  46          1HB       ASP  46   1.393   4.274  -4.097
  312    H    VAL  47           H        VAL  47   4.269   3.567  -3.292
  313    HA   VAL  47           HA       VAL  47   3.680   4.323  -0.620
  314    HB   VAL  47           HB       VAL  47   5.988   2.546  -1.392
  315   1HG1  VAL  47          1HG1      VAL  47   5.652   3.149   0.981
  316   2HG1  VAL  47          2HG1      VAL  47   5.490   1.419   0.672
  317   3HG1  VAL  47          3HG1      VAL  47   4.051   2.410   0.907
  318   1HG2  VAL  47          1HG2      VAL  47   4.090   1.827  -2.739
  319   2HG2  VAL  47          2HG2      VAL  47   3.084   1.755  -1.294
  320   3HG2  VAL  47          3HG2      VAL  47   4.446   0.650  -1.474
  321    H    SER  48           H        SER  48   4.473   6.117   0.254
  322    HA   SER  48           HA       SER  48   6.875   7.298  -0.839
  323   1HB   SER  48          2HB       SER  48   4.897   8.691  -0.513
  324   2HB   SER  48          1HB       SER  48   4.908   8.332   1.212
  325    HG   SER  48           HG       SER  48   6.732   9.881  -0.309
  326    H    GLN  49           H        GLN  49   5.717   6.262   2.377
  327    HA   GLN  49           HA       GLN  49   8.383   5.572   3.187
  328   1HB   GLN  49          2HB       GLN  49   8.279   8.098   3.421
  329   2HB   GLN  49          1HB       GLN  49   7.066   7.850   4.668
  330   1HG   GLN  49          2HG       GLN  49   9.005   8.096   5.889
  331   2HG   GLN  49          1HG       GLN  49   8.845   6.343   5.775
  332   1HE2  GLN  49          1HE2      GLN  49  10.298   5.183   4.488
  333   2HE2  GLN  49          2HE2      GLN  49  11.765   5.890   3.891
  334    H    ILE  50           H        ILE  50   8.300   4.046   4.752
  335    HA   ILE  50           HA       ILE  50   5.775   3.730   6.221
  336    HB   ILE  50           HB       ILE  50   8.109   1.810   5.964
  337   1HG1  ILE  50          2HG1      ILE  50   6.232   0.360   4.923
  338   2HG1  ILE  50          1HG1      ILE  50   5.362   1.876   4.731
  339   1HG2  ILE  50          1HG2      ILE  50   7.111   1.625   8.159
  340   2HG2  ILE  50          2HG2      ILE  50   6.703   0.210   7.188
  341   3HG2  ILE  50          3HG2      ILE  50   5.505   1.479   7.444
  342   1HD1  ILE  50          1HD1      ILE  50   7.176   2.741   3.351
  343   2HD1  ILE  50          2HD1      ILE  50   6.511   1.246   2.690
  344   3HD1  ILE  50          3HD1      ILE  50   8.052   1.224   3.550
  345    H    ILE  51           H        ILE  51   5.811   4.999   7.984
  346    HA   ILE  51           HA       ILE  51   8.241   5.619   9.366
  347    HB   ILE  51           HB       ILE  51   6.709   6.680  11.072
  348   1HG1  ILE  51          2HG1      ILE  51   4.581   6.054   9.014
  349   2HG1  ILE  51          1HG1      ILE  51   4.731   5.248  10.574
  350   1HG2  ILE  51          1HG2      ILE  51   6.450   7.526   8.191
  351   2HG2  ILE  51          2HG2      ILE  51   7.750   7.961   9.300
  352   3HG2  ILE  51          3HG2      ILE  51   6.111   8.549   9.587
  353   1HD1  ILE  51          1HD1      ILE  51   4.373   7.404  11.693
  354   2HD1  ILE  51          2HD1      ILE  51   3.019   6.946  10.661
  355   3HD1  ILE  51          3HD1      ILE  51   4.167   8.169  10.118
  356    H    GLU  52           H        GLU  52   9.247   4.211  10.584
  357    HA   GLU  52           HA       GLU  52   7.652   2.287  12.128
  358   1HB   GLU  52          2HB       GLU  52   9.567   0.686  11.771
  359   2HB   GLU  52          1HB       GLU  52   8.627   1.066  10.334
  360   1HG   GLU  52          2HG       GLU  52  10.330   2.587   9.569
  361   2HG   GLU  52          1HG       GLU  52  11.252   2.351  11.053
  362    H    ARG  53           H        ARG  53   8.027   2.181  14.222
  363    HA   ARG  53           HA       ARG  53   9.032   2.259  16.249
  364   1HB   ARG  53          2HB       ARG  53  10.872   1.054  15.191
  365   2HB   ARG  53          1HB       ARG  53  11.573   2.563  14.634
  366   1HG   ARG  53          2HG       ARG  53  12.091   3.221  16.875
  367   2HG   ARG  53          1HG       ARG  53  11.215   1.837  17.531
  368   1HD   ARG  53          2HD       ARG  53  13.657   1.508  17.544
  369   2HD   ARG  53          1HD       ARG  53  12.818   0.311  16.560
  370    HE   ARG  53           HE       ARG  53  13.564   1.547  14.592
  371   1HH1  ARG  53          1HH1      ARG  53  15.185   2.243  17.633
  372   2HH1  ARG  53          2HH1      ARG  53  16.659   2.764  16.867
  373   1HH2  ARG  53          1HH2      ARG  53  15.518   2.206  13.602
  374   2HH2  ARG  53          2HH2      ARG  53  16.837   2.749  14.591
  Start of MODEL   17
    1    H    ASP   4           H        ASP   4  -2.914   0.570  15.588
    2    HA   ASP   4           HA       ASP   4  -0.490   1.785  16.173
    3   1HB   ASP   4          2HB       ASP   4  -1.288  -0.469  16.939
    4   2HB   ASP   4          1HB       ASP   4  -0.874  -1.092  15.346
    5    H    TYR   5           H        TYR   5  -1.424   0.048  13.214
    6    HA   TYR   5           HA       TYR   5   1.135   0.853  12.038
    7   1HB   TYR   5          2HB       TYR   5  -0.880  -1.145  10.999
    8   2HB   TYR   5          1HB       TYR   5   0.704  -0.814  10.311
    9    HD1  TYR   5           HD2      TYR   5   2.729  -1.617  11.405
   10    HD2  TYR   5           HD1      TYR   5  -1.116  -2.456  13.004
   11    HE1  TYR   5           HE2      TYR   5   3.708  -3.372  12.824
   12    HE2  TYR   5           HE1      TYR   5  -0.155  -4.211  14.422
   13    HH   TYR   5           HH       TYR   5   1.862  -5.697  14.396
   14    H    VAL   6           H        VAL   6   1.261   2.302  10.476
   15    HA   VAL   6           HA       VAL   6  -1.100   2.983   8.916
   16    HB   VAL   6           HB       VAL   6  -1.104   4.641  10.704
   17   1HG1  VAL   6          1HG1      VAL   6   1.711   5.282   9.840
   18   2HG1  VAL   6          2HG1      VAL   6   1.219   4.550  11.368
   19   3HG1  VAL   6          3HG1      VAL   6   0.759   6.211  10.999
   20   1HG2  VAL   6          1HG2      VAL   6  -0.153   5.789   8.078
   21   2HG2  VAL   6          2HG2      VAL   6  -0.973   6.695   9.349
   22   3HG2  VAL   6          3HG2      VAL   6  -1.816   5.392   8.514
   23    H    MET   7           H        MET   7  -0.641   3.253   6.833
   24    HA   MET   7           HA       MET   7   2.177   3.074   6.056
   25   1HB   MET   7          2HB       MET   7   0.536   1.399   5.172
   26   2HB   MET   7          1HB       MET   7  -0.298   2.707   4.351
   27   1HG   MET   7          2HG       MET   7   2.606   2.225   3.844
   28   2HG   MET   7          1HG       MET   7   1.386   1.235   3.052
   29   1HE   MET   7          1HE       MET   7  -0.440   2.167   1.405
   30   2HE   MET   7          2HE       MET   7  -0.626   3.872   0.998
   31   3HE   MET   7          3HE       MET   7  -0.988   3.311   2.631
   32    H    ALA   8           H        ALA   8   3.182   4.863   5.528
   33    HA   ALA   8           HA       ALA   8   1.657   7.256   4.868
   34   1HB   ALA   8          1HB       ALA   8   3.772   8.437   5.195
   35   2HB   ALA   8          2HB       ALA   8   4.603   6.898   5.415
   36   3HB   ALA   8          3HB       ALA   8   3.391   7.421   6.584
   37    H    THR   9           H        THR   9   1.461   7.977   2.851
   38    HA   THR   9           HA       THR   9   2.952   6.607   0.740
   39    HB   THR   9           HB       THR   9   1.383   7.754  -0.794
   40    HG1  THR   9           HG1      THR   9  -0.029   8.570   1.544
   41   1HG2  THR   9          1HG2      THR   9   0.830   5.522   0.023
   42   2HG2  THR   9          2HG2      THR   9  -0.632   6.494  -0.156
   43   3HG2  THR   9          3HG2      THR   9   0.058   6.222   1.445
   44    H    LYS  10           H        LYS  10   3.761   7.906  -1.094
   45    HA   LYS  10           HA       LYS  10   5.151  10.293  -0.249
   46   1HB   LYS  10          2HB       LYS  10   6.130   8.657  -1.866
   47   2HB   LYS  10          1HB       LYS  10   4.881   9.097  -3.023
   48   1HG   LYS  10          2HG       LYS  10   5.752  11.313  -3.223
   49   2HG   LYS  10          1HG       LYS  10   6.871  11.048  -1.885
   50   1HD   LYS  10          2HD       LYS  10   8.020  10.905  -4.033
   51   2HD   LYS  10          1HD       LYS  10   8.042   9.351  -3.195
   52   1HE   LYS  10          2HE       LYS  10   6.097   8.648  -4.577
   53   2HE   LYS  10          1HE       LYS  10   6.235  10.160  -5.473
   54   1HZ   LYS  10          1HZ       LYS  10   8.414   9.518  -6.226
   55   2HZ   LYS  10          2HZ       LYS  10   7.322   8.275  -6.575
   56   3HZ   LYS  10          3HZ       LYS  10   8.386   8.119  -5.266
   57    H    ASP  11           H        ASP  11   2.173   9.438  -1.638
   58    HA   ASP  11           HA       ASP  11   1.415  11.812  -2.937
   59   1HB   ASP  11          2HB       ASP  11   0.106   9.804  -3.214
   60   2HB   ASP  11          1HB       ASP  11  -0.205   9.710  -1.485
   61    H    GLY  12           H        GLY  12   1.139  10.753   0.424
   62   1HA   GLY  12          2HA       GLY  12   1.619  12.615   2.045
   63   2HA   GLY  12          1HA       GLY  12   0.384  13.510   1.166
   64    H    ARG  13           H        ARG  13  -1.125  10.946   0.813
   65    HA   ARG  13           HA       ARG  13  -2.805  11.200   3.084
   66   1HB   ARG  13          2HB       ARG  13  -4.020   9.261   2.068
   67   2HB   ARG  13          1HB       ARG  13  -3.791  10.624   0.980
   68   1HG   ARG  13          2HG       ARG  13  -1.864   9.450  -0.026
   69   2HG   ARG  13          1HG       ARG  13  -2.207   8.064   1.010
   70   1HD   ARG  13          2HD       ARG  13  -4.347   7.751  -0.022
   71   2HD   ARG  13          1HD       ARG  13  -4.171   9.245  -0.942
   72    HE   ARG  13           HE       ARG  13  -2.105   7.293  -1.440
   73   1HH1  ARG  13          1HH1      ARG  13  -5.254   8.499  -2.365
   74   2HH1  ARG  13          2HH1      ARG  13  -5.212   7.781  -3.952
   75   1HH2  ARG  13          1HH2      ARG  13  -1.996   6.391  -3.541
   76   2HH2  ARG  13          2HH2      ARG  13  -3.338   6.627  -4.630
   77    H    MET  14           H        MET  14  -3.142   9.858   4.793
   78    HA   MET  14           HA       MET  14  -1.086   7.797   5.275
   79   1HB   MET  14          2HB       MET  14  -2.750   9.358   7.267
   80   2HB   MET  14          1HB       MET  14  -1.565   8.127   7.677
   81   1HG   MET  14          2HG       MET  14  -0.962  10.721   6.273
   82   2HG   MET  14          1HG       MET  14  -0.723  10.407   7.990
   83   1HE   MET  14          1HE       MET  14   1.528  11.493   5.958
   84   2HE   MET  14          2HE       MET  14   2.924  10.571   6.519
   85   3HE   MET  14          3HE       MET  14   1.794  11.262   7.686
   86    H    ILE  15           H        ILE  15  -1.791   5.763   5.168
   87    HA   ILE  15           HA       ILE  15  -4.684   5.295   5.482
   88    HB   ILE  15           HB       ILE  15  -2.635   3.674   3.962
   89   1HG1  ILE  15          2HG1      ILE  15  -4.987   5.325   3.006
   90   2HG1  ILE  15          1HG1      ILE  15  -3.293   5.787   2.865
   91   1HG2  ILE  15          1HG2      ILE  15  -5.604   3.213   4.256
   92   2HG2  ILE  15          2HG2      ILE  15  -4.330   2.245   4.997
   93   3HG2  ILE  15          3HG2      ILE  15  -4.500   2.282   3.243
   94   1HD1  ILE  15          1HD1      ILE  15  -4.116   4.947   0.760
   95   2HD1  ILE  15          2HD1      ILE  15  -4.624   3.442   1.526
   96   3HD1  ILE  15          3HD1      ILE  15  -2.910   3.842   1.419
   97    H    LEU  16           H        LEU  16  -5.346   4.151   7.195
   98    HA   LEU  16           HA       LEU  16  -3.509   3.039   9.065
   99   1HB   LEU  16          2HB       LEU  16  -6.508   2.789   8.811
  100   2HB   LEU  16          1HB       LEU  16  -5.594   2.061  10.116
  101    HG   LEU  16           HG       LEU  16  -6.488   4.038  11.008
  102   1HD1  LEU  16          1HD1      LEU  16  -3.657   4.629  10.170
  103   2HD1  LEU  16          2HD1      LEU  16  -4.168   3.730  11.599
  104   3HD1  LEU  16          3HD1      LEU  16  -4.537   5.449  11.461
  105   1HD2  LEU  16          1HD2      LEU  16  -6.325   6.227   9.958
  106   2HD2  LEU  16          2HD2      LEU  16  -7.174   5.084   8.916
  107   3HD2  LEU  16          3HD2      LEU  16  -5.497   5.514   8.575
  108    H    THR  17           H        THR  17  -2.895   0.952   9.383
  109    HA   THR  17           HA       THR  17  -3.925  -1.097   7.562
  110    HB   THR  17           HB       THR  17  -1.471  -1.792   7.166
  111    HG1  THR  17           HG1      THR  17  -1.159   0.685   8.425
  112   1HG2  THR  17          1HG2      THR  17  -2.870  -0.855   5.379
  113   2HG2  THR  17          2HG2      THR  17  -1.212  -0.270   5.248
  114   3HG2  THR  17          3HG2      THR  17  -2.467   0.778   5.908
  115    H    ASP  18           H        ASP  18  -3.150  -3.307   8.222
  116    HA   ASP  18           HA       ASP  18  -2.449  -3.473  11.055
  117   1HB   ASP  18          2HB       ASP  18  -4.055  -5.128  10.025
  118   2HB   ASP  18          1HB       ASP  18  -2.715  -5.741   9.058
  119    H    GLY  19           H        GLY  19  -1.057  -2.975   8.146
  120   1HA   GLY  19          2HA       GLY  19   1.237  -2.210   8.184
  121   2HA   GLY  19          1HA       GLY  19   1.611  -3.564   9.246
  122    H    LYS  20           H        LYS  20   3.318  -3.613   7.279
  123    HA   LYS  20           HA       LYS  20   4.144  -5.334   6.055
  124   1HB   LYS  20          2HB       LYS  20   1.494  -6.664   6.579
  125   2HB   LYS  20          1HB       LYS  20   2.896  -7.445   5.861
  126   1HG   LYS  20          2HG       LYS  20   4.155  -6.841   7.966
  127   2HG   LYS  20          1HG       LYS  20   2.596  -6.388   8.658
  128   1HD   LYS  20          2HD       LYS  20   1.782  -8.685   8.139
  129   2HD   LYS  20          1HD       LYS  20   3.424  -9.102   7.640
  130   1HE   LYS  20          2HE       LYS  20   4.222  -8.467   9.898
  131   2HE   LYS  20          1HE       LYS  20   2.548  -8.184  10.377
  132   1HZ   LYS  20          1HZ       LYS  20   2.161 -10.573   9.658
  133   2HZ   LYS  20          2HZ       LYS  20   3.024 -10.328  11.094
  134   3HZ   LYS  20          3HZ       LYS  20   3.852 -10.742   9.671
  135    HA   PRO  21           HA       PRO  21   2.021  -3.909   2.239
  136   1HB   PRO  21          2HB       PRO  21   4.526  -2.653   1.522
  137   2HB   PRO  21          1HB       PRO  21   2.951  -1.901   1.774
  138   1HG   PRO  21          2HG       PRO  21   5.090  -1.527   3.420
  139   2HG   PRO  21          1HG       PRO  21   3.405  -1.378   3.944
  140   1HD   PRO  21          2HD       PRO  21   5.308  -3.657   4.320
  141   2HD   PRO  21          1HD       PRO  21   4.102  -2.995   5.445
  142    H    GLU  22           H        GLU  22   2.005  -5.851   1.240
  143    HA   GLU  22           HA       GLU  22   4.450  -7.261   0.627
  144   1HB   GLU  22          2HB       GLU  22   2.308  -8.400   1.256
  145   2HB   GLU  22          1HB       GLU  22   1.630  -7.862  -0.273
  146   1HG   GLU  22          2HG       GLU  22   3.261  -9.158  -1.491
  147   2HG   GLU  22          1HG       GLU  22   4.037  -9.642   0.019
  148    H    ILE  23           H        ILE  23   5.677  -6.425  -0.934
  149    HA   ILE  23           HA       ILE  23   4.510  -4.861  -3.052
  150    HB   ILE  23           HB       ILE  23   7.401  -5.704  -2.788
  151   1HG1  ILE  23          2HG1      ILE  23   6.036  -3.198  -1.765
  152   2HG1  ILE  23          1HG1      ILE  23   6.600  -4.526  -0.755
  153   1HG2  ILE  23          1HG2      ILE  23   6.747  -4.871  -4.999
  154   2HG2  ILE  23          2HG2      ILE  23   7.828  -3.739  -4.186
  155   3HG2  ILE  23          3HG2      ILE  23   6.096  -3.410  -4.256
  156   1HD1  ILE  23          1HD1      ILE  23   8.322  -2.739  -2.460
  157   2HD1  ILE  23          2HD1      ILE  23   8.894  -4.076  -1.460
  158   3HD1  ILE  23          3HD1      ILE  23   8.151  -2.666  -0.705
  159    H    ASP  24           H        ASP  24   3.503  -5.866  -4.607
  160    HA   ASP  24           HA       ASP  24   4.221  -8.497  -5.527
  161   1HB   ASP  24          2HB       ASP  24   1.890  -7.936  -5.439
  162   2HB   ASP  24          1HB       ASP  24   2.145  -6.475  -6.386
  163    H    ASP  25           H        ASP  25   5.362  -9.022  -7.331
  164    HA   ASP  25           HA       ASP  25   6.502  -6.763  -8.850
  165   1HB   ASP  25          2HB       ASP  25   8.075  -8.239  -7.548
  166   2HB   ASP  25          1HB       ASP  25   7.625  -9.565  -8.615
  167    H    ASP  26           H        ASP  26   4.015  -8.674  -9.168
  168    HA   ASP  26           HA       ASP  26   4.465  -9.640 -11.879
  169   1HB   ASP  26          2HB       ASP  26   3.179 -11.078 -10.422
  170   2HB   ASP  26          1HB       ASP  26   2.067  -9.772 -10.039
  171    H    THR  27           H        THR  27   2.409  -7.305 -10.186
  172    HA   THR  27           HA       THR  27   2.077  -5.878 -12.750
  173    HB   THR  27           HB       THR  27  -0.079  -6.461 -11.847
  174    HG1  THR  27           HG1      THR  27   0.692  -3.753 -11.707
  175   1HG2  THR  27          1HG2      THR  27   0.579  -6.785  -9.502
  176   2HG2  THR  27          2HG2      THR  27  -0.842  -5.749  -9.647
  177   3HG2  THR  27          3HG2      THR  27   0.738  -5.038  -9.316
  178    H    GLY  28           H        GLY  28   3.468  -5.782  -9.621
  179   1HA   GLY  28          2HA       GLY  28   5.067  -4.254  -8.878
  180   2HA   GLY  28          1HA       GLY  28   4.637  -3.192 -10.213
  181    H    LEU  29           H        LEU  29   2.386  -4.587  -7.902
  182    HA   LEU  29           HA       LEU  29   1.840  -1.864  -6.934
  183   1HB   LEU  29          2HB       LEU  29  -0.056  -4.211  -7.072
  184   2HB   LEU  29          1HB       LEU  29  -0.449  -2.620  -6.456
  185    HG   LEU  29           HG       LEU  29   0.141  -3.384  -9.309
  186   1HD1  LEU  29          1HD1      LEU  29  -2.110  -2.506  -9.698
  187   2HD1  LEU  29          2HD1      LEU  29  -2.280  -2.190  -7.973
  188   3HD1  LEU  29          3HD1      LEU  29  -2.117  -3.847  -8.552
  189   1HD2  LEU  29          1HD2      LEU  29  -0.243  -0.621  -8.163
  190   2HD2  LEU  29          2HD2      LEU  29  -0.160  -1.029  -9.877
  191   3HD2  LEU  29          3HD2      LEU  29   1.249  -1.270  -8.844
  192    H    VAL  30           H        VAL  30   1.172  -1.670  -4.709
  193    HA   VAL  30           HA       VAL  30   2.624  -3.592  -3.023
  194    HB   VAL  30           HB       VAL  30   1.783  -0.751  -2.439
  195   1HG1  VAL  30          1HG1      VAL  30   3.159  -0.955  -0.428
  196   2HG1  VAL  30          2HG1      VAL  30   3.456  -2.652  -0.808
  197   3HG1  VAL  30          3HG1      VAL  30   1.824  -2.108  -0.420
  198   1HG2  VAL  30          1HG2      VAL  30   4.524  -1.882  -2.966
  199   2HG2  VAL  30          2HG2      VAL  30   4.139  -0.204  -2.585
  200   3HG2  VAL  30          3HG2      VAL  30   3.580  -0.915  -4.099
  201    H    SER  31           H        SER  31   1.355  -5.061  -2.107
  202    HA   SER  31           HA       SER  31  -1.446  -4.550  -1.632
  203   1HB   SER  31          2HB       SER  31   0.189  -6.976  -0.874
  204   2HB   SER  31          1HB       SER  31  -1.567  -6.878  -0.983
  205    HG   SER  31           HG       SER  31  -1.173  -7.603  -2.937
  206    H    TYR  32           H        TYR  32  -2.055  -3.442   0.090
  207    HA   TYR  32           HA       TYR  32  -0.559  -3.793   2.604
  208   1HB   TYR  32          2HB       TYR  32  -1.346  -1.579   3.271
  209   2HB   TYR  32          1HB       TYR  32  -0.493  -1.486   1.738
  210    HD1  TYR  32           HD1      TYR  32  -2.162  -1.792  -0.380
  211    HD2  TYR  32           HD2      TYR  32  -3.272  -0.319   3.454
  212    HE1  TYR  32           HE1      TYR  32  -4.081  -0.631  -1.385
  213    HE2  TYR  32           HE2      TYR  32  -5.193   0.839   2.451
  214    HH   TYR  32           HH       TYR  32  -6.235   0.274  -0.744
  215    H    HIS  33           H        HIS  33  -1.765  -3.986   4.544
  216    HA   HIS  33           HA       HIS  33  -4.372  -5.240   4.049
  217   1HB   HIS  33          2HB       HIS  33  -2.441  -5.580   6.360
  218   2HB   HIS  33          1HB       HIS  33  -3.994  -6.399   6.216
  219    HD1  HIS  33           HD1      HIS  33  -0.469  -6.648   5.210
  220    HD2  HIS  33           HD2      HIS  33  -4.107  -8.271   4.015
  221    HE1  HIS  33           HE1      HIS  33   0.113  -8.630   3.772
  222    HE2  HIS  33           HE2      HIS  33  -2.102  -9.475   2.906
  223    H    ASP  34           H        ASP  34  -6.128  -4.304   4.707
  224    HA   ASP  34           HA       ASP  34  -6.247  -1.761   5.880
  225   1HB   ASP  34          2HB       ASP  34  -8.105  -3.739   4.905
  226   2HB   ASP  34          1HB       ASP  34  -8.702  -3.024   6.395
  227    H    GLN  35           H        GLN  35  -7.161  -1.091   7.869
  228    HA   GLN  35           HA       GLN  35  -6.614  -2.698  10.182
  229   1HB   GLN  35          2HB       GLN  35  -6.531  -0.206  10.184
  230   2HB   GLN  35          1HB       GLN  35  -8.263  -0.168   9.908
  231   1HG   GLN  35          2HG       GLN  35  -7.824   0.275  12.214
  232   2HG   GLN  35          1HG       GLN  35  -8.601  -1.301  12.070
  233   1HE2  GLN  35          1HE2      GLN  35  -5.230  -0.753  11.310
  234   2HE2  GLN  35          2HE2      GLN  35  -4.584  -1.644  12.647
  235    H    GLN  36           H        GLN  36  -9.089  -2.455   7.911
  236    HA   GLN  36           HA       GLN  36 -11.205  -3.532   9.562
  237   1HB   GLN  36          2HB       GLN  36 -11.098  -3.226   6.553
  238   2HB   GLN  36          1HB       GLN  36 -12.533  -3.523   7.524
  239   1HG   GLN  36          2HG       GLN  36 -12.278  -1.341   8.570
  240   2HG   GLN  36          1HG       GLN  36 -10.831  -1.043   7.615
  241   1HE2  GLN  36          1HE2      GLN  36 -13.332   0.440   7.735
  242   2HE2  GLN  36          2HE2      GLN  36 -13.941   0.480   6.115
  243    H    GLY  37           H        GLY  37  -8.484  -4.786   8.150
  244   1HA   GLY  37          2HA       GLY  37  -7.820  -7.022   8.051
  245   2HA   GLY  37          1HA       GLY  37  -9.491  -7.503   8.322
  246    H    ASN  38           H        ASN  38  -8.391  -5.284   5.838
  247    HA   ASN  38           HA       ASN  38  -9.357  -7.175   3.796
  248   1HB   ASN  38          2HB       ASN  38  -9.027  -4.166   3.660
  249   2HB   ASN  38          1HB       ASN  38  -9.598  -5.180   2.343
  250   1HD2  ASN  38          1HD2      ASN  38 -10.779  -2.949   3.986
  251   2HD2  ASN  38          2HD2      ASN  38 -12.318  -3.568   4.489
  252    H    ALA  39           H        ALA  39  -8.172  -7.196   1.742
  253    HA   ALA  39           HA       ALA  39  -5.370  -6.327   2.012
  254   1HB   ALA  39          1HB       ALA  39  -4.704  -8.210   0.613
  255   2HB   ALA  39          2HB       ALA  39  -6.382  -8.744   0.517
  256   3HB   ALA  39          3HB       ALA  39  -5.536  -8.770   2.064
  257    H    MET  40           H        MET  40  -5.163  -4.564   0.813
  258    HA   MET  40           HA       MET  40  -6.386  -4.550  -1.867
  259   1HB   MET  40          2HB       MET  40  -6.038  -2.199   0.009
  260   2HB   MET  40          1HB       MET  40  -6.618  -2.090  -1.649
  261   1HG   MET  40          2HG       MET  40  -8.492  -3.587  -1.018
  262   2HG   MET  40          1HG       MET  40  -7.953  -3.490   0.655
  263   1HE   MET  40          1HE       MET  40  -8.582   0.245   1.547
  264   2HE   MET  40          2HE       MET  40  -7.075  -0.526   1.048
  265   3HE   MET  40          3HE       MET  40  -8.163  -1.354   2.164
  266    H    GLN  41           H        GLN  41  -5.211  -2.779  -3.282
  267    HA   GLN  41           HA       GLN  41  -2.319  -3.024  -2.776
  268   1HB   GLN  41          2HB       GLN  41  -3.714  -3.635  -5.392
  269   2HB   GLN  41          1HB       GLN  41  -1.970  -3.577  -5.165
  270   1HG   GLN  41          2HG       GLN  41  -2.127  -5.432  -3.571
  271   2HG   GLN  41          1HG       GLN  41  -3.868  -5.496  -3.828
  272   1HE2  GLN  41          1HE2      GLN  41  -1.590  -4.852  -6.388
  273   2HE2  GLN  41          2HE2      GLN  41  -1.811  -6.345  -7.226
  274    H    ILE  42           H        ILE  42  -1.242  -1.174  -3.031
  275    HA   ILE  42           HA       ILE  42  -2.494   0.976  -4.617
  276    HB   ILE  42           HB       ILE  42  -1.106   2.581  -3.457
  277   1HG1  ILE  42          2HG1      ILE  42  -0.075   0.478  -1.590
  278   2HG1  ILE  42          1HG1      ILE  42   0.753   0.784  -3.117
  279   1HG2  ILE  42          1HG2      ILE  42  -3.229   2.037  -2.411
  280   2HG2  ILE  42          2HG2      ILE  42  -2.011   2.417  -1.192
  281   3HG2  ILE  42          3HG2      ILE  42  -2.460   0.740  -1.495
  282   1HD1  ILE  42          1HD1      ILE  42   1.067   3.100  -2.515
  283   2HD1  ILE  42          2HD1      ILE  42   1.730   2.038  -1.267
  284   3HD1  ILE  42          3HD1      ILE  42   0.183   2.849  -1.009
  285    H    ASN  43           H        ASN  43  -0.494   2.536  -5.320
  286    HA   ASN  43           HA       ASN  43   0.953   0.899  -7.216
  287   1HB   ASN  43          2HB       ASN  43  -0.153   3.013  -7.888
  288   2HB   ASN  43          1HB       ASN  43   0.949   3.898  -6.846
  289   1HD2  ASN  43          1HD2      ASN  43   1.608   5.056  -8.685
  290   2HD2  ASN  43          2HD2      ASN  43   2.778   4.384  -9.772
  291    H    ARG  44           H        ARG  44   3.228   0.917  -7.473
  292    HA   ARG  44           HA       ARG  44   4.617   0.555  -5.052
  293   1HB   ARG  44          2HB       ARG  44   5.258  -0.711  -6.973
  294   2HB   ARG  44          1HB       ARG  44   5.567   0.746  -7.907
  295   1HG   ARG  44          2HG       ARG  44   7.425   1.279  -6.339
  296   2HG   ARG  44          1HG       ARG  44   7.161  -0.288  -5.575
  297   1HD   ARG  44          2HD       ARG  44   8.991  -0.228  -7.293
  298   2HD   ARG  44          1HD       ARG  44   7.748  -1.451  -7.558
  299    HE   ARG  44           HE       ARG  44   6.880  -0.147  -9.347
  300   1HH1  ARG  44          1HH1      ARG  44   9.819   1.196  -7.978
  301   2HH1  ARG  44          2HH1      ARG  44  10.227   2.096  -9.405
  302   1HH2  ARG  44          1HH2      ARG  44   7.391   1.038 -11.218
  303   2HH2  ARG  44          2HH2      ARG  44   8.829   2.021 -11.249
  304    H    ASP  45           H        ASP  45   4.717   3.260  -7.382
  305    HA   ASP  45           HA       ASP  45   6.729   4.546  -5.720
  306   1HB   ASP  45          2HB       ASP  45   6.928   6.217  -7.430
  307   2HB   ASP  45          1HB       ASP  45   6.897   4.641  -8.209
  308    H    ASP  46           H        ASP  46   3.547   4.197  -5.437
  309    HA   ASP  46           HA       ASP  46   2.911   6.925  -4.652
  310   1HB   ASP  46          2HB       ASP  46   1.205   5.475  -5.756
  311   2HB   ASP  46          1HB       ASP  46   1.249   4.409  -4.357
  312    H    VAL  47           H        VAL  47   3.686   3.824  -3.242
  313    HA   VAL  47           HA       VAL  47   3.154   4.554  -0.533
  314    HB   VAL  47           HB       VAL  47   3.205   2.197  -1.360
  315   1HG1  VAL  47          1HG1      VAL  47   5.350   1.059  -1.614
  316   2HG1  VAL  47          2HG1      VAL  47   6.188   2.598  -1.417
  317   3HG1  VAL  47          3HG1      VAL  47   5.143   2.335  -2.813
  318   1HG2  VAL  47          1HG2      VAL  47   3.346   2.630   1.021
  319   2HG2  VAL  47          2HG2      VAL  47   5.099   2.798   0.904
  320   3HG2  VAL  47          3HG2      VAL  47   4.339   1.239   0.585
  321    H    SER  48           H        SER  48   4.629   5.148   1.082
  322    HA   SER  48           HA       SER  48   7.264   6.005   0.097
  323   1HB   SER  48          2HB       SER  48   5.961   7.958   0.626
  324   2HB   SER  48          1HB       SER  48   5.479   7.283   2.181
  325    HG   SER  48           HG       SER  48   7.127   8.538   2.760
  326    H    GLN  49           H        GLN  49   5.870   5.616   3.371
  327    HA   GLN  49           HA       GLN  49   7.814   3.517   3.941
  328   1HB   GLN  49          2HB       GLN  49   7.712   6.091   5.539
  329   2HB   GLN  49          1HB       GLN  49   8.683   4.679   5.937
  330   1HG   GLN  49          2HG       GLN  49   9.930   4.978   3.836
  331   2HG   GLN  49          1HG       GLN  49   8.979   6.422   3.500
  332   1HE2  GLN  49          1HE2      GLN  49  10.091   5.542   6.698
  333   2HE2  GLN  49          2HE2      GLN  49  11.252   6.819   6.851
  334    H    ILE  50           H        ILE  50   7.311   2.297   5.817
  335    HA   ILE  50           HA       ILE  50   4.546   2.415   6.653
  336    HB   ILE  50           HB       ILE  50   6.759   0.631   7.707
  337   1HG1  ILE  50          2HG1      ILE  50   5.432  -1.111   6.293
  338   2HG1  ILE  50          1HG1      ILE  50   4.827   0.292   5.423
  339   1HG2  ILE  50          1HG2      ILE  50   4.949  -0.762   8.560
  340   2HG2  ILE  50          2HG2      ILE  50   3.764   0.388   7.943
  341   3HG2  ILE  50          3HG2      ILE  50   4.866   0.866   9.234
  342   1HD1  ILE  50          1HD1      ILE  50   7.096   0.905   4.809
  343   2HD1  ILE  50          2HD1      ILE  50   6.723  -0.741   4.296
  344   3HD1  ILE  50          3HD1      ILE  50   7.723  -0.467   5.723
  345    H    ILE  51           H        ILE  51   4.020   3.968   8.013
  346    HA   ILE  51           HA       ILE  51   4.063   5.570   9.579
  347    HB   ILE  51           HB       ILE  51   4.553   3.347  10.998
  348   1HG1  ILE  51          2HG1      ILE  51   4.723   6.153  12.120
  349   2HG1  ILE  51          1HG1      ILE  51   3.232   5.331  11.675
  350   1HG2  ILE  51          1HG2      ILE  51   6.982   3.505  10.847
  351   2HG2  ILE  51          2HG2      ILE  51   6.437   3.684  12.514
  352   3HG2  ILE  51          3HG2      ILE  51   6.933   5.103  11.591
  353   1HD1  ILE  51          1HD1      ILE  51   5.144   4.477  13.835
  354   2HD1  ILE  51          2HD1      ILE  51   3.659   3.641  13.384
  355   3HD1  ILE  51          3HD1      ILE  51   3.584   5.265  14.070
  356    H    GLU  52           H        GLU  52   5.484   7.198  10.718
  357    HA   GLU  52           HA       GLU  52   7.347   8.090   8.743
  358   1HB   GLU  52          2HB       GLU  52   6.478   9.290  11.367
  359   2HB   GLU  52          1HB       GLU  52   7.563  10.086  10.233
  360   1HG   GLU  52          2HG       GLU  52   5.849  10.116   8.543
  361   2HG   GLU  52          1HG       GLU  52   4.766   9.192   9.583
  362    H    ARG  53           H        ARG  53   9.237   7.175   8.627
  363    HA   ARG  53           HA       ARG  53  11.437   6.825   9.050
  364   1HB   ARG  53          2HB       ARG  53  11.007   8.190  11.707
  365   2HB   ARG  53          1HB       ARG  53  12.536   7.950  10.873
  366   1HG   ARG  53          2HG       ARG  53  11.774   9.433   9.073
  367   2HG   ARG  53          1HG       ARG  53  10.261   9.689   9.944
  368   1HD   ARG  53          2HD       ARG  53  11.715  10.467  11.888
  369   2HD   ARG  53          1HD       ARG  53  13.035  10.537  10.720
  370    HE   ARG  53           HE       ARG  53  10.575  11.984  10.083
  371   1HH1  ARG  53          1HH1      ARG  53  13.940  12.074  11.069
  372   2HH1  ARG  53          2HH1      ARG  53  14.073  13.801  10.882
  373   1HH2  ARG  53          1HH2      ARG  53  10.750  14.214   9.801
  374   2HH2  ARG  53          2HH2      ARG  53  12.255  15.026  10.137
  Start of MODEL   18
    1    H    ASP   4           H        ASP   4   2.860  -1.514  17.056
    2    HA   ASP   4           HA       ASP   4   0.444  -0.832  15.620
    3   1HB   ASP   4          2HB       ASP   4   1.154   0.512  17.562
    4   2HB   ASP   4          1HB       ASP   4   2.656   0.916  16.739
    5    H    TYR   5           H        TYR   5   0.335  -0.386  13.495
    6    HA   TYR   5           HA       TYR   5   2.872   0.015  12.059
    7   1HB   TYR   5          2HB       TYR   5   0.477  -1.520  11.054
    8   2HB   TYR   5          1HB       TYR   5   1.974  -1.246  10.176
    9    HD1  TYR   5           HD2      TYR   5   4.117  -2.274  11.134
   10    HD2  TYR   5           HD1      TYR   5   0.218  -3.376  12.427
   11    HE1  TYR   5           HE2      TYR   5   5.010  -4.396  12.002
   12    HE2  TYR   5           HE1      TYR   5   1.098  -5.500  13.294
   13    HH   TYR   5           HH       TYR   5   3.032  -6.991  12.863
   14    H    VAL   6           H        VAL   6   2.727   1.228  10.101
   15    HA   VAL   6           HA       VAL   6   0.290   2.528   9.362
   16    HB   VAL   6           HB       VAL   6   0.995   3.869  11.332
   17   1HG1  VAL   6          1HG1      VAL   6   2.952   5.323  11.182
   18   2HG1  VAL   6          2HG1      VAL   6   3.405   4.554   9.662
   19   3HG1  VAL   6          3HG1      VAL   6   3.405   3.620  11.158
   20   1HG2  VAL   6          1HG2      VAL   6  -0.327   4.880   9.555
   21   2HG2  VAL   6          2HG2      VAL   6   1.151   5.328   8.703
   22   3HG2  VAL   6          3HG2      VAL   6   0.782   6.051  10.269
   23    H    MET   7           H        MET   7   0.446   3.506   7.330
   24    HA   MET   7           HA       MET   7   3.065   3.420   6.008
   25   1HB   MET   7          2HB       MET   7   1.820   1.317   5.524
   26   2HB   MET   7          1HB       MET   7   0.518   2.275   4.837
   27   1HG   MET   7          2HG       MET   7   3.321   2.406   3.778
   28   2HG   MET   7          1HG       MET   7   2.173   1.183   3.246
   29   1HE   MET   7          1HE       MET   7  -0.074   1.718   1.943
   30   2HE   MET   7          2HE       MET   7  -0.636   3.357   1.607
   31   3HE   MET   7          3HE       MET   7  -0.563   2.772   3.269
   32    H    ALA   8           H        ALA   8   3.438   5.391   5.265
   33    HA   ALA   8           HA       ALA   8   1.154   7.079   4.496
   34   1HB   ALA   8          1HB       ALA   8   2.633   8.984   4.803
   35   2HB   ALA   8          2HB       ALA   8   3.987   7.905   5.140
   36   3HB   ALA   8          3HB       ALA   8   2.622   7.983   6.254
   37    H    THR   9           H        THR   9   0.820   7.460   2.395
   38    HA   THR   9           HA       THR   9   2.730   6.442   0.481
   39    HB   THR   9           HB       THR   9   1.073   7.012  -1.222
   40    HG1  THR   9           HG1      THR   9  -0.567   8.315  -0.832
   41   1HG2  THR   9          1HG2      THR   9  -0.192   5.693   1.180
   42   2HG2  THR   9          2HG2      THR   9   0.828   4.894  -0.017
   43   3HG2  THR   9          3HG2      THR   9  -0.741   5.549  -0.491
   44    H    LYS  10           H        LYS  10   3.066   7.872  -1.544
   45    HA   LYS  10           HA       LYS  10   4.477  10.204  -0.661
   46   1HB   LYS  10          2HB       LYS  10   5.301   8.676  -2.434
   47   2HB   LYS  10          1HB       LYS  10   3.978   9.190  -3.468
   48   1HG   LYS  10          2HG       LYS  10   4.933  11.196  -3.932
   49   2HG   LYS  10          1HG       LYS  10   5.773  11.283  -2.383
   50   1HD   LYS  10          2HD       LYS  10   7.286  10.945  -4.331
   51   2HD   LYS  10          1HD       LYS  10   7.406   9.682  -3.107
   52   1HE   LYS  10          2HE       LYS  10   5.850   8.303  -4.499
   53   2HE   LYS  10          1HE       LYS  10   5.970   9.535  -5.754
   54   1HZ   LYS  10          1HZ       LYS  10   8.302   9.131  -5.956
   55   2HZ   LYS  10          2HZ       LYS  10   7.512   7.636  -6.057
   56   3HZ   LYS  10          3HZ       LYS  10   8.299   8.084  -4.626
   57    H    ASP  11           H        ASP  11   1.292   9.706  -1.239
   58    HA   ASP  11           HA       ASP  11   0.576  12.174  -2.507
   59   1HB   ASP  11          2HB       ASP  11  -1.089  10.439  -0.665
   60   2HB   ASP  11          1HB       ASP  11  -1.694  11.687  -1.750
   61    H    GLY  12           H        GLY  12   1.125  11.063   0.763
   62   1HA   GLY  12          2HA       GLY  12   1.810  12.731   2.424
   63   2HA   GLY  12          1HA       GLY  12   0.592  13.799   1.740
   64    H    ARG  13           H        ARG  13  -0.818  10.897   1.626
   65    HA   ARG  13           HA       ARG  13  -2.360  11.402   4.027
   66   1HB   ARG  13          2HB       ARG  13  -3.849   9.623   3.184
   67   2HB   ARG  13          1HB       ARG  13  -3.577  10.881   1.985
   68   1HG   ARG  13          2HG       ARG  13  -1.858   9.405   0.942
   69   2HG   ARG  13          1HG       ARG  13  -2.353   8.135   2.060
   70   1HD   ARG  13          2HD       ARG  13  -4.153   9.505   0.063
   71   2HD   ARG  13          1HD       ARG  13  -3.418   7.920  -0.152
   72    HE   ARG  13           HE       ARG  13  -5.017   8.169   2.230
   73   1HH1  ARG  13          1HH1      ARG  13  -5.017   7.378  -1.180
   74   2HH1  ARG  13          2HH1      ARG  13  -6.475   6.439  -1.083
   75   1HH2  ARG  13          1HH2      ARG  13  -6.937   6.900   2.351
   76   2HH2  ARG  13          2HH2      ARG  13  -7.554   6.167   0.899
   77    H    MET  14           H        MET  14  -2.416  10.148   5.823
   78    HA   MET  14           HA       MET  14  -0.335   8.080   5.996
   79   1HB   MET  14          2HB       MET  14  -0.218  10.010   7.569
   80   2HB   MET  14          1HB       MET  14  -1.771   9.517   8.234
   81   1HG   MET  14          2HG       MET  14  -0.809   7.403   8.950
   82   2HG   MET  14          1HG       MET  14   0.744   7.866   8.256
   83   1HE   MET  14          1HE       MET  14   0.872  10.966   9.016
   84   2HE   MET  14          2HE       MET  14   2.241   9.870   9.188
   85   3HE   MET  14          3HE       MET  14   1.756  10.899  10.539
   86    H    ILE  15           H        ILE  15  -1.113   6.132   5.590
   87    HA   ILE  15           HA       ILE  15  -3.892   5.497   6.259
   88    HB   ILE  15           HB       ILE  15  -1.897   4.053   4.501
   89   1HG1  ILE  15          2HG1      ILE  15  -4.348   5.676   3.776
   90   2HG1  ILE  15          1HG1      ILE  15  -2.681   6.205   3.582
   91   1HG2  ILE  15          1HG2      ILE  15  -4.818   3.465   4.968
   92   2HG2  ILE  15          2HG2      ILE  15  -3.453   2.476   5.486
   93   3HG2  ILE  15          3HG2      ILE  15  -3.792   2.680   3.768
   94   1HD1  ILE  15          1HD1      ILE  15  -3.942   3.860   2.184
   95   2HD1  ILE  15          2HD1      ILE  15  -2.290   4.438   1.964
   96   3HD1  ILE  15          3HD1      ILE  15  -3.653   5.449   1.479
   97    H    LEU  16           H        LEU  16  -4.447   3.977   7.719
   98    HA   LEU  16           HA       LEU  16  -2.356   2.765   9.327
   99   1HB   LEU  16          2HB       LEU  16  -5.370   2.701   9.532
  100   2HB   LEU  16          1HB       LEU  16  -4.318   1.794  10.600
  101    HG   LEU  16           HG       LEU  16  -4.945   3.728  11.792
  102   1HD1  LEU  16          1HD1      LEU  16  -2.212   4.251  10.631
  103   2HD1  LEU  16          2HD1      LEU  16  -2.576   3.169  11.975
  104   3HD1  LEU  16          3HD1      LEU  16  -2.841   4.905  12.143
  105   1HD2  LEU  16          1HD2      LEU  16  -4.676   6.010  10.922
  106   2HD2  LEU  16          2HD2      LEU  16  -5.815   5.062   9.965
  107   3HD2  LEU  16          3HD2      LEU  16  -4.181   5.344   9.365
  108    H    THR  17           H        THR  17  -1.534   0.839   8.898
  109    HA   THR  17           HA       THR  17  -3.014  -0.920   7.048
  110    HB   THR  17           HB       THR  17  -0.662  -1.649   6.307
  111    HG1  THR  17           HG1      THR  17   0.255  -0.382   8.177
  112   1HG2  THR  17          1HG2      THR  17  -1.531   1.180   5.686
  113   2HG2  THR  17          2HG2      THR  17  -2.167  -0.269   4.913
  114   3HG2  THR  17          3HG2      THR  17  -0.474   0.174   4.697
  115    H    ASP  18           H        ASP  18  -3.130  -3.063   7.550
  116    HA   ASP  18           HA       ASP  18  -1.932  -4.208   9.849
  117   1HB   ASP  18          2HB       ASP  18  -3.778  -5.351   8.734
  118   2HB   ASP  18          1HB       ASP  18  -2.848  -5.473   7.247
  119    H    GLY  19           H        GLY  19   0.205  -4.409  10.165
  120   1HA   GLY  19          2HA       GLY  19   1.904  -3.236   8.241
  121   2HA   GLY  19          1HA       GLY  19   2.435  -4.012   9.726
  122    H    LYS  20           H        LYS  20   3.768  -4.119   7.104
  123    HA   LYS  20           HA       LYS  20   4.999  -5.793   6.151
  124   1HB   LYS  20          2HB       LYS  20   3.312  -7.634   7.832
  125   2HB   LYS  20          1HB       LYS  20   4.453  -8.236   6.638
  126   1HG   LYS  20          2HG       LYS  20   6.287  -7.150   7.806
  127   2HG   LYS  20          1HG       LYS  20   5.159  -6.462   8.977
  128   1HD   LYS  20          2HD       LYS  20   4.634  -8.612   9.852
  129   2HD   LYS  20          1HD       LYS  20   5.452  -9.428   8.519
  130   1HE   LYS  20          2HE       LYS  20   6.849  -9.565  10.463
  131   2HE   LYS  20          1HE       LYS  20   7.600  -8.459   9.318
  132   1HZ   LYS  20          1HZ       LYS  20   7.763  -7.527  11.482
  133   2HZ   LYS  20          2HZ       LYS  20   6.114  -7.744  11.786
  134   3HZ   LYS  20          3HZ       LYS  20   6.615  -6.613  10.636
  135    HA   PRO  21           HA       PRO  21   1.560  -5.992   3.146
  136   1HB   PRO  21          2HB       PRO  21   2.314  -4.035   1.501
  137   2HB   PRO  21          1HB       PRO  21   1.537  -3.678   3.046
  138   1HG   PRO  21          2HG       PRO  21   4.404  -3.467   2.277
  139   2HG   PRO  21          1HG       PRO  21   3.456  -2.450   3.372
  140   1HD   PRO  21          2HD       PRO  21   5.192  -4.531   4.113
  141   2HD   PRO  21          1HD       PRO  21   4.007  -3.724   5.156
  142    H    GLU  22           H        GLU  22   1.549  -6.575   0.886
  143    HA   GLU  22           HA       GLU  22   4.002  -8.000   0.135
  144   1HB   GLU  22          2HB       GLU  22   1.143  -8.313  -0.802
  145   2HB   GLU  22          1HB       GLU  22   2.497  -9.256  -1.410
  146   1HG   GLU  22          2HG       GLU  22   1.648  -9.207   1.475
  147   2HG   GLU  22          1HG       GLU  22   1.085 -10.398   0.304
  148    H    ILE  23           H        ILE  23   5.212  -6.437  -0.905
  149    HA   ILE  23           HA       ILE  23   4.013  -4.962  -3.095
  150    HB   ILE  23           HB       ILE  23   6.931  -5.122  -2.323
  151   1HG1  ILE  23          2HG1      ILE  23   4.724  -3.243  -1.521
  152   2HG1  ILE  23          1HG1      ILE  23   5.890  -4.073  -0.500
  153   1HG2  ILE  23          1HG2      ILE  23   6.620  -4.500  -4.647
  154   2HG2  ILE  23          2HG2      ILE  23   7.166  -3.106  -3.712
  155   3HG2  ILE  23          3HG2      ILE  23   5.471  -3.246  -4.180
  156   1HD1  ILE  23          1HD1      ILE  23   6.531  -1.826  -2.400
  157   2HD1  ILE  23          2HD1      ILE  23   7.669  -2.640  -1.323
  158   3HD1  ILE  23          3HD1      ILE  23   6.351  -1.678  -0.650
  159    H    ASP  24           H        ASP  24   3.407  -6.417  -4.647
  160    HA   ASP  24           HA       ASP  24   5.343  -8.329  -5.642
  161   1HB   ASP  24          2HB       ASP  24   2.905  -8.867  -5.632
  162   2HB   ASP  24          1HB       ASP  24   2.648  -7.576  -6.801
  163    H    ASP  25           H        ASP  25   7.031  -7.338  -6.571
  164    HA   ASP  25           HA       ASP  25   6.740  -4.839  -7.958
  165   1HB   ASP  25          2HB       ASP  25   8.784  -5.850  -6.599
  166   2HB   ASP  25          1HB       ASP  25   9.221  -6.500  -8.175
  167    H    ASP  26           H        ASP  26   6.312  -8.049  -8.780
  168    HA   ASP  26           HA       ASP  26   7.201  -8.083 -11.467
  169   1HB   ASP  26          2HB       ASP  26   6.750 -10.142 -10.224
  170   2HB   ASP  26          1HB       ASP  26   5.048  -9.713 -10.099
  171    H    THR  27           H        THR  27   3.929  -7.671 -10.069
  172    HA   THR  27           HA       THR  27   2.991  -6.535 -12.581
  173    HB   THR  27           HB       THR  27   1.425  -7.946 -11.362
  174    HG1  THR  27           HG1      THR  27   0.915  -5.455 -12.160
  175   1HG2  THR  27          1HG2      THR  27   1.600  -5.908  -9.147
  176   2HG2  THR  27          2HG2      THR  27   2.215  -7.559  -9.083
  177   3HG2  THR  27          3HG2      THR  27   0.480  -7.269  -9.208
  178    H    GLY  28           H        GLY  28   4.266  -5.484  -9.563
  179   1HA   GLY  28          2HA       GLY  28   5.058  -3.340  -9.092
  180   2HA   GLY  28          1HA       GLY  28   4.153  -2.721 -10.466
  181    H    LEU  29           H        LEU  29   2.603  -4.776  -8.139
  182    HA   LEU  29           HA       LEU  29   1.103  -2.429  -7.171
  183   1HB   LEU  29          2HB       LEU  29   0.026  -5.238  -7.381
  184   2HB   LEU  29          1HB       LEU  29  -0.871  -3.780  -7.006
  185    HG   LEU  29           HG       LEU  29   0.306  -4.568  -9.668
  186   1HD1  LEU  29          1HD1      LEU  29  -1.775  -5.673  -9.147
  187   2HD1  LEU  29          2HD1      LEU  29  -2.035  -4.462 -10.403
  188   3HD1  LEU  29          3HD1      LEU  29  -2.525  -4.128  -8.742
  189   1HD2  LEU  29          1HD2      LEU  29  -0.546  -2.500 -10.571
  190   2HD2  LEU  29          2HD2      LEU  29   0.609  -2.154  -9.284
  191   3HD2  LEU  29          3HD2      LEU  29  -1.122  -2.003  -8.979
  192    H    VAL  30           H        VAL  30   0.621  -2.300  -5.015
  193    HA   VAL  30           HA       VAL  30   2.125  -4.149  -3.288
  194    HB   VAL  30           HB       VAL  30   1.256  -1.312  -2.723
  195   1HG1  VAL  30          1HG1      VAL  30   2.786  -1.512  -0.776
  196   2HG1  VAL  30          2HG1      VAL  30   2.961  -3.229  -1.136
  197   3HG1  VAL  30          3HG1      VAL  30   1.387  -2.582  -0.677
  198   1HG2  VAL  30          1HG2      VAL  30   2.980  -1.414  -4.438
  199   2HG2  VAL  30          2HG2      VAL  30   3.976  -2.421  -3.386
  200   3HG2  VAL  30          3HG2      VAL  30   3.621  -0.756  -2.935
  201    H    SER  31           H        SER  31   0.789  -5.645  -2.511
  202    HA   SER  31           HA       SER  31  -1.986  -5.068  -1.955
  203   1HB   SER  31          2HB       SER  31  -0.408  -7.565  -1.333
  204   2HB   SER  31          1HB       SER  31  -2.159  -7.419  -1.409
  205    HG   SER  31           HG       SER  31  -1.360  -6.569  -3.717
  206    H    TYR  32           H        TYR  32  -2.668  -4.238  -0.104
  207    HA   TYR  32           HA       TYR  32  -1.127  -4.766   2.344
  208   1HB   TYR  32          2HB       TYR  32  -1.360  -2.496   3.073
  209   2HB   TYR  32          1HB       TYR  32  -0.685  -2.460   1.449
  210    HD1  TYR  32           HD1      TYR  32  -2.548  -2.250  -0.473
  211    HD2  TYR  32           HD2      TYR  32  -3.055  -1.022   3.563
  212    HE1  TYR  32           HE1      TYR  32  -4.326  -0.700  -1.176
  213    HE2  TYR  32           HE2      TYR  32  -4.829   0.537   2.875
  214    HH   TYR  32           HH       TYR  32  -6.166   0.526  -0.334
  215    H    HIS  33           H        HIS  33  -2.375  -4.691   4.291
  216    HA   HIS  33           HA       HIS  33  -5.211  -5.254   3.788
  217   1HB   HIS  33          2HB       HIS  33  -3.431  -6.048   6.101
  218   2HB   HIS  33          1HB       HIS  33  -5.159  -6.374   6.017
  219    HD1  HIS  33           HD1      HIS  33  -1.863  -7.576   4.795
  220    HD2  HIS  33           HD2      HIS  33  -5.899  -8.349   4.113
  221    HE1  HIS  33           HE1      HIS  33  -1.940  -9.755   3.528
  222    HE2  HIS  33           HE2      HIS  33  -4.397 -10.262   3.240
  223    H    ASP  34           H        ASP  34  -6.768  -4.107   4.718
  224    HA   ASP  34           HA       ASP  34  -6.220  -1.565   5.858
  225   1HB   ASP  34          2HB       ASP  34  -8.551  -3.066   5.015
  226   2HB   ASP  34          1HB       ASP  34  -8.851  -2.267   6.553
  227    H    GLN  35           H        GLN  35  -7.020  -0.852   7.994
  228    HA   GLN  35           HA       GLN  35  -6.325  -2.674  10.101
  229   1HB   GLN  35          2HB       GLN  35  -6.067  -0.142  10.155
  230   2HB   GLN  35          1HB       GLN  35  -7.806  -0.052  10.386
  231   1HG   GLN  35          2HG       GLN  35  -6.708   0.143  12.505
  232   2HG   GLN  35          1HG       GLN  35  -7.579  -1.387  12.439
  233   1HE2  GLN  35          1HE2      GLN  35  -5.333  -0.576  14.110
  234   2HE2  GLN  35          2HE2      GLN  35  -4.076  -1.727  13.812
  235    H    GLN  36           H        GLN  36  -9.054  -2.070   8.240
  236    HA   GLN  36           HA       GLN  36 -11.007  -3.083  10.114
  237   1HB   GLN  36          2HB       GLN  36 -11.557  -1.395   8.363
  238   2HB   GLN  36          1HB       GLN  36 -11.237  -2.608   7.131
  239   1HG   GLN  36          2HG       GLN  36 -13.606  -2.406   7.482
  240   2HG   GLN  36          1HG       GLN  36 -13.061  -3.985   8.044
  241   1HE2  GLN  36          1HE2      GLN  36 -14.247  -0.855   8.978
  242   2HE2  GLN  36          2HE2      GLN  36 -14.647  -1.266  10.614
  243    H    GLY  37           H        GLY  37  -8.762  -4.351   7.862
  244   1HA   GLY  37          2HA       GLY  37  -8.280  -6.719   7.925
  245   2HA   GLY  37          1HA       GLY  37 -10.000  -7.009   8.134
  246    H    ASN  38           H        ASN  38  -9.503  -4.594   5.866
  247    HA   ASN  38           HA       ASN  38 -10.403  -6.259   3.715
  248   1HB   ASN  38          2HB       ASN  38  -9.465  -3.378   3.729
  249   2HB   ASN  38          1HB       ASN  38 -10.208  -4.185   2.352
  250   1HD2  ASN  38          1HD2      ASN  38 -10.988  -1.853   4.025
  251   2HD2  ASN  38          2HD2      ASN  38 -12.616  -2.196   4.526
  252    H    ALA  39           H        ALA  39  -9.308  -6.695   1.747
  253    HA   ALA  39           HA       ALA  39  -6.369  -6.480   1.916
  254   1HB   ALA  39          1HB       ALA  39  -7.974  -8.568   0.442
  255   2HB   ALA  39          2HB       ALA  39  -7.204  -8.802   2.011
  256   3HB   ALA  39          3HB       ALA  39  -6.216  -8.496   0.582
  257    H    MET  40           H        MET  40  -5.877  -4.720   0.752
  258    HA   MET  40           HA       MET  40  -7.083  -4.471  -1.924
  259   1HB   MET  40          2HB       MET  40  -6.476  -2.282   0.070
  260   2HB   MET  40          1HB       MET  40  -6.868  -1.983  -1.620
  261   1HG   MET  40          2HG       MET  40  -9.030  -3.040  -1.316
  262   2HG   MET  40          1HG       MET  40  -8.647  -3.374   0.371
  263   1HE   MET  40          1HE       MET  40  -8.325  -1.510   2.197
  264   2HE   MET  40          2HE       MET  40  -8.481   0.219   1.888
  265   3HE   MET  40          3HE       MET  40  -7.128  -0.680   1.204
  266    H    GLN  41           H        GLN  41  -5.706  -2.778  -3.227
  267    HA   GLN  41           HA       GLN  41  -2.852  -3.319  -2.808
  268   1HB   GLN  41          2HB       GLN  41  -4.407  -3.879  -5.344
  269   2HB   GLN  41          1HB       GLN  41  -2.653  -3.889  -5.233
  270   1HG   GLN  41          2HG       GLN  41  -2.669  -5.756  -3.777
  271   2HG   GLN  41          1HG       GLN  41  -4.417  -5.656  -3.567
  272   1HE2  GLN  41          1HE2      GLN  41  -5.761  -6.421  -5.152
  273   2HE2  GLN  41          2HE2      GLN  41  -5.201  -7.429  -6.446
  274    H    ILE  42           H        ILE  42  -1.680  -1.517  -3.103
  275    HA   ILE  42           HA       ILE  42  -2.812   0.612  -4.803
  276    HB   ILE  42           HB       ILE  42  -1.392   2.226  -3.715
  277   1HG1  ILE  42          2HG1      ILE  42  -0.444   0.194  -1.716
  278   2HG1  ILE  42          1HG1      ILE  42   0.436   0.432  -3.226
  279   1HG2  ILE  42          1HG2      ILE  42  -2.334   2.189  -1.447
  280   2HG2  ILE  42          2HG2      ILE  42  -2.866   0.528  -1.718
  281   3HG2  ILE  42          3HG2      ILE  42  -3.532   1.839  -2.692
  282   1HD1  ILE  42          1HD1      ILE  42  -0.198   2.602  -1.250
  283   2HD1  ILE  42          2HD1      ILE  42   0.789   2.745  -2.708
  284   3HD1  ILE  42          3HD1      ILE  42   1.339   1.745  -1.360
  285    H    ASN  43           H        ASN  43  -0.709   2.025  -5.573
  286    HA   ASN  43           HA       ASN  43   0.639   0.119  -7.304
  287   1HB   ASN  43          2HB       ASN  43  -0.543   2.278  -8.068
  288   2HB   ASN  43          1HB       ASN  43   0.889   3.107  -7.477
  289   1HD2  ASN  43          1HD2      ASN  43   1.246   3.792  -9.642
  290   2HD2  ASN  43          2HD2      ASN  43   1.963   2.725 -10.801
  291    H    ARG  44           H        ARG  44   2.862   0.105  -7.625
  292    HA   ARG  44           HA       ARG  44   4.404  -0.119  -5.349
  293   1HB   ARG  44          2HB       ARG  44   4.938  -1.276  -7.358
  294   2HB   ARG  44          1HB       ARG  44   5.126   0.221  -8.252
  295   1HG   ARG  44          2HG       ARG  44   7.128   0.730  -6.891
  296   2HG   ARG  44          1HG       ARG  44   6.958  -0.852  -6.118
  297   1HD   ARG  44          2HD       ARG  44   7.122  -1.937  -8.285
  298   2HD   ARG  44          1HD       ARG  44   7.277  -0.373  -9.078
  299    HE   ARG  44           HE       ARG  44   9.313  -1.855  -7.674
  300   1HH1  ARG  44          1HH1      ARG  44   8.350   1.349  -8.786
  301   2HH1  ARG  44          2HH1      ARG  44   9.984   1.899  -8.964
  302   1HH2  ARG  44          1HH2      ARG  44  11.444  -1.127  -7.954
  303   2HH2  ARG  44          2HH2      ARG  44  11.746   0.486  -8.531
  304    H    ASP  45           H        ASP  45   4.502   2.580  -7.707
  305    HA   ASP  45           HA       ASP  45   6.573   3.846  -6.130
  306   1HB   ASP  45          2HB       ASP  45   5.283   4.520  -8.757
  307   2HB   ASP  45          1HB       ASP  45   6.357   5.654  -7.943
  308    H    ASP  46           H        ASP  46   3.390   3.700  -5.649
  309    HA   ASP  46           HA       ASP  46   3.013   6.484  -4.902
  310   1HB   ASP  46          2HB       ASP  46   1.259   4.043  -4.767
  311   2HB   ASP  46          1HB       ASP  46   0.840   5.502  -3.875
  312    H    VAL  47           H        VAL  47   4.199   3.598  -3.565
  313    HA   VAL  47           HA       VAL  47   3.691   4.127  -0.803
  314    HB   VAL  47           HB       VAL  47   5.978   2.453  -1.832
  315   1HG1  VAL  47          1HG1      VAL  47   4.155   2.141   0.539
  316   2HG1  VAL  47          2HG1      VAL  47   5.806   2.765   0.577
  317   3HG1  VAL  47          3HG1      VAL  47   5.504   1.089   0.115
  318   1HG2  VAL  47          1HG2      VAL  47   4.481   0.559  -2.048
  319   2HG2  VAL  47          2HG2      VAL  47   4.004   1.852  -3.149
  320   3HG2  VAL  47          3HG2      VAL  47   3.102   1.582  -1.660
  321    H    SER  48           H        SER  48   5.155   4.995   0.757
  322    HA   SER  48           HA       SER  48   7.605   6.186  -0.268
  323   1HB   SER  48          2HB       SER  48   5.848   7.868  -0.672
  324   2HB   SER  48          1HB       SER  48   5.442   7.842   1.043
  325    HG   SER  48           HG       SER  48   8.066   8.417   0.151
  326    H    GLN  49           H        GLN  49   5.625   6.650   2.683
  327    HA   GLN  49           HA       GLN  49   8.145   6.437   4.167
  328   1HB   GLN  49          2HB       GLN  49   5.560   7.844   4.806
  329   2HB   GLN  49          1HB       GLN  49   6.905   7.715   5.934
  330   1HG   GLN  49          2HG       GLN  49   8.322   8.987   4.503
  331   2HG   GLN  49          1HG       GLN  49   7.137   8.942   3.199
  332   1HE2  GLN  49          1HE2      GLN  49   5.364  10.288   3.277
  333   2HE2  GLN  49          2HE2      GLN  49   5.253  11.622   4.377
  334    H    ILE  50           H        ILE  50   8.446   4.490   4.928
  335    HA   ILE  50           HA       ILE  50   6.496   3.435   6.831
  336    HB   ILE  50           HB       ILE  50   7.050   1.092   6.045
  337   1HG1  ILE  50          2HG1      ILE  50   7.967   2.596   3.587
  338   2HG1  ILE  50          1HG1      ILE  50   8.974   1.607   4.637
  339   1HG2  ILE  50          1HG2      ILE  50   5.343   1.101   4.283
  340   2HG2  ILE  50          2HG2      ILE  50   5.447   2.860   4.208
  341   3HG2  ILE  50          3HG2      ILE  50   4.871   2.073   5.678
  342   1HD1  ILE  50          1HD1      ILE  50   7.666  -0.366   3.991
  343   2HD1  ILE  50          2HD1      ILE  50   8.441   0.413   2.611
  344   3HD1  ILE  50          3HD1      ILE  50   6.715   0.643   2.901
  345    H    ILE  51           H        ILE  51   7.757   1.305   7.800
  346    HA   ILE  51           HA       ILE  51  10.142   2.451   8.982
  347    HB   ILE  51           HB       ILE  51   8.369   1.324  10.346
  348   1HG1  ILE  51          2HG1      ILE  51  11.111   0.060  10.551
  349   2HG1  ILE  51          1HG1      ILE  51  10.674   1.638  11.194
  350   1HG2  ILE  51          1HG2      ILE  51   9.454  -1.191   9.089
  351   2HG2  ILE  51          2HG2      ILE  51   7.850  -0.505   8.834
  352   3HG2  ILE  51          3HG2      ILE  51   8.303  -1.118  10.424
  353   1HD1  ILE  51          1HD1      ILE  51   9.067   0.573  12.698
  354   2HD1  ILE  51          2HD1      ILE  51  10.703  -0.039  12.943
  355   3HD1  ILE  51          3HD1      ILE  51   9.521  -1.006  12.058
  356    H    GLU  52           H        GLU  52   9.585   0.824   6.250
  357    HA   GLU  52           HA       GLU  52  10.836  -0.297   4.733
  358   1HB   GLU  52          2HB       GLU  52  13.138   0.168   6.638
  359   2HB   GLU  52          1HB       GLU  52  13.273  -0.360   4.966
  360   1HG   GLU  52          2HG       GLU  52  12.230   1.773   4.257
  361   2HG   GLU  52          1HG       GLU  52  12.251   2.296   5.940
  362    H    ARG  53           H        ARG  53  12.917  -2.155   5.024
  363    HA   ARG  53           HA       ARG  53  11.818  -4.131   6.883
  364   1HB   ARG  53          2HB       ARG  53  12.026  -5.870   5.064
  365   2HB   ARG  53          1HB       ARG  53  10.710  -4.719   4.877
  366   1HG   ARG  53          2HG       ARG  53  11.891  -3.525   3.185
  367   2HG   ARG  53          1HG       ARG  53  13.364  -4.455   3.484
  368   1HD   ARG  53          2HD       ARG  53  12.253  -6.481   2.725
  369   2HD   ARG  53          1HD       ARG  53  10.756  -5.584   2.473
  370    HE   ARG  53           HE       ARG  53  11.987  -4.306   0.737
  371   1HH1  ARG  53          1HH1      ARG  53  13.254  -7.412   1.738
  372   2HH1  ARG  53          2HH1      ARG  53  13.984  -7.757   0.202
  373   1HH2  ARG  53          1HH2      ARG  53  12.940  -4.750  -1.278
  374   2HH2  ARG  53          2HH2      ARG  53  13.788  -6.246  -1.528
  Start of MODEL   19
    1    H    ASP   4           H        ASP   4  -0.788  -1.779  14.076
    2    HA   ASP   4           HA       ASP   4  -0.783   0.242  13.042
    3   1HB   ASP   4          2HB       ASP   4   0.081   1.130  15.794
    4   2HB   ASP   4          1HB       ASP   4  -0.253   2.255  14.486
    5    H    TYR   5           H        TYR   5   1.210  -0.897  11.935
    6    HA   TYR   5           HA       TYR   5   3.711   0.408  12.299
    7   1HB   TYR   5          2HB       TYR   5   2.529  -1.357  10.232
    8   2HB   TYR   5          1HB       TYR   5   3.816  -0.289   9.685
    9    HD1  TYR   5           HD1      TYR   5   5.281  -0.385  12.470
   10    HD2  TYR   5           HD2      TYR   5   3.804  -3.355   9.810
   11    HE1  TYR   5           HE1      TYR   5   6.977  -1.967  13.294
   12    HE2  TYR   5           HE2      TYR   5   5.485  -4.942  10.632
   13    HH   TYR   5           HH       TYR   5   7.136  -4.621  13.398
   14    H    VAL   6           H        VAL   6   0.904   0.964  10.248
   15    HA   VAL   6           HA       VAL   6   0.027   2.869   9.373
   16    HB   VAL   6           HB       VAL   6   2.266   4.272  10.834
   17   1HG1  VAL   6          1HG1      VAL   6  -0.184   5.424   9.505
   18   2HG1  VAL   6          2HG1      VAL   6   1.486   5.627   8.973
   19   3HG1  VAL   6          3HG1      VAL   6   0.957   6.318  10.508
   20   1HG2  VAL   6          1HG2      VAL   6   0.524   4.882  12.443
   21   2HG2  VAL   6          2HG2      VAL   6   0.714   3.133  12.329
   22   3HG2  VAL   6          3HG2      VAL   6  -0.649   3.926  11.537
   23    H    MET   7           H        MET   7   0.139   3.068   7.258
   24    HA   MET   7           HA       MET   7   2.774   3.230   5.989
   25   1HB   MET   7          2HB       MET   7   1.317   1.433   5.183
   26   2HB   MET   7          1HB       MET   7   0.065   2.604   4.792
   27   1HG   MET   7          2HG       MET   7   1.487   3.608   3.109
   28   2HG   MET   7          1HG       MET   7   2.802   2.515   3.534
   29   1HE   MET   7          1HE       MET   7  -1.160   1.165   1.595
   30   2HE   MET   7          2HE       MET   7  -0.756   2.848   1.932
   31   3HE   MET   7          3HE       MET   7  -1.035   1.727   3.264
   32    H    ALA   8           H        ALA   8   3.416   5.274   5.842
   33    HA   ALA   8           HA       ALA   8   1.529   7.343   5.014
   34   1HB   ALA   8          1HB       ALA   8   4.451   7.570   5.749
   35   2HB   ALA   8          2HB       ALA   8   3.100   7.844   6.848
   36   3HB   ALA   8          3HB       ALA   8   3.342   8.911   5.465
   37    H    THR   9           H        THR   9   1.183   7.504   2.891
   38    HA   THR   9           HA       THR   9   3.200   6.532   1.047
   39    HB   THR   9           HB       THR   9   1.449   7.032  -0.692
   40    HG1  THR   9           HG1      THR   9  -0.398   7.919  -0.097
   41   1HG2  THR   9          1HG2      THR   9   0.040   5.115  -0.090
   42   2HG2  THR   9          2HG2      THR   9   0.665   5.178   1.557
   43   3HG2  THR   9          3HG2      THR   9   1.745   4.784   0.221
   44    H    LYS  10           H        LYS  10   3.556   7.812  -0.966
   45    HA   LYS  10           HA       LYS  10   4.637  10.350  -0.119
   46   1HB   LYS  10          2HB       LYS  10   5.889   8.627  -1.445
   47   2HB   LYS  10          1HB       LYS  10   4.838   8.981  -2.805
   48   1HG   LYS  10          2HG       LYS  10   5.769  11.066  -3.154
   49   2HG   LYS  10          1HG       LYS  10   6.405  11.168  -1.509
   50   1HD   LYS  10          2HD       LYS  10   8.184  10.775  -3.163
   51   2HD   LYS  10          1HD       LYS  10   8.047   9.447  -2.011
   52   1HE   LYS  10          2HE       LYS  10   6.689   8.210  -3.679
   53   2HE   LYS  10          1HE       LYS  10   6.986   9.510  -4.834
   54   1HZ   LYS  10          1HZ       LYS  10   8.544   7.776  -5.233
   55   2HZ   LYS  10          2HZ       LYS  10   9.006   7.712  -3.602
   56   3HZ   LYS  10          3HZ       LYS  10   9.395   9.072  -4.546
   57    H    ASP  11           H        ASP  11   1.694   9.447  -1.286
   58    HA   ASP  11           HA       ASP  11   1.276  11.811  -2.926
   59   1HB   ASP  11          2HB       ASP  11  -0.900  10.993  -3.388
   60   2HB   ASP  11          1HB       ASP  11   0.137   9.576  -3.383
   61    H    GLY  12           H        GLY  12   1.096  10.895   0.352
   62   1HA   GLY  12          2HA       GLY  12   1.098  12.867   1.841
   63   2HA   GLY  12          1HA       GLY  12  -0.297  13.433   0.936
   64    H    ARG  13           H        ARG  13  -1.397  10.624   0.856
   65    HA   ARG  13           HA       ARG  13  -2.907  10.905   3.275
   66   1HB   ARG  13          2HB       ARG  13  -4.156   8.922   2.511
   67   2HB   ARG  13          1HB       ARG  13  -4.049  10.163   1.274
   68   1HG   ARG  13          2HG       ARG  13  -2.325   8.915   0.129
   69   2HG   ARG  13          1HG       ARG  13  -2.334   7.689   1.386
   70   1HD   ARG  13          2HD       ARG  13  -4.557   8.370  -0.531
   71   2HD   ARG  13          1HD       ARG  13  -3.613   6.883  -0.476
   72    HE   ARG  13           HE       ARG  13  -5.036   7.418   1.964
   73   1HH1  ARG  13          1HH1      ARG  13  -5.299   5.981  -1.238
   74   2HH1  ARG  13          2HH1      ARG  13  -6.639   4.958  -0.797
   75   1HH2  ARG  13          1HH2      ARG  13  -6.778   6.106   2.525
   76   2HH2  ARG  13          2HH2      ARG  13  -7.489   5.035   1.353
   77    H    MET  14           H        MET  14  -3.093   9.452   4.981
   78    HA   MET  14           HA       MET  14  -0.796   7.637   5.312
   79   1HB   MET  14          2HB       MET  14  -0.636   9.705   6.687
   80   2HB   MET  14          1HB       MET  14  -2.161   9.282   7.451
   81   1HG   MET  14          2HG       MET  14  -1.174   7.280   8.381
   82   2HG   MET  14          1HG       MET  14   0.347   7.631   7.560
   83   1HE   MET  14          1HE       MET  14   1.925   9.690   8.170
   84   2HE   MET  14          2HE       MET  14   1.499  10.915   9.365
   85   3HE   MET  14          3HE       MET  14   0.567  10.775   7.875
   86    H    ILE  15           H        ILE  15  -1.445   5.595   5.378
   87    HA   ILE  15           HA       ILE  15  -4.244   5.050   6.082
   88    HB   ILE  15           HB       ILE  15  -2.294   3.316   4.555
   89   1HG1  ILE  15          2HG1      ILE  15  -4.628   4.983   3.581
   90   2HG1  ILE  15          1HG1      ILE  15  -2.927   5.352   3.320
   91   1HG2  ILE  15          1HG2      ILE  15  -3.975   2.010   5.739
   92   2HG2  ILE  15          2HG2      ILE  15  -4.264   1.968   4.000
   93   3HG2  ILE  15          3HG2      ILE  15  -5.255   2.997   5.034
   94   1HD1  ILE  15          1HD1      ILE  15  -4.387   2.941   2.261
   95   2HD1  ILE  15          2HD1      ILE  15  -2.690   3.330   1.979
   96   3HD1  ILE  15          3HD1      ILE  15  -3.954   4.381   1.340
   97    H    LEU  16           H        LEU  16  -4.775   3.758   7.751
   98    HA   LEU  16           HA       LEU  16  -2.722   3.034   9.618
   99   1HB   LEU  16          2HB       LEU  16  -5.707   2.622   9.639
  100   2HB   LEU  16          1HB       LEU  16  -4.657   2.067  10.925
  101    HG   LEU  16           HG       LEU  16  -5.579   4.077  11.698
  102   1HD1  LEU  16          1HD1      LEU  16  -3.190   3.916  12.086
  103   2HD1  LEU  16          2HD1      LEU  16  -3.681   5.598  11.876
  104   3HD1  LEU  16          3HD1      LEU  16  -2.872   4.743  10.560
  105   1HD2  LEU  16          1HD2      LEU  16  -6.505   4.894   9.620
  106   2HD2  LEU  16          2HD2      LEU  16  -4.894   5.303   9.034
  107   3HD2  LEU  16          3HD2      LEU  16  -5.577   6.167  10.412
  108    H    THR  17           H        THR  17  -1.524   1.535   8.413
  109    HA   THR  17           HA       THR  17  -2.771  -1.092   8.040
  110    HB   THR  17           HB       THR  17  -0.519  -1.638   6.980
  111    HG1  THR  17           HG1      THR  17   0.970  -0.142   7.060
  112   1HG2  THR  17          1HG2      THR  17  -2.502  -1.139   5.628
  113   2HG2  THR  17          2HG2      THR  17  -1.046  -0.490   4.873
  114   3HG2  THR  17          3HG2      THR  17  -2.148   0.585   5.732
  115    H    ASP  18           H        ASP  18  -2.463  -2.625   9.598
  116    HA   ASP  18           HA       ASP  18  -0.893  -2.116  11.882
  117   1HB   ASP  18          2HB       ASP  18  -2.316  -4.519  10.845
  118   2HB   ASP  18          1HB       ASP  18  -1.105  -4.753  12.106
  119    H    GLY  19           H        GLY  19  -0.209  -3.809   8.876
  120   1HA   GLY  19          2HA       GLY  19   2.199  -2.684   8.528
  121   2HA   GLY  19          1HA       GLY  19   2.596  -4.018   9.601
  122    H    LYS  20           H        LYS  20   3.875  -4.093   7.229
  123    HA   LYS  20           HA       LYS  20   4.412  -5.835   5.917
  124   1HB   LYS  20          2HB       LYS  20   2.093  -7.140   7.283
  125   2HB   LYS  20          1HB       LYS  20   2.993  -7.952   6.003
  126   1HG   LYS  20          2HG       LYS  20   5.076  -7.346   7.395
  127   2HG   LYS  20          1HG       LYS  20   3.929  -7.083   8.709
  128   1HD   LYS  20          2HD       LYS  20   3.173  -9.349   8.592
  129   2HD   LYS  20          1HD       LYS  20   4.101  -9.637   7.119
  130   1HE   LYS  20          2HE       LYS  20   6.178  -9.218   8.396
  131   2HE   LYS  20          1HE       LYS  20   5.209  -9.049   9.860
  132   1HZ   LYS  20          1HZ       LYS  20   6.135 -11.264   9.682
  133   2HZ   LYS  20          2HZ       LYS  20   5.397 -11.485   8.172
  134   3HZ   LYS  20          3HZ       LYS  20   4.444 -11.327   9.565
  135    HA   PRO  21           HA       PRO  21   1.650  -4.836   2.502
  136   1HB   PRO  21          2HB       PRO  21   3.246  -2.897   1.389
  137   2HB   PRO  21          1HB       PRO  21   1.935  -2.565   2.520
  138   1HG   PRO  21          2HG       PRO  21   4.770  -2.252   2.918
  139   2HG   PRO  21          1HG       PRO  21   3.450  -1.829   4.020
  140   1HD   PRO  21          2HD       PRO  21   5.187  -4.205   4.000
  141   2HD   PRO  21          1HD       PRO  21   4.210  -3.535   5.322
  142    H    GLU  22           H        GLU  22   1.945  -6.453   1.106
  143    HA   GLU  22           HA       GLU  22   4.594  -7.400   0.453
  144   1HB   GLU  22          2HB       GLU  22   2.084  -8.571   0.605
  145   2HB   GLU  22          1HB       GLU  22   2.389  -8.498  -1.124
  146   1HG   GLU  22          2HG       GLU  22   4.216  -9.749   0.918
  147   2HG   GLU  22          1HG       GLU  22   3.099 -10.621  -0.126
  148    H    ILE  23           H        ILE  23   5.703  -6.099  -0.867
  149    HA   ILE  23           HA       ILE  23   4.489  -4.522  -2.906
  150    HB   ILE  23           HB       ILE  23   7.414  -5.224  -2.626
  151   1HG1  ILE  23          2HG1      ILE  23   5.852  -2.919  -1.433
  152   2HG1  ILE  23          1HG1      ILE  23   6.549  -4.264  -0.540
  153   1HG2  ILE  23          1HG2      ILE  23   6.029  -2.919  -3.995
  154   2HG2  ILE  23          2HG2      ILE  23   6.819  -4.278  -4.791
  155   3HG2  ILE  23          3HG2      ILE  23   7.773  -3.131  -3.851
  156   1HD1  ILE  23          1HD1      ILE  23   7.933  -2.309  -0.310
  157   2HD1  ILE  23          2HD1      ILE  23   8.059  -2.157  -2.061
  158   3HD1  ILE  23          3HD1      ILE  23   8.789  -3.538  -1.245
  159    H    ASP  24           H        ASP  24   3.587  -5.447  -4.614
  160    HA   ASP  24           HA       ASP  24   4.335  -8.038  -5.563
  161   1HB   ASP  24          2HB       ASP  24   1.986  -7.034  -5.660
  162   2HB   ASP  24          1HB       ASP  24   2.572  -6.036  -6.982
  163    H    ASP  25           H        ASP  25   5.761  -8.544  -7.139
  164    HA   ASP  25           HA       ASP  25   7.082  -6.291  -8.471
  165   1HB   ASP  25          2HB       ASP  25   8.987  -7.776  -8.821
  166   2HB   ASP  25          1HB       ASP  25   8.547  -7.706  -7.119
  167    H    ASP  26           H        ASP  26   4.614  -8.188  -9.229
  168    HA   ASP  26           HA       ASP  26   5.463  -8.623 -12.030
  169   1HB   ASP  26          2HB       ASP  26   4.246 -10.479 -10.702
  170   2HB   ASP  26          1HB       ASP  26   2.838  -9.455 -10.788
  171    H    THR  27           H        THR  27   3.090  -7.231  -9.933
  172    HA   THR  27           HA       THR  27   1.548  -6.205 -12.170
  173    HB   THR  27           HB       THR  27   0.586  -5.885  -9.387
  174    HG1  THR  27           HG1      THR  27   1.679  -7.975  -9.355
  175   1HG2  THR  27          1HG2      THR  27  -1.439  -6.716 -10.346
  176   2HG2  THR  27          2HG2      THR  27  -0.578  -7.201 -11.809
  177   3HG2  THR  27          3HG2      THR  27  -0.767  -5.487 -11.422
  178    H    GLY  28           H        GLY  28   3.828  -5.077  -9.923
  179   1HA   GLY  28          2HA       GLY  28   4.699  -2.956  -9.642
  180   2HA   GLY  28          1HA       GLY  28   3.521  -2.367 -10.809
  181    H    LEU  29           H        LEU  29   2.411  -4.226  -8.146
  182    HA   LEU  29           HA       LEU  29   1.300  -1.784  -6.960
  183   1HB   LEU  29          2HB       LEU  29   0.032  -4.517  -7.133
  184   2HB   LEU  29          1HB       LEU  29  -0.664  -3.130  -6.318
  185    HG   LEU  29           HG       LEU  29  -0.144  -3.354  -9.285
  186   1HD1  LEU  29          1HD1      LEU  29  -2.727  -3.348  -7.728
  187   2HD1  LEU  29          2HD1      LEU  29  -1.999  -4.747  -8.516
  188   3HD1  LEU  29          3HD1      LEU  29  -2.572  -3.390  -9.484
  189   1HD2  LEU  29          1HD2      LEU  29  -1.340  -1.230  -9.453
  190   2HD2  LEU  29          2HD2      LEU  29   0.124  -1.062  -8.483
  191   3HD2  LEU  29          3HD2      LEU  29  -1.452  -1.149  -7.694
  192    H    VAL  30           H        VAL  30   0.432  -2.357  -4.637
  193    HA   VAL  30           HA       VAL  30   2.356  -4.103  -3.258
  194    HB   VAL  30           HB       VAL  30   1.581  -1.357  -2.257
  195   1HG1  VAL  30          1HG1      VAL  30   3.365  -1.759  -0.596
  196   2HG1  VAL  30          2HG1      VAL  30   3.540  -3.402  -1.217
  197   3HG1  VAL  30          3HG1      VAL  30   2.029  -2.901  -0.456
  198   1HG2  VAL  30          1HG2      VAL  30   3.957  -0.779  -2.692
  199   2HG2  VAL  30          2HG2      VAL  30   3.015  -1.077  -4.150
  200   3HG2  VAL  30          3HG2      VAL  30   4.127  -2.308  -3.552
  201    H    SER  31           H        SER  31   1.254  -5.591  -2.203
  202    HA   SER  31           HA       SER  31  -1.549  -5.259  -1.648
  203   1HB   SER  31          2HB       SER  31   0.229  -7.555  -0.826
  204   2HB   SER  31          1HB       SER  31  -1.516  -7.574  -1.062
  205    HG   SER  31           HG       SER  31   0.055  -8.366  -2.814
  206    H    TYR  32           H        TYR  32  -1.977  -3.896   0.009
  207    HA   TYR  32           HA       TYR  32  -0.522  -4.312   2.528
  208   1HB   TYR  32          2HB       TYR  32  -1.107  -2.096   3.190
  209   2HB   TYR  32          1HB       TYR  32  -0.523  -1.991   1.532
  210    HD1  TYR  32           HD1      TYR  32  -2.719  -2.501  -0.180
  211    HD2  TYR  32           HD2      TYR  32  -2.762  -0.598   3.622
  212    HE1  TYR  32           HE1      TYR  32  -4.776  -1.304  -0.807
  213    HE2  TYR  32           HE2      TYR  32  -4.814   0.598   3.008
  214    HH   TYR  32           HH       TYR  32  -6.766  -0.221   0.547
  215    H    HIS  33           H        HIS  33  -1.912  -3.868   4.501
  216    HA   HIS  33           HA       HIS  33  -4.503  -5.218   4.142
  217   1HB   HIS  33          2HB       HIS  33  -2.588  -5.315   6.490
  218   2HB   HIS  33          1HB       HIS  33  -4.207  -6.002   6.502
  219    HD1  HIS  33           HD1      HIS  33  -0.736  -6.730   5.521
  220    HD2  HIS  33           HD2      HIS  33  -4.526  -8.243   4.728
  221    HE1  HIS  33           HE1      HIS  33  -0.361  -9.007   4.534
  222    HE2  HIS  33           HE2      HIS  33  -2.670  -9.990   4.308
  223    H    ASP  34           H        ASP  34  -6.136  -3.898   4.427
  224    HA   ASP  34           HA       ASP  34  -6.000  -1.326   5.557
  225   1HB   ASP  34          2HB       ASP  34  -8.329  -3.168   5.026
  226   2HB   ASP  34          1HB       ASP  34  -8.539  -1.553   5.684
  227    H    GLN  35           H        GLN  35  -6.906  -0.526   7.501
  228    HA   GLN  35           HA       GLN  35  -6.875  -2.274   9.774
  229   1HB   GLN  35          2HB       GLN  35  -6.427   0.309   9.647
  230   2HB   GLN  35          1HB       GLN  35  -8.178   0.436   9.770
  231   1HG   GLN  35          2HG       GLN  35  -8.145  -0.765  11.867
  232   2HG   GLN  35          1HG       GLN  35  -6.402  -0.979  11.736
  233   1HE2  GLN  35          1HE2      GLN  35  -5.928   0.056  13.598
  234   2HE2  GLN  35          2HE2      GLN  35  -6.102   1.771  13.806
  235    H    GLN  36           H        GLN  36  -8.961  -1.677   7.287
  236    HA   GLN  36           HA       GLN  36 -11.451  -2.151   8.675
  237   1HB   GLN  36          2HB       GLN  36 -11.231  -0.646   6.669
  238   2HB   GLN  36          1HB       GLN  36 -10.898  -2.073   5.701
  239   1HG   GLN  36          2HG       GLN  36 -13.175  -1.462   5.402
  240   2HG   GLN  36          1HG       GLN  36 -13.122  -2.959   6.335
  241   1HE2  GLN  36          1HE2      GLN  36 -13.761  -2.940   8.485
  242   2HE2  GLN  36          2HE2      GLN  36 -14.635  -1.614   9.173
  243    H    GLY  37           H        GLY  37  -8.918  -4.011   7.478
  244   1HA   GLY  37          2HA       GLY  37  -8.749  -6.328   7.800
  245   2HA   GLY  37          1HA       GLY  37 -10.501  -6.429   7.867
  246    H    ASN  38           H        ASN  38  -8.816  -4.775   5.265
  247    HA   ASN  38           HA       ASN  38  -9.509  -7.033   3.499
  248   1HB   ASN  38          2HB       ASN  38  -9.459  -4.091   2.778
  249   2HB   ASN  38          1HB       ASN  38  -9.755  -5.407   1.648
  250   1HD2  ASN  38          1HD2      ASN  38 -11.081  -3.344   4.008
  251   2HD2  ASN  38          2HD2      ASN  38 -12.707  -3.941   3.953
  252    H    ALA  39           H        ALA  39  -8.041  -7.669   1.953
  253    HA   ALA  39           HA       ALA  39  -5.353  -6.486   2.178
  254   1HB   ALA  39          1HB       ALA  39  -5.452  -8.875   2.690
  255   2HB   ALA  39          2HB       ALA  39  -4.527  -8.585   1.218
  256   3HB   ALA  39          3HB       ALA  39  -6.180  -9.191   1.115
  257    H    MET  40           H        MET  40  -5.179  -4.918   0.689
  258    HA   MET  40           HA       MET  40  -6.140  -5.519  -2.031
  259   1HB   MET  40          2HB       MET  40  -6.276  -2.826  -0.654
  260   2HB   MET  40          1HB       MET  40  -6.800  -3.178  -2.297
  261   1HG   MET  40          2HG       MET  40  -8.400  -4.850  -1.272
  262   2HG   MET  40          1HG       MET  40  -8.005  -4.123   0.283
  263   1HE   MET  40          1HE       MET  40  -7.669  -1.106  -0.329
  264   2HE   MET  40          2HE       MET  40  -8.693  -1.669   0.993
  265   3HE   MET  40          3HE       MET  40  -9.303  -0.469  -0.148
  266    H    GLN  41           H        GLN  41  -5.102  -3.895  -3.654
  267    HA   GLN  41           HA       GLN  41  -2.247  -3.705  -2.929
  268   1HB   GLN  41          2HB       GLN  41  -3.310  -4.402  -5.668
  269   2HB   GLN  41          1HB       GLN  41  -1.640  -4.468  -5.117
  270   1HG   GLN  41          2HG       GLN  41  -2.237  -6.275  -3.573
  271   2HG   GLN  41          1HG       GLN  41  -3.894  -6.226  -4.169
  272   1HE2  GLN  41          1HE2      GLN  41  -0.653  -7.212  -4.791
  273   2HE2  GLN  41          2HE2      GLN  41  -0.984  -8.141  -6.215
  274    H    ILE  42           H        ILE  42  -1.665  -1.615  -2.900
  275    HA   ILE  42           HA       ILE  42  -3.005   0.260  -4.704
  276    HB   ILE  42           HB       ILE  42  -2.029   2.061  -3.502
  277   1HG1  ILE  42          2HG1      ILE  42  -0.515   0.259  -1.641
  278   2HG1  ILE  42          1HG1      ILE  42   0.228   0.752  -3.160
  279   1HG2  ILE  42          1HG2      ILE  42  -3.942   1.007  -2.430
  280   2HG2  ILE  42          2HG2      ILE  42  -2.838   1.694  -1.239
  281   3HG2  ILE  42          3HG2      ILE  42  -2.857  -0.046  -1.522
  282   1HD1  ILE  42          1HD1      ILE  42  -0.018   3.073  -2.561
  283   2HD1  ILE  42          2HD1      ILE  42   0.857   2.201  -1.302
  284   3HD1  ILE  42          3HD1      ILE  42  -0.839   2.622  -1.065
  285    H    ASN  43           H        ASN  43  -1.314   2.049  -5.493
  286    HA   ASN  43           HA       ASN  43   0.357   0.604  -7.326
  287   1HB   ASN  43          2HB       ASN  43  -0.935   2.635  -7.949
  288   2HB   ASN  43          1HB       ASN  43   0.114   3.586  -6.905
  289   1HD2  ASN  43          1HD2      ASN  43   2.068   4.189  -7.592
  290   2HD2  ASN  43          2HD2      ASN  43   2.716   3.837  -9.166
  291    H    ARG  44           H        ARG  44   2.540   0.399  -7.333
  292    HA   ARG  44           HA       ARG  44   3.847   0.329  -4.873
  293   1HB   ARG  44          2HB       ARG  44   4.513  -1.065  -6.765
  294   2HB   ARG  44          1HB       ARG  44   5.055   0.360  -7.644
  295   1HG   ARG  44          2HG       ARG  44   6.679   0.755  -5.753
  296   2HG   ARG  44          1HG       ARG  44   6.250  -0.852  -5.169
  297   1HD   ARG  44          2HD       ARG  44   7.304  -0.271  -7.929
  298   2HD   ARG  44          1HD       ARG  44   8.307  -0.777  -6.572
  299    HE   ARG  44           HE       ARG  44   6.165  -2.600  -7.006
  300   1HH1  ARG  44          1HH1      ARG  44   9.275  -1.606  -8.208
  301   2HH1  ARG  44          2HH1      ARG  44   9.659  -3.149  -8.902
  302   1HH2  ARG  44          1HH2      ARG  44   6.657  -4.660  -7.911
  303   2HH2  ARG  44          2HH2      ARG  44   8.182  -4.885  -8.724
  304    H    ASP  45           H        ASP  45   3.815   2.848  -7.314
  305    HA   ASP  45           HA       ASP  45   6.160   4.185  -6.408
  306   1HB   ASP  45          2HB       ASP  45   3.913   5.387  -8.029
  307   2HB   ASP  45          1HB       ASP  45   5.585   5.928  -7.954
  308    H    ASP  46           H        ASP  46   3.145   3.962  -5.017
  309    HA   ASP  46           HA       ASP  46   3.097   6.682  -3.976
  310   1HB   ASP  46          2HB       ASP  46   1.220   4.345  -3.610
  311   2HB   ASP  46          1HB       ASP  46   1.012   5.900  -2.813
  312    H    VAL  47           H        VAL  47   3.862   3.441  -2.948
  313    HA   VAL  47           HA       VAL  47   3.740   3.901  -0.153
  314    HB   VAL  47           HB       VAL  47   5.438   1.823  -1.546
  315   1HG1  VAL  47          1HG1      VAL  47   4.079   1.805   1.141
  316   2HG1  VAL  47          2HG1      VAL  47   5.799   2.100   0.876
  317   3HG1  VAL  47          3HG1      VAL  47   5.098   0.531   0.473
  318   1HG2  VAL  47          1HG2      VAL  47   3.471   0.344  -1.365
  319   2HG2  VAL  47          2HG2      VAL  47   3.198   1.701  -2.457
  320   3HG2  VAL  47          3HG2      VAL  47   2.514   1.723  -0.832
  321    H    SER  48           H        SER  48   5.109   5.011   1.101
  322    HA   SER  48           HA       SER  48   7.784   5.565   0.017
  323   1HB   SER  48          2HB       SER  48   6.309   7.514  -0.272
  324   2HB   SER  48          1HB       SER  48   5.986   7.529   1.461
  325    HG   SER  48           HG       SER  48   7.607   9.003   1.067
  326    H    GLN  49           H        GLN  49   6.040   6.189   3.090
  327    HA   GLN  49           HA       GLN  49   8.437   5.174   4.479
  328   1HB   GLN  49          2HB       GLN  49   6.643   7.478   5.261
  329   2HB   GLN  49          1HB       GLN  49   7.975   6.865   6.234
  330   1HG   GLN  49          2HG       GLN  49   9.556   7.492   4.503
  331   2HG   GLN  49          1HG       GLN  49   8.234   8.042   3.474
  332   1HE2  GLN  49          1HE2      GLN  49  10.147   8.718   6.295
  333   2HE2  GLN  49          2HE2      GLN  49   9.655  10.364   6.475
  334    H    ILE  50           H        ILE  50   8.020   3.370   5.549
  335    HA   ILE  50           HA       ILE  50   5.304   2.890   6.541
  336    HB   ILE  50           HB       ILE  50   7.619   0.951   6.424
  337   1HG1  ILE  50          2HG1      ILE  50   6.938   1.646   4.168
  338   2HG1  ILE  50          1HG1      ILE  50   6.485  -0.028   4.476
  339   1HG2  ILE  50          1HG2      ILE  50   5.990   0.365   8.114
  340   2HG2  ILE  50          2HG2      ILE  50   5.871  -0.755   6.755
  341   3HG2  ILE  50          3HG2      ILE  50   4.680   0.533   6.947
  342   1HD1  ILE  50          1HD1      ILE  50   4.728   1.136   3.298
  343   2HD1  ILE  50          2HD1      ILE  50   4.653   2.359   4.565
  344   3HD1  ILE  50          3HD1      ILE  50   4.185   0.693   4.916
  345    H    ILE  51           H        ILE  51   8.569   2.089   7.753
  346    HA   ILE  51           HA       ILE  51   7.596   2.561  10.476
  347    HB   ILE  51           HB       ILE  51  10.213   1.356   9.550
  348   1HG1  ILE  51          2HG1      ILE  51   7.726  -0.001  10.621
  349   2HG1  ILE  51          1HG1      ILE  51   8.254  -0.020   8.941
  350   1HG2  ILE  51          1HG2      ILE  51  10.438   0.584  11.871
  351   2HG2  ILE  51          2HG2      ILE  51   8.969   1.462  12.296
  352   3HG2  ILE  51          3HG2      ILE  51  10.399   2.344  11.762
  353   1HD1  ILE  51          1HD1      ILE  51  10.237  -1.259   9.548
  354   2HD1  ILE  51          2HD1      ILE  51   8.797  -2.092  10.133
  355   3HD1  ILE  51          3HD1      ILE  51   9.802  -1.170  11.252
  356    H    GLU  52           H        GLU  52   9.714   3.844   8.071
  357    HA   GLU  52           HA       GLU  52  11.351   5.422   9.759
  358   1HB   GLU  52          2HB       GLU  52  11.869   6.638   7.581
  359   2HB   GLU  52          1HB       GLU  52  12.238   4.920   7.638
  360   1HG   GLU  52          2HG       GLU  52   9.977   4.557   6.535
  361   2HG   GLU  52          1HG       GLU  52   9.972   6.295   6.235
  362    H    ARG  53           H        ARG  53  10.196   6.661  11.151
  363    HA   ARG  53           HA       ARG  53   8.098   8.427  10.303
  364   1HB   ARG  53          2HB       ARG  53   9.691   8.318  12.876
  365   2HB   ARG  53          1HB       ARG  53   8.319   9.380  12.607
  366   1HG   ARG  53          2HG       ARG  53   8.299   6.375  12.713
  367   2HG   ARG  53          1HG       ARG  53   7.606   7.499  13.883
  368   1HD   ARG  53          2HD       ARG  53   6.076   8.318  12.101
  369   2HD   ARG  53          1HD       ARG  53   6.708   7.059  11.039
  370    HE   ARG  53           HE       ARG  53   5.350   6.452  13.591
  371   1HH1  ARG  53          1HH1      ARG  53   5.794   5.962  10.152
  372   2HH1  ARG  53          2HH1      ARG  53   4.765   4.560  10.086
  373   1HH2  ARG  53          1HH2      ARG  53   3.933   4.638  13.495
  374   2HH2  ARG  53          2HH2      ARG  53   3.699   3.828  11.972
  Start of MODEL   20
    1    H    ASP   4           H        ASP   4   3.914   1.363  16.406
    2    HA   ASP   4           HA       ASP   4   2.589  -0.463  16.253
    3   1HB   ASP   4          2HB       ASP   4   0.481   1.517  15.380
    4   2HB   ASP   4          1HB       ASP   4   0.170  -0.189  15.671
    5    H    TYR   5           H        TYR   5   0.980   1.191  13.610
    6    HA   TYR   5           HA       TYR   5   2.383  -0.204  11.551
    7   1HB   TYR   5          2HB       TYR   5  -0.026  -1.263  10.905
    8   2HB   TYR   5          1HB       TYR   5   1.225  -2.144  11.771
    9    HD1  TYR   5           HD2      TYR   5  -1.751   0.034  12.396
   10    HD2  TYR   5           HD1      TYR   5   0.717  -3.133  13.801
   11    HE1  TYR   5           HE2      TYR   5  -3.284  -0.319  14.282
   12    HE2  TYR   5           HE1      TYR   5  -0.813  -3.494  15.688
   13    HH   TYR   5           HH       TYR   5  -2.480  -2.114  16.986
   14    H    VAL   6           H        VAL   6   2.534   1.441  10.211
   15    HA   VAL   6           HA       VAL   6   0.137   2.706   9.198
   16    HB   VAL   6           HB       VAL   6   0.746   4.115  11.132
   17   1HG1  VAL   6          1HG1      VAL   6   2.819   5.418  11.119
   18   2HG1  VAL   6          2HG1      VAL   6   3.353   4.541   9.683
   19   3HG1  VAL   6          3HG1      VAL   6   3.133   3.683  11.210
   20   1HG2  VAL   6          1HG2      VAL   6   1.258   5.448   8.477
   21   2HG2  VAL   6          2HG2      VAL   6   0.813   6.269   9.974
   22   3HG2  VAL   6          3HG2      VAL   6  -0.321   5.155   9.207
   23    H    MET   7           H        MET   7   0.430   3.601   7.149
   24    HA   MET   7           HA       MET   7   3.093   3.226   5.955
   25   1HB   MET   7          2HB       MET   7   1.611   1.303   5.417
   26   2HB   MET   7          1HB       MET   7   0.462   2.418   4.696
   27   1HG   MET   7          2HG       MET   7   2.043   3.013   2.983
   28   2HG   MET   7          1HG       MET   7   3.289   2.024   3.746
   29   1HE   MET   7          1HE       MET   7  -0.157   2.015   1.868
   30   2HE   MET   7          2HE       MET   7  -0.537   1.153   3.361
   31   3HE   MET   7          3HE       MET   7  -0.537   0.293   1.821
   32    H    ALA   8           H        ALA   8   3.692   5.257   5.557
   33    HA   ALA   8           HA       ALA   8   1.731   7.234   4.724
   34   1HB   ALA   8          1HB       ALA   8   3.405   7.867   6.390
   35   2HB   ALA   8          2HB       ALA   8   3.560   8.843   4.929
   36   3HB   ALA   8          3HB       ALA   8   4.691   7.524   5.233
   37    H    THR   9           H        THR   9   1.694   8.220   2.748
   38    HA   THR   9           HA       THR   9   3.111   6.766   0.632
   39    HB   THR   9           HB       THR   9   1.305   7.808  -0.833
   40    HG1  THR   9           HG1      THR   9  -0.045   8.186   1.624
   41   1HG2  THR   9          1HG2      THR   9   1.211   5.464  -0.135
   42   2HG2  THR   9          2HG2      THR   9  -0.403   6.174  -0.118
   43   3HG2  THR   9          3HG2      THR   9   0.472   5.940   1.395
   44    H    LYS  10           H        LYS  10   3.459   8.128  -1.395
   45    HA   LYS  10           HA       LYS  10   5.157  10.338  -0.625
   46   1HB   LYS  10          2HB       LYS  10   5.862   8.638  -2.281
   47   2HB   LYS  10          1HB       LYS  10   4.574   9.165  -3.354
   48   1HG   LYS  10          2HG       LYS  10   5.634  11.170  -3.848
   49   2HG   LYS  10          1HG       LYS  10   6.649  11.099  -2.406
   50   1HD   LYS  10          2HD       LYS  10   7.932  10.632  -4.440
   51   2HD   LYS  10          1HD       LYS  10   7.900   9.241  -3.357
   52   1HE   LYS  10          2HE       LYS  10   6.033   8.312  -4.728
   53   2HE   LYS  10          1HE       LYS  10   6.276   9.644  -5.859
   54   1HZ   LYS  10          1HZ       LYS  10   8.585   8.879  -6.151
   55   2HZ   LYS  10          2HZ       LYS  10   7.456   7.710  -6.629
   56   3HZ   LYS  10          3HZ       LYS  10   8.260   7.548  -5.149
   57    H    ASP  11           H        ASP  11   1.945   9.981  -1.456
   58    HA   ASP  11           HA       ASP  11   1.732  12.724  -2.449
   59   1HB   ASP  11          2HB       ASP  11  -0.215  10.424  -2.415
   60   2HB   ASP  11          1HB       ASP  11  -0.719  12.073  -2.779
   61    H    GLY  12           H        GLY  12   2.014  11.356   0.417
   62   1HA   GLY  12          2HA       GLY  12   1.807  12.408   2.463
   63   2HA   GLY  12          1HA       GLY  12   0.820  13.641   1.698
   64    H    ARG  13           H        ARG  13  -0.028  10.283   1.342
   65    HA   ARG  13           HA       ARG  13  -2.373  10.765   3.036
   66   1HB   ARG  13          2HB       ARG  13  -2.041   8.253   1.452
   67   2HB   ARG  13          1HB       ARG  13  -3.509   9.140   1.845
   68   1HG   ARG  13          2HG       ARG  13  -2.695  10.927   0.274
   69   2HG   ARG  13          1HG       ARG  13  -1.451   9.797  -0.211
   70   1HD   ARG  13          2HD       ARG  13  -4.361   9.076  -0.288
   71   2HD   ARG  13          1HD       ARG  13  -3.571   9.888  -1.633
   72    HE   ARG  13           HE       ARG  13  -1.962   7.792  -1.304
   73   1HH1  ARG  13          1HH1      ARG  13  -5.460   7.940  -1.320
   74   2HH1  ARG  13          2HH1      ARG  13  -5.647   6.404  -2.101
   75   1HH2  ARG  13          1HH2      ARG  13  -2.207   5.765  -2.317
   76   2HH2  ARG  13          2HH2      ARG  13  -3.811   5.172  -2.672
   77    H    MET  14           H        MET  14  -2.613   9.804   4.900
   78    HA   MET  14           HA       MET  14  -0.492   8.010   5.816
   79   1HB   MET  14          2HB       MET  14  -2.451   9.775   7.251
   80   2HB   MET  14          1HB       MET  14  -1.698   8.430   8.095
   81   1HG   MET  14          2HG       MET  14  -0.496  10.483   8.513
   82   2HG   MET  14          1HG       MET  14   0.509   9.349   7.617
   83   1HE   MET  14          1HE       MET  14   1.765  12.767   6.237
   84   2HE   MET  14          2HE       MET  14   2.217  11.231   6.980
   85   3HE   MET  14          3HE       MET  14   1.274  12.410   7.893
   86    H    ILE  15           H        ILE  15  -1.031   6.045   5.070
   87    HA   ILE  15           HA       ILE  15  -3.773   5.099   5.361
   88    HB   ILE  15           HB       ILE  15  -1.379   3.920   3.946
   89   1HG1  ILE  15          2HG1      ILE  15  -3.961   5.093   2.883
   90   2HG1  ILE  15          1HG1      ILE  15  -2.410   5.922   2.911
   91   1HG2  ILE  15          1HG2      ILE  15  -4.199   2.859   4.086
   92   2HG2  ILE  15          2HG2      ILE  15  -2.768   2.116   4.803
   93   3HG2  ILE  15          3HG2      ILE  15  -2.917   2.233   3.049
   94   1HD1  ILE  15          1HD1      ILE  15  -3.065   3.435   1.350
   95   2HD1  ILE  15          2HD1      ILE  15  -1.495   4.235   1.392
   96   3HD1  ILE  15          3HD1      ILE  15  -2.889   5.068   0.703
   97    H    LEU  16           H        LEU  16  -4.392   3.580   6.768
   98    HA   LEU  16           HA       LEU  16  -2.447   2.723   8.759
   99   1HB   LEU  16          2HB       LEU  16  -5.453   2.536   8.632
  100   2HB   LEU  16          1HB       LEU  16  -4.511   1.755   9.884
  101    HG   LEU  16           HG       LEU  16  -5.370   3.783  10.790
  102   1HD1  LEU  16          1HD1      LEU  16  -2.465   4.157  10.080
  103   2HD1  LEU  16          2HD1      LEU  16  -3.102   3.260  11.460
  104   3HD1  LEU  16          3HD1      LEU  16  -3.329   5.007  11.363
  105   1HD2  LEU  16          1HD2      LEU  16  -5.898   4.979   8.761
  106   2HD2  LEU  16          2HD2      LEU  16  -4.184   5.176   8.393
  107   3HD2  LEU  16          3HD2      LEU  16  -4.886   5.984   9.795
  108    H    THR  17           H        THR  17  -1.950   0.599   9.176
  109    HA   THR  17           HA       THR  17  -2.968  -1.413   7.301
  110    HB   THR  17           HB       THR  17  -0.559  -2.299   7.169
  111    HG1  THR  17           HG1      THR  17   0.146   0.375   7.819
  112   1HG2  THR  17          1HG2      THR  17   0.061  -0.777   5.346
  113   2HG2  THR  17          2HG2      THR  17  -1.166   0.369   5.883
  114   3HG2  THR  17          3HG2      THR  17  -1.647  -1.210   5.265
  115    H    ASP  18           H        ASP  18  -2.190  -3.664   8.054
  116    HA   ASP  18           HA       ASP  18  -1.871  -3.743  10.976
  117   1HB   ASP  18          2HB       ASP  18  -2.453  -6.074  10.881
  118   2HB   ASP  18          1HB       ASP  18  -3.635  -5.207   9.914
  119    H    GLY  19           H        GLY  19  -0.075  -2.914   8.824
  120   1HA   GLY  19          2HA       GLY  19   2.214  -2.919   8.492
  121   2HA   GLY  19          1HA       GLY  19   2.339  -4.337   9.535
  122    H    LYS  20           H        LYS  20   3.846  -4.987   7.603
  123    HA   LYS  20           HA       LYS  20   4.039  -6.961   6.468
  124   1HB   LYS  20          2HB       LYS  20   1.113  -7.368   7.082
  125   2HB   LYS  20          1HB       LYS  20   2.293  -8.607   6.676
  126   1HG   LYS  20          2HG       LYS  20   3.503  -8.141   8.745
  127   2HG   LYS  20          1HG       LYS  20   2.332  -6.884   9.146
  128   1HD   LYS  20          2HD       LYS  20   0.554  -8.640   9.088
  129   2HD   LYS  20          1HD       LYS  20   1.831  -9.844   8.900
  130   1HE   LYS  20          2HE       LYS  20   1.405  -7.974  11.223
  131   2HE   LYS  20          1HE       LYS  20   1.235  -9.729  11.218
  132   1HZ   LYS  20          1HZ       LYS  20   3.723  -8.135  11.018
  133   2HZ   LYS  20          2HZ       LYS  20   3.671  -9.772  10.594
  134   3HZ   LYS  20          3HZ       LYS  20   3.315  -9.299  12.183
  135    HA   PRO  21           HA       PRO  21   1.679  -5.206   2.798
  136   1HB   PRO  21          2HB       PRO  21   3.498  -3.630   1.630
  137   2HB   PRO  21          1HB       PRO  21   2.507  -3.047   2.974
  138   1HG   PRO  21          2HG       PRO  21   5.341  -3.997   2.977
  139   2HG   PRO  21          1HG       PRO  21   4.616  -2.637   3.851
  140   1HD   PRO  21          2HD       PRO  21   5.133  -5.118   4.950
  141   2HD   PRO  21          1HD       PRO  21   3.940  -3.964   5.577
  142    H    GLU  22           H        GLU  22   1.678  -6.286   0.898
  143    HA   GLU  22           HA       GLU  22   4.095  -7.813   0.214
  144   1HB   GLU  22          2HB       GLU  22   1.186  -8.243  -0.464
  145   2HB   GLU  22          1HB       GLU  22   2.486  -9.141  -1.231
  146   1HG   GLU  22          2HG       GLU  22   3.170  -9.978   0.979
  147   2HG   GLU  22          1HG       GLU  22   1.799  -9.130   1.696
  148    H    ILE  23           H        ILE  23   5.291  -6.883  -1.279
  149    HA   ILE  23           HA       ILE  23   4.022  -5.092  -3.193
  150    HB   ILE  23           HB       ILE  23   6.964  -5.627  -2.720
  151   1HG1  ILE  23          2HG1      ILE  23   5.167  -3.320  -1.928
  152   2HG1  ILE  23          1HG1      ILE  23   5.893  -4.477  -0.833
  153   1HG2  ILE  23          1HG2      ILE  23   7.335  -3.674  -4.150
  154   2HG2  ILE  23          2HG2      ILE  23   5.597  -3.543  -4.430
  155   3HG2  ILE  23          3HG2      ILE  23   6.485  -4.948  -5.026
  156   1HD1  ILE  23          1HD1      ILE  23   7.381  -2.480  -2.518
  157   2HD1  ILE  23          2HD1      ILE  23   8.109  -3.647  -1.414
  158   3HD1  ILE  23          3HD1      ILE  23   7.075  -2.364  -0.784
  159    H    ASP  24           H        ASP  24   3.205  -6.014  -4.888
  160    HA   ASP  24           HA       ASP  24   4.116  -8.504  -5.969
  161   1HB   ASP  24          2HB       ASP  24   2.181  -6.476  -7.117
  162   2HB   ASP  24          1HB       ASP  24   2.396  -8.127  -7.686
  163    H    ASP  25           H        ASP  25   6.149  -8.396  -6.756
  164    HA   ASP  25           HA       ASP  25   7.144  -5.991  -7.973
  165   1HB   ASP  25          2HB       ASP  25   9.280  -7.282  -8.136
  166   2HB   ASP  25          1HB       ASP  25   8.624  -7.160  -6.507
  167    H    ASP  26           H        ASP  26   5.407  -8.532  -9.213
  168    HA   ASP  26           HA       ASP  26   6.690  -8.784 -11.748
  169   1HB   ASP  26          2HB       ASP  26   3.934  -9.447 -10.752
  170   2HB   ASP  26          1HB       ASP  26   4.303  -9.529 -12.471
  171    H    THR  27           H        THR  27   4.421  -6.549 -10.363
  172    HA   THR  27           HA       THR  27   4.336  -5.096 -12.921
  173    HB   THR  27           HB       THR  27   2.182  -6.084 -12.715
  174    HG1  THR  27           HG1      THR  27   2.050  -3.906 -13.314
  175   1HG2  THR  27          1HG2      THR  27   2.286  -6.707 -10.363
  176   2HG2  THR  27          2HG2      THR  27   0.773  -5.881 -10.734
  177   3HG2  THR  27          3HG2      THR  27   2.068  -5.020  -9.900
  178    H    GLY  28           H        GLY  28   4.460  -4.945  -9.422
  179   1HA   GLY  28          2HA       GLY  28   5.575  -3.125  -8.322
  180   2HA   GLY  28          1HA       GLY  28   5.054  -2.071  -9.631
  181    H    LEU  29           H        LEU  29   2.999  -4.408  -7.989
  182    HA   LEU  29           HA       LEU  29   1.409  -2.165  -6.958
  183   1HB   LEU  29          2HB       LEU  29   0.617  -5.055  -7.346
  184   2HB   LEU  29          1HB       LEU  29  -0.429  -3.779  -6.754
  185    HG   LEU  29           HG       LEU  29   0.763  -3.965  -9.521
  186   1HD1  LEU  29          1HD1      LEU  29  -1.576  -4.210 -10.219
  187   2HD1  LEU  29          2HD1      LEU  29  -2.066  -4.229  -8.525
  188   3HD1  LEU  29          3HD1      LEU  29  -1.056  -5.524  -9.165
  189   1HD2  LEU  29          1HD2      LEU  29  -1.082  -1.883  -8.354
  190   2HD2  LEU  29          2HD2      LEU  29  -0.568  -1.991 -10.039
  191   3HD2  LEU  29          3HD2      LEU  29   0.614  -1.640  -8.777
  192    H    VAL  30           H        VAL  30   0.282  -2.673  -4.827
  193    HA   VAL  30           HA       VAL  30   2.012  -4.221  -3.026
  194    HB   VAL  30           HB       VAL  30   1.071  -1.380  -2.568
  195   1HG1  VAL  30          1HG1      VAL  30   0.864  -2.637  -0.503
  196   2HG1  VAL  30          2HG1      VAL  30   2.215  -1.509  -0.403
  197   3HG1  VAL  30          3HG1      VAL  30   2.520  -3.225  -0.670
  198   1HG2  VAL  30          1HG2      VAL  30   3.031  -1.455  -3.962
  199   2HG2  VAL  30          2HG2      VAL  30   3.833  -2.550  -2.840
  200   3HG2  VAL  30          3HG2      VAL  30   3.486  -0.892  -2.354
  201    H    SER  31           H        SER  31   0.784  -5.680  -2.080
  202    HA   SER  31           HA       SER  31  -2.059  -5.183  -1.655
  203   1HB   SER  31          2HB       SER  31  -1.491  -7.732  -0.721
  204   2HB   SER  31          1HB       SER  31  -2.098  -7.336  -2.324
  205    HG   SER  31           HG       SER  31   0.018  -7.309  -3.094
  206    H    TYR  32           H        TYR  32  -2.773  -4.459   0.245
  207    HA   TYR  32           HA       TYR  32  -1.235  -5.050   2.686
  208   1HB   TYR  32          2HB       TYR  32  -1.281  -2.773   3.410
  209   2HB   TYR  32          1HB       TYR  32  -0.695  -2.749   1.750
  210    HD1  TYR  32           HD2      TYR  32  -2.606  -2.420  -0.075
  211    HD2  TYR  32           HD1      TYR  32  -2.939  -1.274   4.005
  212    HE1  TYR  32           HE2      TYR  32  -4.389  -0.832  -0.676
  213    HE2  TYR  32           HE1      TYR  32  -4.715   0.319   3.419
  214    HH   TYR  32           HH       TYR  32  -5.610   1.498   1.594
  215    H    HIS  33           H        HIS  33  -2.554  -4.380   4.681
  216    HA   HIS  33           HA       HIS  33  -5.427  -4.852   4.191
  217   1HB   HIS  33          2HB       HIS  33  -3.895  -5.382   6.748
  218   2HB   HIS  33          1HB       HIS  33  -5.586  -5.744   6.452
  219    HD1  HIS  33           HD1      HIS  33  -2.359  -7.250   6.508
  220    HD2  HIS  33           HD2      HIS  33  -5.854  -7.831   4.334
  221    HE1  HIS  33           HE1      HIS  33  -2.207  -9.589   5.589
  222    HE2  HIS  33           HE2      HIS  33  -4.463 -10.002   4.539
  223    H    ASP  34           H        ASP  34  -6.874  -3.364   4.965
  224    HA   ASP  34           HA       ASP  34  -5.821  -1.081   6.447
  225   1HB   ASP  34          2HB       ASP  34  -8.107  -1.523   4.770
  226   2HB   ASP  34          1HB       ASP  34  -8.645  -0.932   6.338
  227    H    GLN  35           H        GLN  35  -7.731  -0.378   8.172
  228    HA   GLN  35           HA       GLN  35  -7.228  -2.132  10.355
  229   1HB   GLN  35          2HB       GLN  35  -9.097   0.235  10.185
  230   2HB   GLN  35          1HB       GLN  35  -8.588  -0.560  11.668
  231   1HG   GLN  35          2HG       GLN  35  -6.233   0.039  11.075
  232   2HG   GLN  35          1HG       GLN  35  -6.881   1.003   9.750
  233   1HE2  GLN  35          1HE2      GLN  35  -6.539   0.703  13.185
  234   2HE2  GLN  35          2HE2      GLN  35  -7.050   2.315  13.585
  235    H    GLN  36           H        GLN  36  -9.332  -2.549   7.918
  236    HA   GLN  36           HA       GLN  36 -11.473  -3.686   9.563
  237   1HB   GLN  36          2HB       GLN  36 -11.308  -3.429   6.552
  238   2HB   GLN  36          1HB       GLN  36 -12.724  -3.891   7.481
  239   1HG   GLN  36          2HG       GLN  36 -11.373  -1.202   7.489
  240   2HG   GLN  36          1HG       GLN  36 -12.918  -1.605   6.748
  241   1HE2  GLN  36          1HE2      GLN  36 -13.758  -3.304   8.939
  242   2HE2  GLN  36          2HE2      GLN  36 -14.170  -2.248  10.247
  243    H    GLY  37           H        GLY  37  -8.550  -4.619   8.410
  244   1HA   GLY  37          2HA       GLY  37  -7.581  -6.713   8.177
  245   2HA   GLY  37          1HA       GLY  37  -9.146  -7.433   8.547
  246    H    ASN  38           H        ASN  38  -9.141  -5.062   6.139
  247    HA   ASN  38           HA       ASN  38  -9.777  -7.059   4.119
  248   1HB   ASN  38          2HB       ASN  38 -10.628  -5.078   2.831
  249   2HB   ASN  38          1HB       ASN  38 -11.439  -5.344   4.368
  250   1HD2  ASN  38          1HD2      ASN  38 -11.236  -2.931   2.777
  251   2HD2  ASN  38          2HD2      ASN  38 -10.499  -1.739   3.791
  252    H    ALA  39           H        ALA  39  -8.600  -7.409   2.357
  253    HA   ALA  39           HA       ALA  39  -5.980  -6.118   2.236
  254   1HB   ALA  39          1HB       ALA  39  -6.078  -8.576   2.339
  255   2HB   ALA  39          2HB       ALA  39  -5.296  -7.995   0.869
  256   3HB   ALA  39          3HB       ALA  39  -6.956  -8.588   0.809
  257    H    MET  40           H        MET  40  -5.716  -4.493   0.899
  258    HA   MET  40           HA       MET  40  -7.120  -4.547  -1.689
  259   1HB   MET  40          2HB       MET  40  -6.526  -2.203   0.113
  260   2HB   MET  40          1HB       MET  40  -6.910  -2.004  -1.592
  261   1HG   MET  40          2HG       MET  40  -9.049  -3.096  -1.251
  262   2HG   MET  40          1HG       MET  40  -8.671  -3.340   0.450
  263   1HE   MET  40          1HE       MET  40  -8.599  -1.446   2.236
  264   2HE   MET  40          2HE       MET  40  -8.725   0.273   1.865
  265   3HE   MET  40          3HE       MET  40  -7.323  -0.647   1.317
  266    H    GLN  41           H        GLN  41  -5.911  -3.035  -3.317
  267    HA   GLN  41           HA       GLN  41  -3.036  -3.589  -3.051
  268   1HB   GLN  41          2HB       GLN  41  -4.425  -5.272  -4.434
  269   2HB   GLN  41          1HB       GLN  41  -4.510  -3.992  -5.636
  270   1HG   GLN  41          2HG       GLN  41  -2.122  -3.967  -5.857
  271   2HG   GLN  41          1HG       GLN  41  -1.947  -5.123  -4.536
  272   1HE2  GLN  41          1HE2      GLN  41  -0.899  -6.652  -5.780
  273   2HE2  GLN  41          2HE2      GLN  41  -1.720  -7.550  -7.012
  274    H    ILE  42           H        ILE  42  -1.762  -1.964  -3.587
  275    HA   ILE  42           HA       ILE  42  -2.827   0.273  -5.171
  276    HB   ILE  42           HB       ILE  42  -3.179   1.203  -3.107
  277   1HG1  ILE  42          2HG1      ILE  42  -1.191   2.381  -4.416
  278   2HG1  ILE  42          1HG1      ILE  42  -1.726   2.955  -2.842
  279   1HG2  ILE  42          1HG2      ILE  42  -2.448  -0.702  -1.810
  280   2HG2  ILE  42          2HG2      ILE  42  -1.855   0.796  -1.096
  281   3HG2  ILE  42          3HG2      ILE  42  -0.762  -0.229  -2.027
  282   1HD1  ILE  42          1HD1      ILE  42   0.658   2.900  -2.873
  283   2HD1  ILE  42          2HD1      ILE  42   0.661   1.231  -3.434
  284   3HD1  ILE  42          3HD1      ILE  42   0.087   1.613  -1.810
  285    H    ASN  43           H        ASN  43  -1.301   1.348  -6.445
  286    HA   ASN  43           HA       ASN  43   0.964  -0.182  -7.213
  287   1HB   ASN  43          2HB       ASN  43  -0.234   1.205  -8.816
  288   2HB   ASN  43          1HB       ASN  43   0.191   2.658  -7.920
  289   1HD2  ASN  43          1HD2      ASN  43   1.315   0.189 -10.082
  290   2HD2  ASN  43          2HD2      ASN  43   2.808   0.952 -10.495
  291    H    ARG  44           H        ARG  44   3.150   0.086  -6.833
  292    HA   ARG  44           HA       ARG  44   3.730   1.048  -4.239
  293   1HB   ARG  44          2HB       ARG  44   6.067   0.360  -4.720
  294   2HB   ARG  44          1HB       ARG  44   4.874  -0.889  -5.015
  295   1HG   ARG  44          2HG       ARG  44   6.373  -1.069  -6.786
  296   2HG   ARG  44          1HG       ARG  44   4.998  -0.204  -7.464
  297   1HD   ARG  44          2HD       ARG  44   6.252   1.569  -7.959
  298   2HD   ARG  44          1HD       ARG  44   6.943   1.612  -6.336
  299    HE   ARG  44           HE       ARG  44   8.377  -0.336  -7.300
  300   1HH1  ARG  44          1HH1      ARG  44   7.343   2.526  -9.065
  301   2HH1  ARG  44          2HH1      ARG  44   8.790   2.575 -10.041
  302   1HH2  ARG  44          1HH2      ARG  44  10.225  -0.270  -8.590
  303   2HH2  ARG  44          2HH2      ARG  44  10.407   0.966  -9.797
  304    H    ASP  45           H        ASP  45   3.643   2.797  -7.122
  305    HA   ASP  45           HA       ASP  45   5.737   4.651  -6.420
  306   1HB   ASP  45          2HB       ASP  45   3.662   4.525  -8.567
  307   2HB   ASP  45          1HB       ASP  45   4.442   6.066  -8.227
  308    H    ASP  46           H        ASP  46   2.626   4.091  -5.348
  309    HA   ASP  46           HA       ASP  46   2.020   6.850  -4.693
  310   1HB   ASP  46          2HB       ASP  46   0.284   5.131  -5.363
  311   2HB   ASP  46          1HB       ASP  46   0.556   4.363  -3.807
  312    H    VAL  47           H        VAL  47   2.833   3.839  -2.974
  313    HA   VAL  47           HA       VAL  47   2.941   5.048  -0.396
  314    HB   VAL  47           HB       VAL  47   4.249   2.989   0.267
  315   1HG1  VAL  47          1HG1      VAL  47   2.288   1.489   0.048
  316   2HG1  VAL  47          2HG1      VAL  47   1.562   2.665  -1.046
  317   3HG1  VAL  47          3HG1      VAL  47   1.882   3.104   0.629
  318   1HG2  VAL  47          1HG2      VAL  47   3.627   2.154  -2.568
  319   2HG2  VAL  47          2HG2      VAL  47   4.283   1.106  -1.307
  320   3HG2  VAL  47          3HG2      VAL  47   5.231   2.468  -1.908
  321    H    SER  48           H        SER  48   4.935   5.098   0.950
  322    HA   SER  48           HA       SER  48   7.431   5.449  -0.438
  323   1HB   SER  48          2HB       SER  48   6.328   7.601  -0.891
  324   2HB   SER  48          1HB       SER  48   6.081   7.843   0.838
  325    HG   SER  48           HG       SER  48   8.473   7.896  -0.653
  326    H    GLN  49           H        GLN  49   5.988   6.684   2.599
  327    HA   GLN  49           HA       GLN  49   8.399   5.783   3.974
  328   1HB   GLN  49          2HB       GLN  49   6.163   7.593   4.884
  329   2HB   GLN  49          1HB       GLN  49   7.542   7.138   5.876
  330   1HG   GLN  49          2HG       GLN  49   9.043   8.187   4.238
  331   2HG   GLN  49          1HG       GLN  49   7.640   8.682   3.292
  332   1HE2  GLN  49          1HE2      GLN  49   7.650   8.637   6.780
  333   2HE2  GLN  49          2HE2      GLN  49   7.606  10.352   6.990
  334    H    ILE  50           H        ILE  50   8.133   3.637   4.285
  335    HA   ILE  50           HA       ILE  50   6.375   3.024   6.520
  336    HB   ILE  50           HB       ILE  50   5.072   2.191   4.668
  337   1HG1  ILE  50          2HG1      ILE  50   6.458  -0.136   6.019
  338   2HG1  ILE  50          1HG1      ILE  50   5.192   0.840   6.755
  339   1HG2  ILE  50          1HG2      ILE  50   7.503   0.618   3.836
  340   2HG2  ILE  50          2HG2      ILE  50   6.820   2.008   2.992
  341   3HG2  ILE  50          3HG2      ILE  50   5.900   0.508   3.108
  342   1HD1  ILE  50          1HD1      ILE  50   3.630   0.119   5.037
  343   2HD1  ILE  50          2HD1      ILE  50   4.318  -1.257   5.897
  344   3HD1  ILE  50          3HD1      ILE  50   4.894  -0.849   4.281
  345    H    ILE  51           H        ILE  51   8.952   1.842   4.384
  346    HA   ILE  51           HA       ILE  51  10.149   0.327   6.544
  347    HB   ILE  51           HB       ILE  51  10.233  -0.582   4.271
  348   1HG1  ILE  51          2HG1      ILE  51  12.978   0.216   5.270
  349   2HG1  ILE  51          1HG1      ILE  51  12.039  -1.155   5.848
  350   1HG2  ILE  51          1HG2      ILE  51  10.286   1.522   3.031
  351   2HG2  ILE  51          2HG2      ILE  51  11.587   0.445   2.524
  352   3HG2  ILE  51          3HG2      ILE  51  11.935   1.811   3.584
  353   1HD1  ILE  51          1HD1      ILE  51  13.078  -0.799   3.048
  354   2HD1  ILE  51          2HD1      ILE  51  12.175  -2.187   3.654
  355   3HD1  ILE  51          3HD1      ILE  51  13.782  -1.832   4.289
  356    H    GLU  52           H        GLU  52  10.391   3.441   5.098
  357    HA   GLU  52           HA       GLU  52  13.004   4.017   6.223
  358   1HB   GLU  52          2HB       GLU  52  11.068   5.802   4.731
  359   2HB   GLU  52          1HB       GLU  52  12.717   6.224   5.170
  360   1HG   GLU  52          2HG       GLU  52  11.913   3.999   3.308
  361   2HG   GLU  52          1HG       GLU  52  12.535   5.577   2.826
  362    H    ARG  53           H        ARG  53   9.997   3.812   7.416
  363    HA   ARG  53           HA       ARG  53   8.901   4.549   9.244
  364   1HB   ARG  53          2HB       ARG  53  11.590   5.675  10.048
  365   2HB   ARG  53          1HB       ARG  53  10.196   5.503  11.103
  366   1HG   ARG  53          2HG       ARG  53  10.295   3.088  10.889
  367   2HG   ARG  53          1HG       ARG  53  11.657   3.228   9.772
  368   1HD   ARG  53          2HD       ARG  53  12.980   4.302  11.531
  369   2HD   ARG  53          1HD       ARG  53  11.620   4.152  12.643
  370    HE   ARG  53           HE       ARG  53  12.423   1.634  11.540
  371   1HH1  ARG  53          1HH1      ARG  53  13.228   4.021  13.965
  372   2HH1  ARG  53          2HH1      ARG  53  13.935   2.866  15.062
  373   1HH2  ARG  53          1HH2      ARG  53  13.370   0.103  12.949
  374   2HH2  ARG  53          2HH2      ARG  53  14.010   0.631  14.486