*HEADER    MEMBRANE PROTEIN                        10-MAR-04   1SN6              
*TITLE     NMR SOLUTION STRUCTURE OF HUMAN SAPOSIN C IN SDS MICELLES             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROACTIVATOR POLYPEPTIDE;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SAPOSIN C;                                                 
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: PSAP;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-30B                                   
*KEYWDS    3 DISULFIDE BRIDGES, ALL ALPHA-HELICES, ALPHA-HELICES                 
*KEYWDS   2 CONNECTED BY TURNS                                                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.A.HAWKINS, E.DE ALBA, N.TJANDRA                                     
*REVDAT   1   01-MAR-05 1SN6    0                                                
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assign	( resid 67  and name N )
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	( resid 68  and name N ) 5.00 139.10 30  2

assign	( resid 68  and name N )
	( resid 68  and name CA ) 
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assign	( resid 70  and name N )
	( resid 70  and name CA ) 
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assign	( resid 71  and name N )
	( resid 71  and name CA ) 
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assign	( resid 72  and name N )
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assign	( resid 73  and name N )
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assign	( resid 74  and name N )
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assign	( resid 75  and name N )
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assign	( resid 77  and name N )
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assign	( resid 82  and name N )
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assign (resid   4 and name HN  ) (resid   5 and name HN  )  3.1  1.1  1.1
assign (resid   5 and name HN  ) (resid   6 and name HN  )  3.2  1.1  1.1
assign (resid   8 and name HN  ) (resid   9 and name HN  )  3.6  1.3  1.3
assign (resid   9 and name HN  ) (resid  10 and name HN  )  3.3  1.2  1.2
assign (resid  10 and name HN  ) (resid  11 and name HN  )  2.8  1.0  1.0
assign (resid  11 and name HN  ) (resid  12 and name HN  )  2.4  0.8  0.8
assign (resid  11 and name HN  ) (resid  13 and name HN  )  3.8  1.3  1.3
assign (resid  12 and name HN  ) (resid  13 and name HN  )  3.0  1.0  1.0
assign (resid  12 and name HN  ) (resid  14 and name HN  )  4.7  1.7  1.7
assign (resid  14 and name HN  ) (resid  15 and name HN  )  2.8  1.0  1.0
assign (resid  15 and name HN  ) (resid  16 and name HN  )  3.0  1.0  1.0
assign (resid  15 and name HN  ) (resid  17 and name HN  )  5.1  1.8  1.8
assign (resid  16 and name HN  ) (resid  17 and name HN  )  3.3  1.1  1.1
assign (resid  16 and name HN  ) (resid  18 and name HN  )  4.4  1.5  1.5
assign (resid  17 and name HN  ) (resid  18 and name HN  )  2.4  0.8  0.8
assign (resid  18 and name HN  ) (resid  19 and name HN  )  3.0  1.1  1.1
assign (resid  19 and name HN  ) (resid  20 and name HN  )  3.3  1.2  1.2
assign (resid  22 and name HN  ) (resid  23 and name HN  )  2.4  0.8  0.8
assign (resid  23 and name HN  ) (resid  24 and name HN  )  4.6  1.6  1.6
assign (resid  24 and name HN  ) (resid  27 and name HN  )  5.0  1.8  1.8
assign (resid  25 and name HN  ) (resid  26 and name HN  )  3.0  1.1  1.1
assign (resid  27 and name HN  ) (resid  28 and name HN  )  3.3  1.2  1.2
assign (resid  28 and name HN  ) (resid  29 and name HN  )  3.0  1.0  1.0
assign (resid  28 and name HN  ) (resid  30 and name HN  )  4.2  1.5  1.5
assign (resid  28 and name HN  ) (resid  31 and name HN  )  3.4  1.2  1.2
assign (resid  30 and name HN  ) (resid  31 and name HN  )  2.5  0.9  0.9
assign (resid  31 and name HN  ) (resid  32 and name HN  )  2.7  1.0  1.0
assign (resid  31 and name HN  ) (resid  33 and name HN  )  4.3  1.5  1.5
assign (resid  31 and name HN  ) (resid  34 and name HN  )  4.8  1.7  1.7
assign (resid  33 and name HN  ) (resid  34 and name HN  )  2.3  0.8  0.8
assign (resid  34 and name HN  ) (resid  35 and name HN  )  2.6  0.9  0.9
assign (resid  35 and name HN  ) (resid  36 and name HN  )  2.6  0.9  0.9
assign (resid  35 and name HN  ) (resid  37 and name HN  )  3.9  1.4  1.4
assign (resid  36 and name HN  ) (resid  37 and name HN  )  2.8  1.0  1.0
assign (resid  36 and name HN  ) (resid  38 and name HN  )  4.9  1.7  1.7
assign (resid  36 and name HN  ) (resid  39 and name HN  )  4.9  1.7  1.7
assign (resid  37 and name HN  ) (resid  38 and name HN  )  3.1  1.1  1.1
assign (resid  37 and name HN  ) (resid  39 and name HN  )  4.7  1.6  1.6
assign (resid  38 and name HN  ) (resid  39 and name HN  )  2.6  0.9  0.9
assign (resid  43 and name HN  ) (resid  44 and name HN  )  2.3  0.8  0.8
assign (resid  43 and name HN  ) (resid  45 and name HN  )  3.4  1.2  1.2
assign (resid  44 and name HN  ) (resid  45 and name HN  )  2.7  0.9  0.9
assign (resid  45 and name HN  ) (resid  46 and name HN  )  2.6  0.9  0.9
assign (resid  47 and name HN  ) (resid  48 and name HN  )  2.9  1.0  1.0
assign (resid  49 and name HN  ) (resid  50 and name HN  )  2.7  0.9  0.9
assign (resid  49 and name HN  ) (resid  51 and name HN  )  4.6  1.6  1.6
assign (resid  49 and name HN  ) (resid  52 and name HN  )  5.7  2.0  2.0
assign (resid  50 and name HN  ) (resid  51 and name HN  )  2.7  0.9  0.9
assign (resid  51 and name HN  ) (resid  52 and name HN  )  2.7  0.9  0.9
assign (resid  52 and name HN  ) (resid  53 and name HN  )  2.8  1.0  1.0
assign (resid  53 and name HN  ) (resid  54 and name HN  )  2.9  1.0  1.0
assign (resid  55 and name HN  ) (resid  56 and name HN  )  2.6  0.9  0.9
assign (resid  55 and name HN  ) (resid  57 and name HN  )  3.8  1.3  1.3
assign (resid  56 and name HN  ) (resid  57 and name HN  )  2.4  0.8  0.8
assign (resid  56 and name HN  ) (resid  58 and name HN  )  4.9  1.7  1.7
assign (resid  56 and name HN  ) (resid  59 and name HN  )  5.7  2.0  2.0
assign (resid  57 and name HN  ) (resid  58 and name HN  )  2.5  0.9  0.9
assign (resid  57 and name HN  ) (resid  59 and name HN  )  3.3  1.2  1.2
assign (resid  57 and name HN  ) (resid  60 and name HN  )  3.1  1.1  1.1
assign (resid  59 and name HN  ) (resid  60 and name HN  )  2.3  0.8  0.8
assign (resid  59 and name HN  ) (resid  61 and name HN  )  4.4  1.5  1.5
assign (resid  60 and name HN  ) (resid  61 and name HN  )  2.8  1.0  1.0
assign (resid  61 and name HN  ) (resid  62 and name HN  )  2.8  1.0  1.0
assign (resid  61 and name HN  ) (resid  63 and name HN  )  3.7  1.3  1.3
assign (resid  63 and name HN  ) (resid  64 and name HN  )  2.4  0.9  0.9
assign (resid  64 and name HN  ) (resid  65 and name HN  )  2.7  0.9  0.9
assign (resid  65 and name HN  ) (resid  66 and name HN  )  2.7  0.9  0.9
assign (resid  69 and name HN  ) (resid  70 and name HN  )  3.3  1.2  1.2
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assign (resid  70 and name HN  ) (resid  72 and name HN  )  5.0  1.8  1.8
assign (resid  71 and name HN  ) (resid  72 and name HN  )  3.0  1.0  1.0
assign (resid  72 and name HN  ) (resid  73 and name HN  )  2.9  1.0  1.0
assign (resid  74 and name HN  ) (resid  75 and name HN  )  3.4  1.2  1.2
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assign (resid  77 and name HN  ) (resid  78 and name HN  )  3.3  1.1  1.1
assign (resid  79 and name HN  ) (resid  80 and name HN  )  4.9  1.7  1.7

assign (resid 2 and (name HB2 or name HB1 )) (resid 3 and name HN ) 3.2 1.3 1.3
assign (resid 2 and name HA ) (resid 3 and name HN ) 2.0 0.8 0.8
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assign (resid 3 and (name HG1# or name HG2# )) (resid 3 and name HN ) 1.8 0.7 0.7
assign (resid 3 and (name HG1# or name HG2# )) (resid 4 and name HN ) 2.5 1.0 1.0
assign (resid 3 and (name HG1# or name HG2# )) (resid 6 and name HN ) 3.6 1.4 1.4
assign (resid 3 and (name HG1# or name HG2# )) (resid 7 and name HN ) 3.7 1.5 1.5
assign (resid 3 and (name HG2# or name HG1# )) (resid 3 and name HN ) 2.0 0.8 0.8
assign (resid 3 and (name HG2# or name HG1# )) (resid 4 and name HN ) 2.5 1.0 1.0
assign (resid 3 and (name HG2# or name HG1# )) (resid 7 and name HN ) 3.3 1.3 1.3
assign (resid 3 and name HA ) (resid 3 and name HN ) 2.1 0.8 0.8
assign (resid 3 and name HA ) (resid 4 and name HN ) 3.5 1.4 1.4
assign (resid 3 and name HA ) (resid 6 and name HN ) 3.3 1.3 1.3
assign (resid 3 and name HB ) (resid 3 and name HN ) 1.9 0.8 0.8
assign (resid 3 and name HB ) (resid 4 and name HN ) 2.8 1.1 1.1
assign (resid 3 and name HB ) (resid 6 and name HN ) 4.1 1.6 1.6
assign (resid 3 and name HN ) (resid 7 and (name HG2# or name HG1# )) 4.8 1.9 1.9
assign (resid 4 and (name HD1 or name HD2 )) (resid 4 and name HN ) 4.0 1.6 1.6
assign (resid 4 and name HA ) (resid 4 and name HN ) 3.1 1.2 1.2
assign (resid 4 and name HA ) (resid 5 and name HN ) 4.1 1.6 1.6
assign (resid 4 and name HA ) (resid 7 and name HN ) 3.9 1.6 1.6
assign (resid 4 and name HB# ) (resid 4 and name HN ) 3.3 1.3 1.3
assign (resid 5 and name HA ) (resid 5 and name HN ) 3.0 1.2 1.2
assign (resid 5 and name HA ) (resid 6 and name HN ) 3.5 1.4 1.4
assign (resid 5 and (name HB1 or name HB2 )) (resid 5 and name HN ) 5.1 5.1 5.1
assign (resid 5 and (name HB2 or name HB1 )) (resid 5 and name HN ) 3.9 1.6 1.6
assign (resid 5 and (name HB1 or name HB2 )) (resid 6 and name HN ) 4.1 1.6 1.6
assign (resid 5 and (name HB2 or name HB1 )) (resid 6 and name HN ) 3.7 1.5 1.5
assign (resid 5 and (name HB2 or name HB1 )) (resid 7 and name HN ) 4.4 1.8 1.8
assign (resid 5 and name HN ) (resid 6 and name HG# ) 4.3 1.7 1.7
assign (resid 6 and name HA ) (resid 10 and name HN ) 4.5 1.8 1.8
assign (resid 6 and name HA ) (resid 6 and name HN ) 3.4 1.4 1.4
assign (resid 6 and name HB# ) (resid 6 and name HN ) 2.4 1.0 1.0
assign (resid 6 and name HB# ) (resid 7 and name HN ) 3.5 1.4 1.4
assign (resid 6 and name HG# ) (resid 6 and name HN ) 2.5 1.0 1.0
assign (resid 6 and name HG# ) (resid 7 and name HN ) 4.1 1.6 1.6
assign (resid 7 and (name HG1# or name HG2# )) (resid 7 and name HN ) 1.9 0.8 0.8
assign (resid 7 and (name HG1# or name HG2# )) (resid 8 and name HN ) 2.9 1.2 1.2
assign (resid 7 and (name HG1# or name HG2# )) (resid 9 and name HN ) 5.0 2.0 2.0
assign (resid 7 and (name HG2# or name HG1# )) (resid 7 and name HN ) 2.4 1.0 1.0
assign (resid 7 and (name HG2# or name HG1# )) (resid 8 and name HN ) 2.8 1.1 1.1
assign (resid 7 and (name HG2# or name HG1# )) (resid 9 and name HN ) 4.9 2.0 2.0
assign (resid 7 and name HA ) (resid 10 and name HN ) 3.6 1.4 1.4
assign (resid 7 and name HA ) (resid 7 and name HN ) 2.9 1.2 1.2
assign (resid 7 and name HB ) (resid 7 and name HN ) 2.3 0.9 0.9
assign (resid 7 and name HB ) (resid 8 and name HN ) 3.1 1.2 1.2
assign (resid 8 and (name HB1 or name HB2 )) (resid 8 and name HN ) 3.6 1.4 1.4
assign (resid 8 and (name HB1 or name HB2 )) (resid 9 and name HN ) 4.8 1.9 1.9
assign (resid 8 and (name HB2 or name HB1 )) (resid 8 and name HN ) 3.2 1.3 1.3
assign (resid 8 and (name HB2 or name HB1 )) (resid 9 and name HN ) 4.3 1.7 1.7
assign (resid 8 and name HA ) (resid 11 and name HN ) 4.5 1.8 1.8
assign (resid 8 and name HA ) (resid 8 and name HN ) 2.9 1.2 1.2
assign (resid 8 and name HA ) (resid 9 and name HN ) 4.8 1.9 1.9
assign (resid 8 and name HN ) (resid 11 and (name HD1# or name HD2# )) 3.7 1.5 1.5
assign (resid 9 and (name HB1 or name HB2 )) (resid 9 and name HN ) 4.7 1.9 1.9
assign (resid 9 and (name HB2 or name HB1 )) (resid 9 and name HN ) 4.1 1.6 1.6
assign (resid 9 and name HA ) (resid 9 and name HN ) 3.5 1.4 1.4
assign (resid 9 and name HG# ) (resid 9 and name HN ) 4.3 1.7 1.7
assign (resid 9 and name HN ) (resid 10 and (name HB1 or name HB2 )) 4.7 1.9 1.9
assign (resid 9 and name HN ) (resid 11 and (name HD1# or name HD2# )) 4.6 1.8 1.8
assign (resid 10 and name HA ) (resid 10 and name HN ) 2.8 1.1 1.1
assign (resid 10 and name HA ) (resid 11 and name HN ) 3.8 1.5 1.5
assign (resid 10 and name HA ) (resid 14 and name HN ) 4.6 1.8 1.8
assign (resid 10 and (name HB1 or name HB2 )) (resid 10 and name HN ) 3.0 1.2 1.2
assign (resid 10 and (name HB1 or name HB2 )) (resid 11 and name HN ) 4.1 1.6 1.6
assign (resid 11 and (name HB1 or name HB2 )) (resid 11 and name HN ) 2.9 1.2 1.2
assign (resid 11 and (name HB1 or name HB2 )) (resid 12 and name HN ) 3.3 1.3 1.3
assign (resid 11 and (name HB2 or name HB1 )) (resid 11 and name HN ) 3.0 1.2 1.2
assign (resid 11 and (name HB2 or name HB1 )) (resid 12 and name HN ) 3.8 1.5 1.5
assign (resid 11 and (name HD1# or name HD2# )) (resid 11 and name HN ) 2.9 1.2 1.2
assign (resid 11 and (name HD1# or name HD2# )) (resid 12 and name HN ) 4.3 1.7 1.7
assign (resid 11 and (name HD1# or name HD2# )) (resid 15 and name HN ) 4.0 1.6 1.6
assign (resid 11 and (name HD2# or name HD1# )) (resid 11 and name HN ) 2.6 1.0 1.0
assign (resid 11 and (name HD2# or name HD1# )) (resid 12 and name HN ) 3.6 1.4 1.4
assign (resid 11 and (name HD2# or name HD1# )) (resid 14 and name HN ) 3.6 1.4 1.4
assign (resid 11 and (name HD2# or name HD1# )) (resid 15 and name HN ) 3.3 1.3 1.3
assign (resid 11 and name HA ) (resid 11 and name HN ) 3.0 1.2 1.2
assign (resid 11 and name HA ) (resid 12 and name HN ) 3.6 1.4 1.4
assign (resid 11 and name HA ) (resid 13 and name HN ) 4.4 1.8 1.8
assign (resid 11 and name HA ) (resid 14 and name HN ) 3.6 1.4 1.4
assign (resid 11 and name HG ) (resid 11 and name HN ) 2.6 1.0 1.0
assign (resid 11 and name HG ) (resid 12 and name HN ) 4.3 1.7 1.7
assign (resid 12 and (name HG1# or name HG2# )) (resid 12 and name HN ) 2.0 0.8 0.8
assign (resid 12 and (name HG1# or name HG2# )) (resid 13 and name HN ) 2.7 1.1 1.1
assign (resid 12 and (name HG2# or name HG1# )) (resid 12 and name HN ) 2.5 1.0 1.0
assign (resid 12 and name HA ) (resid 12 and name HN ) 2.7 1.1 1.1
assign (resid 12 and name HA ) (resid 13 and name HN ) 4.1 1.6 1.6
assign (resid 12 and name HA ) (resid 15 and name HN ) 3.6 1.4 1.4
assign (resid 12 and name HA ) (resid 16 and name HN ) 4.3 1.7 1.7
assign (resid 12 and name HB ) (resid 12 and name HN ) 2.6 1.0 1.0
assign (resid 12 and name HB ) (resid 13 and name HN ) 2.8 1.1 1.1
assign (resid 12 and name HN ) (resid 13 and name HB# ) 4.2 1.7 1.7
assign (resid 13 and name HA ) (resid 13 and name HN ) 2.8 1.1 1.1
assign (resid 13 and name HA ) (resid 14 and name HN ) 3.9 1.6 1.6
assign (resid 13 and name HA ) (resid 16 and name HN ) 4.0 1.6 1.6
assign (resid 13 and name HB# ) (resid 14 and name HN ) 2.5 1.0 1.0
assign (resid 13 and name HD# ) (resid 13 and name HN ) 3.2 1.3 1.3
assign (resid 13 and name HD# ) (resid 14 and name HN ) 3.9 1.6 1.6
assign (resid 13 and name HE# ) (resid 13 and name HN ) 4.4 1.8 1.8
assign (resid 14 and (name HB1 or name HB2 )) (resid 14 and name HN ) 3.3 1.3 1.3
assign (resid 14 and (name HB2 or name HB1 )) (resid 14 and name HN ) 3.1 1.2 1.2
assign (resid 14 and name HA ) (resid 14 and name HN ) 2.5 1.0 1.0
assign (resid 14 and name HA ) (resid 15 and name HN ) 3.4 1.4 1.4
assign (resid 14 and name HA ) (resid 16 and name HN ) 4.9 2.0 2.0
assign (resid 14 and name HA ) (resid 17 and name HN ) 3.9 1.6 1.6
assign (resid 14 and name HB# ) (resid 15 and name HN ) 3.5 1.4 1.4
assign (resid 14 and name HN ) (resid 15 and (name HG1# or name HG2# )) 3.4 1.4 1.4
assign (resid 14 and name HN ) (resid 15 and name HB ) 4.2 1.7 1.7
assign (resid 15 and (name HG1# or name HG2# )) (resid 15 and name HN ) 1.9 0.8 0.8
assign (resid 15 and (name HG1# or name HG2# )) (resid 16 and name HN ) 2.7 1.1 1.1
assign (resid 15 and (name HG1# or name HG2# )) (resid 18 and name HN ) 4.5 1.8 1.8
assign (resid 15 and (name HG2# or name HG1# )) (resid 15 and name HN ) 2.3 0.9 0.9
assign (resid 15 and (name HG2# or name HG1# )) (resid 16 and name HN ) 2.7 1.1 1.1
assign (resid 15 and (name HG2# or name HG1# )) (resid 18 and name HN ) 4.2 1.7 1.7
assign (resid 15 and name HA ) (resid 15 and name HN ) 2.5 1.0 1.0
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assign (resid 15 and name HA ) (resid 18 and name HN ) 3.8 1.5 1.5
assign (resid 15 and name HA ) (resid 19 and name HN ) 4.8 1.9 1.9
assign (resid 15 and name HB ) (resid 15 and name HN ) 2.2 0.9 0.9
assign (resid 15 and name HB ) (resid 16 and name HN ) 2.9 1.2 1.2
assign (resid 15 and name HN ) (resid 16 and name HG2# ) 3.9 1.6 1.6
assign (resid 15 and name HN ) (resid 17 and name HB# ) 3.4 1.4 1.4
assign (resid 16 and name HA ) (resid 16 and name HN ) 2.7 1.1 1.1
assign (resid 16 and name HA ) (resid 17 and name HN ) 4.0 1.6 1.6
assign (resid 16 and name HA ) (resid 18 and name HN ) 4.4 1.8 1.8
assign (resid 16 and name HB ) (resid 16 and name HN ) 3.1 1.2 1.2
assign (resid 16 and name HB ) (resid 17 and name HN ) 3.2 1.3 1.3
assign (resid 16 and name HG2# ) (resid 16 and name HN ) 2.2 0.9 0.9
assign (resid 16 and name HG2# ) (resid 17 and name HN ) 2.9 1.2 1.2
assign (resid 16 and name HN ) (resid 17 and name HB# ) 4.4 1.8 1.8
assign (resid 16 and name HN ) (resid 17 and name HD# ) 4.7 1.9 1.9
assign (resid 17 and (name HG1 or name HG2 )) (resid 17 and name HN ) 2.8 1.1 1.1
assign (resid 17 and (name HG2 or name HG1 )) (resid 17 and name HN ) 3.0 1.2 1.2
assign (resid 17 and name HA ) (resid 17 and name HN ) 2.5 1.0 1.0
assign (resid 17 and name HB# ) (resid 17 and name HN ) 2.2 0.9 0.9
assign (resid 17 and name HB# ) (resid 18 and name HN ) 2.9 1.2 1.2
assign (resid 17 and name HD# ) (resid 17 and name HN ) 3.0 1.2 1.2
assign (resid 17 and name HD# ) (resid 18 and name HN ) 4.5 1.8 1.8
assign (resid 17 and name HN ) (resid 18 and (name HD1# or name HD2# )) 4.5 1.8 1.8
assign (resid 17 and name HN ) (resid 18 and name HG ) 4.7 1.9 1.9
assign (resid 18 and (name HB1 or name HB2 )) (resid 18 and name HN ) 2.5 1.0 1.0
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assign (resid 18 and (name HB2 or name HB1 )) (resid 18 and name HN ) 2.9 1.2 1.2
assign (resid 18 and (name HB2 or name HB1 )) (resid 19 and name HN ) 3.7 1.5 1.5
assign (resid 18 and (name HD1# or name HD2# )) (resid 18 and name HN ) 2.4 1.0 1.0
assign (resid 18 and (name HD1# or name HD2# )) (resid 22 and (name HD22 or name HD21 )) 2.5 1.0 1.0
assign (resid 18 and (name HD2# or name HD1# )) (resid 18 and name HN ) 2.4 1.0 1.0
assign (resid 18 and name HA ) (resid 18 and name HN ) 2.5 1.0 1.0
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assign (resid 18 and name HA ) (resid 22 and name HN ) 4.5 1.8 1.8
assign (resid 18 and name HG ) (resid 18 and name HN ) 2.2 0.9 0.9
assign (resid 18 and name HN ) (resid 19 and name HB ) 4.2 1.7 1.7
assign (resid 19 and (name HG12 or name HG13 )) (resid 19 and name HN ) 3.4 1.4 1.4
assign (resid 19 and (name HG13 or name HG12 )) (resid 19 and name HN ) 3.9 1.6 1.6
assign (resid 19 and name HA ) (resid 19 and name HN ) 3.7 1.5 1.5
assign (resid 19 and name HA ) (resid 20 and name HN ) 2.7 1.1 1.1
assign (resid 19 and name HA ) (resid 21 and name HN ) 4.8 1.9 1.9
assign (resid 19 and name HB ) (resid 19 and name HN ) 2.6 1.0 1.0
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assign (resid 19 and name HD1# ) (resid 19 and name HN ) 2.5 1.0 1.0
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assign (resid 19 and name HG2# ) (resid 19 and name HN ) 2.5 1.0 1.0
assign (resid 19 and name HG2# ) (resid 20 and name HN ) 2.8 1.1 1.1
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assign (resid 20 and name HA ) (resid 20 and name HN ) 3.1 1.2 1.2
assign (resid 20 and name HB# ) (resid 20 and name HN ) 3.0 1.2 1.2
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assign (resid 21 and name HA ) (resid 21 and name HN ) 2.1 0.8 0.8
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assign (resid 21 and name HB# ) (resid 21 and (name HD21 or name HD22 )) 2.5 1.0 1.0
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assign (resid 21 and name HN ) (resid 22 and name HA ) 3.8 1.5 1.5
assign (resid 22 and name HA ) (resid 22 and name HN ) 2.6 1.0 1.0
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assign (resid 22 and name HB# ) (resid 22 and (name HD21 or name HD22 )) 2.0 0.8 0.8
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assign (resid 23 and name HA ) (resid 23 and name HN ) 2.8 1.1 1.1
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assign (resid 25 and name HA ) (resid 25 and name HN ) 3.5 1.4 1.4
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assign (resid 25 and name HB# ) (resid 25 and name HN ) 2.5 1.0 1.0
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assign (resid 25 and name HG# ) (resid 25 and name HN ) 3.5 1.4 1.4
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assign (resid 26 and name HA ) (resid 26 and name HN ) 2.8 1.1 1.1
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assign (resid 26 and name HN ) (resid 27 and name HA ) 3.5 1.4 1.4
assign (resid 26 and name HN ) (resid 29 and (name HD1# or name HD2# )) 3.7 1.5 1.5
assign (resid 27 and name HA ) (resid 27 and name HN ) 3.0 1.2 1.2
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assign (resid 27 and name HG# ) (resid 27 and name HN ) 3.7 1.5 1.5
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assign (resid 28 and name HA ) (resid 28 and name HN ) 2.9 1.2 1.2
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assign (resid 28 and name HB ) (resid 28 and name HN ) 2.5 1.0 1.0
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assign (resid 28 and name HN ) (resid 29 and (name HD1# or name HD2# )) 3.3 1.3 1.3
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assign (resid 30 and (name HB1 or name HB2 )) (resid 30 and name HN ) 2.8 1.1 1.1
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assign (resid 30 and name HA ) (resid 30 and name HN ) 2.9 1.2 1.2
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assign (resid 30 and name HN ) (resid 31 and name HB# ) 2.9 1.2 1.2
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assign (resid 31 and name HA ) (resid 31 and name HN ) 2.5 1.0 1.0
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assign (resid 32 and name HA ) (resid 32 and name HN ) 2.8 1.1 1.1
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assign (resid 32 and name HA ) (resid 35 and name HN ) 3.2 1.3 1.3
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assign (resid 33 and (name HB1 or name HB2 )) (resid 33 and name HN ) 2.7 1.1 1.1
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assign (resid 35 and name HA ) (resid 35 and name HN ) 2.2 0.9 0.9
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assign (resid 35 and (name HB2 or name HB1 )) (resid 35 and name HN ) 2.3 0.9 0.9
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assign (resid 55 and name HN ) (resid 57 and (name HB2 or name HB1 )) 2.7 1.1 1.1
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assign (resid 4 and name HB# ) (resid 77 and (name HD1# or name HD2# )) 3.8 1.5 1.5
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assign (resid 4 and name HD# ) (resid 4 and name HE# ) 1.6 0.6 0.6
assign (resid 4 and name HD# ) (resid 7 and (name HG1# or name HG2# )) 2.8 1.1 1.1
assign (resid 4 and name HD# ) (resid 7 and (name HG2# or name HG1# )) 2.5 1.0 1.0
assign (resid 4 and name HD# ) (resid 7 and name HB ) 3.3 1.3 1.3
assign (resid 4 and name HD# ) (resid 77 and (name HD1# or name HD2# )) 3.4 1.4 1.4
assign (resid 4 and name HD# ) (resid 77 and (name HD2# or name HD1# )) 2.2 0.9 0.9
assign (resid 4 and name HE# ) (resid 7 and (name HG1# or name HG2# )) 3.9 1.6 1.6
assign (resid 4 and name HE# ) (resid 77 and (name HD1# or name HD2# )) 4.5 1.8 1.8
assign (resid 4 and name HE# ) (resid 77 and (name HD2# or name HD1# )) 2.6 1.0 1.0
assign (resid 5 and (name HB1 or name HB2 )) (resid 78 and name HA ) 3.8 1.5 1.5
assign (resid 5 and (name HB2 or name HB1 )) (resid 77 and (name HD1# or name HD2# )) 5.0 2.0 2.0
assign (resid 5 and (name HB2 or name HB1 )) (resid 77 and (name HD2# or name HD1# )) 4.2 1.7 1.7
assign (resid 5 and (name HB2 or name HB1 )) (resid 78 and name HA ) 3.8 1.5 1.5
assign (resid 5 and name HA ) (resid 8 and (name HB1 or name HB2 )) 4.1 1.6 1.6
assign (resid 5 and name HA ) (resid 8 and (name HB2 or name HB1 )) 4.4 1.8 1.8
assign (resid 5 and name HA ) (resid 77 and (name HD1# or name HD2# )) 3.4 1.4 1.4
assign (resid 5 and name HA ) (resid 77 and (name HD2# or name HD1# )) 3.6 1.4 1.4
assign (resid 5 and name HA ) (resid 78 and name HA ) 3.7 1.5 1.5
assign (resid 6 and name HA ) (resid 6 and name HG# ) 3.1 1.2 1.2
assign (resid 6 and name HB# ) (resid 6 and name HG# ) 2.3 0.9 0.9
assign (resid 6 and name HB# ) (resid 7 and (name HG1# or name HG2# )) 3.2 1.3 1.3
assign (resid 6 and name HB# ) (resid 7 and (name HG2# or name HG1# )) 3.1 1.2 1.2
assign (resid 7 and (name HG1# or name HG2# )) (resid 10 and (name HB1 or name HB2 )) 4.0 1.6 1.6
assign (resid 7 and (name HG1# or name HG2# )) (resid 10 and name HD# ) 3.6 1.4 1.4
assign (resid 7 and (name HG1# or name HG2# )) (resid 11 and (name HD1# or name HD2# )) 2.3 0.9 0.9
assign (resid 7 and (name HG1# or name HG2# )) (resid 11 and name HG ) 4.4 1.8 1.8
assign (resid 7 and (name HG2# or name HG1# )) (resid 10 and (name HB2 or name HB1 )) 4.1 1.6 1.6
assign (resid 7 and (name HG2# or name HG1# )) (resid 11 and (name HB1 or name HB2 )) 4.2 1.7 1.7
assign (resid 7 and (name HG2# or name HG1# )) (resid 11 and (name HB2 or name HB1 )) 4.6 1.8 1.8
assign (resid 7 and (name HG2# or name HG1# )) (resid 11 and (name HD1# or name HD2# )) 1.8 0.7 0.7
assign (resid 7 and (name HG2# or name HG1# )) (resid 11 and name HG ) 2.5 1.0 1.0
assign (resid 7 and (name HG2# or name HG1# )) (resid 8 and name HA ) 2.8 1.1 1.1
assign (resid 7 and name HA ) (resid 10 and (name HB1 or name HB2 )) 3.2 1.3 1.3
assign (resid 7 and name HA ) (resid 10 and (name HB2 or name HB1 )) 3.9 1.6 1.6
assign (resid 7 and name HA ) (resid 10 and name HA ) 4.7 1.9 1.9
assign (resid 7 and name HA ) (resid 10 and name HD# ) 4.3 1.7 1.7
assign (resid 7 and name HA ) (resid 11 and (name HD1# or name HD2# )) 4.2 1.7 1.7
assign (resid 7 and name HA ) (resid 7 and (name HG1# or name HG2# )) 1.9 0.8 0.8
assign (resid 7 and name HA ) (resid 7 and (name HG2# or name HG1# )) 1.9 0.8 0.8
assign (resid 7 and name HA ) (resid 7 and name HB ) 2.7 1.1 1.1
assign (resid 7 and name HB ) (resid 11 and (name HD1# or name HD2# )) 2.9 1.2 1.2
assign (resid 7 and name HB ) (resid 7 and (name HG1# or name HG2# )) 1.8 0.7 0.7
assign (resid 7 and name HB ) (resid 7 and (name HG2# or name HG1# )) 1.8 0.7 0.7
assign (resid 8 and (name HB1 or name HB2 )) (resid 72 and name HB# ) 4.8 1.9 1.9
assign (resid 8 and (name HB1 or name HB2 )) (resid 77 and (name HD1# or name HD2# )) 2.9 1.2 1.2
assign (resid 8 and (name HB2 or name HB1 )) (resid 72 and name HB# ) 1.9 1.9 1.9
assign (resid 8 and (name HB2 or name HB1 )) (resid 77 and (name HD1# or name HD2# )) 2.9 1.2 1.2
assign (resid 8 and name HA ) (resid 8 and (name HB1 or name HB2 )) 3.0 1.2 1.2
assign (resid 8 and name HA ) (resid 8 and (name HB2 or name HB1 )) 2.8 1.1 1.1
assign (resid 8 and name HA ) (resid 11 and (name HB1 or name HB2 )) 3.4 1.4 1.4
assign (resid 8 and name HA ) (resid 11 and (name HB2 or name HB1 )) 3.8 1.5 1.5
assign (resid 8 and name HA ) (resid 11 and (name HD1# or name HD2# )) 2.4 1.0 1.0
assign (resid 8 and name HA ) (resid 12 and (name HG1# or name HG2# )) 3.6 1.4 1.4
assign (resid 8 and name HA ) (resid 77 and (name HD1# or name HD2# )) 3.1 1.2 1.2
assign (resid 8 and name HA ) (resid 77 and (name HD2# or name HD1# )) 2.9 1.2 1.2
assign (resid 9 and name HA ) (resid 12 and (name HG1# or name HG2# )) 3.2 1.3 1.3
assign (resid 9 and name HA ) (resid 12 and (name HG2# or name HG1# )) 3.9 1.6 1.6
assign (resid 10 and (name HB2 or name HB1 )) (resid 11 and (name HD2# or name HD1# )) 3.9 1.6 1.6
assign (resid 10 and name HA ) (resid 10 and (name HB1 or name HB2 )) 2.6 1.0 1.0
assign (resid 10 and name HA ) (resid 10 and (name HB2 or name HB1 )) 2.7 1.1 1.1
assign (resid 10 and name HA ) (resid 10 and name HD# ) 2.8 1.1 1.1
assign (resid 10 and name HA ) (resid 10 and name HE# ) 3.6 1.4 1.4
assign (resid 10 and name HA ) (resid 11 and name HG ) 4.2 1.7 1.7
assign (resid 10 and name HA ) (resid 13 and name HA ) 4.2 1.7 1.7
assign (resid 10 and name HA ) (resid 13 and name HB# ) 2.6 1.0 1.0
assign (resid 10 and name HA ) (resid 13 and name HD# ) 2.7 1.1 1.1
assign (resid 10 and name HA ) (resid 13 and name HE# ) 3.3 1.3 1.3
assign (resid 10 and name HD# ) (resid 11 and (name HD1# or name HD2# )) 3.8 1.5 1.5
assign (resid 10 and name HD# ) (resid 11 and (name HD2# or name HD1# )) 2.2 0.9 0.9
assign (resid 10 and name HD# ) (resid 11 and name HG ) 3.3 1.3 1.3
assign (resid 10 and name HD# ) (resid 13 and name HD# ) 3.9 1.6 1.6
assign (resid 10 and name HD# ) (resid 13 and name HE# ) 4.8 1.9 1.9
assign (resid 10 and name HE# ) (resid 10 and name HZ ) 2.1 0.8 0.8
assign (resid 10 and name HZ ) (resid 11 and (name HD2# or name HD1# )) 3.7 1.5 1.5
assign (resid 11 and (name HB1 or name HB2 )) (resid 11 and (name HD1# or name HD2# )) 2.1 0.8 0.8
assign (resid 11 and (name HB1 or name HB2 )) (resid 11 and (name HD2# or name HD1# )) 2.2 0.9 0.9
assign (resid 11 and (name HB1 or name HB2 )) (resid 11 and name HG ) 1.9 0.8 0.8
assign (resid 11 and (name HB1 or name HB2 )) (resid 12 and (name HG1# or name HG2# )) 3.1 1.2 1.2
assign (resid 11 and (name HB1 or name HB2 )) (resid 12 and (name HG2# or name HG1# )) 3.5 1.4 1.4
assign (resid 11 and (name HB1 or name HB2 )) (resid 15 and (name HG1# or name HG2# )) 4.2 1.7 1.7
assign (resid 11 and (name HB2 or name HB1 )) (resid 11 and (name HD1# or name HD2# )) 2.1 0.8 0.8
assign (resid 11 and (name HB2 or name HB1 )) (resid 11 and (name HD2# or name HD1# )) 2.0 0.8 0.8
assign (resid 11 and (name HB2 or name HB1 )) (resid 11 and name HG ) 2.8 1.1 1.1
assign (resid 11 and (name HB2 or name HB1 )) (resid 12 and (name HG1# or name HG2# )) 3.6 1.4 1.4
assign (resid 11 and (name HB2 or name HB1 )) (resid 15 and (name HG2# or name HG1# )) 4.0 1.6 1.6
assign (resid 11 and (name HD1# or name HD2# )) (resid 11 and name HG ) 2.0 0.8 0.8
assign (resid 11 and (name HD1# or name HD2# )) (resid 12 and name HA ) 4.1 1.6 1.6
assign (resid 11 and (name HD1# or name HD2# )) (resid 13 and name HB# ) 4.5 1.8 1.8
assign (resid 11 and (name HD1# or name HD2# )) (resid 14 and (name HB2 or name HB1 )) 4.2 1.7 1.7
assign (resid 11 and (name HD1# or name HD2# )) (resid 15 and name HB ) 3.3 1.3 1.3
assign (resid 11 and (name HD2# or name HD1# )) (resid 11 and name HG ) 1.8 0.7 0.7
assign (resid 11 and (name HD2# or name HD1# )) (resid 14 and (name HB2 or name HB1 )) 3.6 1.4 1.4
assign (resid 11 and name HA ) (resid 11 and (name HB1 or name HB2 )) 3.0 1.2 1.2
assign (resid 11 and name HA ) (resid 11 and (name HB2 or name HB1 )) 2.6 1.0 1.0
assign (resid 11 and name HA ) (resid 11 and (name HD1# or name HD2# )) 2.9 1.2 1.2
assign (resid 11 and name HA ) (resid 11 and (name HD2# or name HD1# )) 1.8 0.7 0.7
assign (resid 11 and name HA ) (resid 11 and name HG ) 3.3 1.3 1.3
assign (resid 11 and name HA ) (resid 14 and (name HB1 or name HB2 )) 3.6 1.4 1.4
assign (resid 11 and name HG ) (resid 12 and (name HG1# or name HG2# )) 3.6 1.4 1.4
assign (resid 12 and (name HG1# or name HG2# )) (resid 13 and name HA ) 4.1 1.6 1.6
assign (resid 12 and (name HG1# or name HG2# )) (resid 68 and (name HB1 or name HB2 )) 3.6 1.4 1.4
assign (resid 12 and (name HG1# or name HG2# )) (resid 68 and (name HG1 or name HG2 )) 3.5 1.4 1.4
assign (resid 12 and (name HG1# or name HG2# )) (resid 68 and (name HG2 or name HG1 )) 4.2 1.7 1.7
assign (resid 12 and (name HG1# or name HG2# )) (resid 68 and name HA ) 2.7 1.1 1.1
assign (resid 12 and (name HG2# or name HG1# )) (resid 13 and name HE# ) 4.2 1.7 1.7
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HB1 or name HB2 )) 3.2 1.3 1.3
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HG2 or name HG1 )) 3.1 1.2 1.2
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HG1 or name HG2 )) 3.5 1.4 1.4
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and name HA ) 2.1 0.8 0.8
assign (resid 12 and name HA ) (resid 12 and (name HG1# or name HG2# )) 1.9 0.8 0.8
assign (resid 12 and name HA ) (resid 12 and (name HG2# or name HG1# )) 2.0 0.8 0.8
assign (resid 12 and name HA ) (resid 12 and name HB ) 2.6 1.0 1.0
assign (resid 12 and name HA ) (resid 15 and (name HG2# or name HG1# )) 2.5 1.0 1.0
assign (resid 12 and name HA ) (resid 16 and name HG2# ) 4.4 1.8 1.8
assign (resid 12 and name HA ) (resid 62 and (name HD2# or name HD1# )) 4.8 1.9 1.9
assign (resid 12 and name HB ) (resid 16 and name HG2# ) 3.7 1.5 1.5
assign (resid 13 and name HA ) (resid 13 and name HB# ) 1.9 0.8 0.8
assign (resid 13 and name HA ) (resid 13 and name HG# ) 2.7 1.1 1.1
assign (resid 13 and name HA ) (resid 15 and (name HG2# or name HG1# )) 3.0 1.2 1.2
assign (resid 13 and name HA ) (resid 16 and name HB ) 2.6 1.0 1.0
assign (resid 13 and name HA ) (resid 16 and name HG2# ) 2.7 1.1 1.1
assign (resid 13 and name HA ) (resid 68 and name HD# ) 3.0 1.2 1.2
assign (resid 13 and name HB# ) (resid 13 and name HD# ) 1.8 0.7 0.7
assign (resid 13 and name HB# ) (resid 13 and name HE# ) 1.9 0.8 0.8
assign (resid 13 and name HB# ) (resid 16 and name HB ) 3.9 1.6 1.6
assign (resid 13 and name HB# ) (resid 16 and name HG2# ) 3.4 1.4 1.4
assign (resid 13 and name HE# ) (resid 14 and name HA ) 2.6 1.0 1.0
assign (resid 13 and name HE# ) (resid 15 and (name HG2# or name HG1# )) 3.8 1.5 1.5
assign (resid 13 and name HG# ) (resid 16 and name HB ) 4.1 1.6 1.6
assign (resid 13 and name HG# ) (resid 68 and (name HG1 or name HG2 )) 4.0 1.6 1.6
assign (resid 14 and (name HB2 or name HB1 )) (resid 15 and (name HG2# or name HG1# )) 3.6 1.4 1.4
assign (resid 14 and name HA ) (resid 14 and (name HB2 or name HB1 )) 2.5 1.0 1.0
assign (resid 15 and (name HG1# or name HG2# )) (resid 16 and name HB ) 5.1 2.0 2.0
assign (resid 15 and (name HG1# or name HG2# )) (resid 18 and (name HB2 or name HB1 )) 4.5 1.8 1.8
assign (resid 15 and (name HG1# or name HG2# )) (resid 18 and (name HD1# or name HD2# )) 2.0 0.8 0.8
assign (resid 15 and (name HG1# or name HG2# )) (resid 19 and (name HG12 or name HG13 )) 4.0 1.6 1.6
assign (resid 15 and (name HG1# or name HG2# )) (resid 19 and (name HD1# or name HD2# )) 2.6 1.0 1.0
assign (resid 15 and (name HG2# or name HG1# )) (resid 16 and name HB ) 3.8 1.5 1.5
assign (resid 15 and (name HG2# or name HG1# )) (resid 16 and name HG2# ) 2.3 0.9 0.9
assign (resid 15 and (name HG2# or name HG1# )) (resid 18 and name HG ) 3.2 1.3 1.3
assign (resid 15 and (name HG2# or name HG1# )) (resid 19 and (name HG12 or name HG13 )) 3.2 1.3 1.3
assign (resid 15 and (name HG2# or name HG1# )) (resid 19 and (name HG13 or name HG12 )) 2.7 1.1 1.1
assign (resid 15 and (name HG2# or name HG1# )) (resid 19 and name HD1# ) 1.9 0.8 0.8
assign (resid 15 and name HA ) (resid 15 and (name HG1# or name HG2# )) 1.9 0.8 0.8
assign (resid 15 and name HA ) (resid 15 and (name HG2# or name HG1# )) 1.9 0.8 0.8
assign (resid 15 and name HA ) (resid 15 and name HB ) 2.4 1.0 1.0
assign (resid 15 and name HA ) (resid 18 and (name HB1 or name HB2 )) 3.0 1.2 1.2
assign (resid 15 and name HA ) (resid 18 and (name HB2 or name HB1 )) 3.9 1.6 1.6
assign (resid 15 and name HA ) (resid 18 and (name HD1# or name HD2# )) 2.2 0.9 0.9
assign (resid 15 and name HA ) (resid 18 and (name HD2# or name HD1# )) 2.7 1.1 1.1
assign (resid 15 and name HA ) (resid 18 and name HG ) 3.0 1.2 1.2
assign (resid 15 and name HA ) (resid 19 and name HG2# ) 3.9 1.6 1.6
assign (resid 15 and name HB ) (resid 15 and (name HG1# or name HG2# )) 1.8 0.7 0.7
assign (resid 15 and name HB ) (resid 15 and (name HG2# or name HG1# )) 1.8 0.7 0.7
assign (resid 15 and name HB ) (resid 19 and name HD1# ) 3.5 1.4 1.4
assign (resid 16 and name HA ) (resid 16 and name HB ) 2.2 0.9 0.9
assign (resid 16 and name HA ) (resid 16 and name HG2# ) 1.9 0.8 0.8
assign (resid 16 and name HA ) (resid 18 and (name HD1# or name HD2# )) 4.4 1.8 1.8
assign (resid 16 and name HA ) (resid 19 and (name HG12 or name HG13 )) 4.1 2.1 2.1
assign (resid 16 and name HA ) (resid 19 and name HB ) 3.1 1.2 1.2
assign (resid 16 and name HA ) (resid 19 and name HD1# ) 2.2 0.9 0.9
assign (resid 16 and name HA ) (resid 19 and name HG2# ) 2.9 1.2 1.2
assign (resid 16 and name HA ) (resid 62 and (name HD2# or name HD1# )) 4.7 1.9 1.9
assign (resid 16 and name HA ) (resid 68 and (name HB1 or name HB2 )) 3.9 1.6 1.6
assign (resid 16 and name HA ) (resid 68 and (name HB2 or name HB1 )) 3.6 1.4 1.4
assign (resid 16 and name HB ) (resid 16 and name HG2# ) 1.8 0.7 0.7
assign (resid 16 and name HB ) (resid 17 and (name HG1 or name HG2 )) 4.4 1.8 1.8
assign (resid 16 and name HB ) (resid 19 and name HD1# ) 4.2 1.7 1.7
assign (resid 16 and name HB ) (resid 19 and name HG2# ) 4.2 1.7 1.7
assign (resid 16 and name HG2# ) (resid 17 and (name HG1 or name HG2 )) 3.9 1.6 1.6
assign (resid 16 and name HG2# ) (resid 17 and name HA ) 4.2 1.7 1.7
assign (resid 16 and name HG2# ) (resid 18 and name HG ) 4.4 1.8 1.8
assign (resid 16 and name HG2# ) (resid 19 and (name HG12 or name HG13 )) 4.1 1.6 1.6
assign (resid 16 and name HG2# ) (resid 19 and name HB ) 4.0 1.6 1.6
assign (resid 16 and name HG2# ) (resid 19 and name HD1# ) 2.4 1.2 1.2
assign (resid 16 and name HG2# ) (resid 19 and name HG2# ) 2.8 1.1 1.1
assign (resid 16 and name HG2# ) (resid 20 and name HA ) 1.9 1.9 1.9
assign (resid 16 and name HG2# ) (resid 62 and name HA ) 3.7 1.5 1.5
assign (resid 16 and name HG2# ) (resid 63 and (name HD1# or name HD2# )) 2.8 1.1 1.1
assign (resid 16 and name HG2# ) (resid 63 and (name HD2# or name HD1# )) 2.4 1.0 1.0
assign (resid 18 and (name HB1 or name HB2 )) (resid 18 and (name HD1# or name HD2# )) 1.9 0.8 0.8
assign (resid 18 and (name HB1 or name HB2 )) (resid 18 and (name HD2# or name HD1# )) 2.1 0.8 0.8
assign (resid 18 and (name HB1 or name HB2 )) (resid 18 and name HG ) 2.3 0.9 0.9
assign (resid 18 and (name HB2 or name HB1 )) (resid 18 and (name HD1# or name HD2# )) 2.0 0.8 0.8
assign (resid 18 and (name HB2 or name HB1 )) (resid 18 and (name HD2# or name HD1# )) 2.1 0.8 0.8
assign (resid 18 and (name HD1# or name HD2# )) (resid 19 and name HA ) 3.4 1.4 1.4
assign (resid 18 and (name HD2# or name HD1# )) (resid 18 and name HG ) 1.7 0.7 0.7
assign (resid 18 and (name HD2# or name HD1# )) (resid 19 and name HB ) 4.1 1.6 1.6
assign (resid 18 and name HA ) (resid 18 and (name HB1 or name HB2 )) 3.0 1.2 1.2
assign (resid 18 and name HA ) (resid 18 and (name HB2 or name HB1 )) 3.4 1.4 1.4
assign (resid 18 and name HA ) (resid 18 and (name HD1# or name HD2# )) 2.5 1.0 1.0
assign (resid 18 and name HA ) (resid 18 and (name HD2# or name HD1# )) 1.9 0.8 0.8
assign (resid 18 and name HA ) (resid 18 and name HG ) 3.7 1.5 1.5
assign (resid 18 and name HA ) (resid 19 and name HG2# ) 4.2 1.7 1.7
assign (resid 18 and name HA ) (resid 21 and name HB# ) 4.5 1.8 1.8
assign (resid 18 and name HA ) (resid 22 and name HB# ) 3.8 1.5 1.5
assign (resid 18 and name HG ) (resid 19 and name HD1# ) 3.7 1.5 1.5
assign (resid 19 and (name HG12 or name HG13 )) (resid 19 and name HA ) 4.4 1.8 1.8
assign (resid 19 and (name HG12 or name HG13 )) (resid 19 and name HG2# ) 2.0 0.8 0.8
assign (resid 19 and (name HG12 or name HG13 )) (resid 63 and (name HD1# or name HD2# )) 3.3 1.3 1.3
assign (resid 19 and (name HG12 or name HG13 )) (resid 63 and (name HD2# or name HD1# )) 4.2 1.7 1.7
assign (resid 19 and (name HG13 or name HG12 )) (resid 19 and name HA ) 3.3 1.3 1.3
assign (resid 19 and (name HG13 or name HG12 )) (resid 19 and name HG2# ) 2.1 0.8 0.8
assign (resid 19 and name HA ) (resid 19 and name HB ) 3.1 1.2 1.2
assign (resid 19 and name HA ) (resid 19 and name HG2# ) 2.1 0.8 0.8
assign (resid 19 and name HB ) (resid 19 and (name HG12 or name HG13 )) 2.6 1.0 1.0
assign (resid 19 and name HB ) (resid 19 and (name HG13 or name HG12 )) 2.8 1.1 1.1
assign (resid 19 and name HB ) (resid 19 and name HD1# ) 2.0 0.8 0.8
assign (resid 19 and name HB ) (resid 19 and name HG2# ) 1.7 0.7 0.7
assign (resid 19 and name HD1# ) (resid 19 and (name HG12 or name HG13 )) 1.9 0.8 0.8
assign (resid 19 and name HD1# ) (resid 19 and (name HG13 or name HG12 )) 1.9 0.8 0.8
assign (resid 19 and name HD1# ) (resid 19 and name HG2# ) 1.6 0.6 0.6
assign (resid 19 and name HD1# ) (resid 23 and name HG# ) 3.6 1.4 1.4
assign (resid 19 and name HG2# ) (resid 20 and name HA ) 4.0 1.6 1.6
assign (resid 19 and name HG2# ) (resid 23 and name HG# ) 4.7 1.9 1.9
assign (resid 19 and name HG2# ) (resid 23 and name HE# ) 3.6 1.4 1.4
assign (resid 21 and name HA ) (resid 21 and name HB# ) 2.1 0.8 0.8
assign (resid 21 and name HB# ) (resid 24 and name HG2# ) 3.0 1.2 1.2
assign (resid 22 and name HA ) (resid 22 and name HB# ) 2.1 0.8 0.8
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assign (resid 23 and name HA ) (resid 23 and (name HB1 or name HB2 )) 3.5 1.4 1.4
assign (resid 23 and name HA ) (resid 23 and (name HB2 or name HB1 )) 3.5 1.4 1.4
assign (resid 23 and name HA ) (resid 23 and name HD# ) 2.5 1.0 1.0
assign (resid 23 and name HA ) (resid 23 and name HE# ) 3.5 1.4 1.4
assign (resid 23 and name HA ) (resid 23 and name HG# ) 2.8 1.1 1.1
assign (resid 23 and (name HB1 or name HB2 )) (resid 23 and name HD# ) 3.0 1.2 1.2
assign (resid 23 and (name HB1 or name HB2 )) (resid 23 and name HE# ) 4.6 1.8 1.8
assign (resid 23 and (name HB1 or name HB2 )) (resid 23 and name HG# ) 2.7 1.1 1.1
assign (resid 23 and (name HB1 or name HB2 )) (resid 27 and (name HB1 or name HB2 )) 5.4 2.2 2.2
assign (resid 23 and (name HB1 or name HB2 )) (resid 28 and name HD1# ) 4.0 1.6 1.6
assign (resid 23 and (name HB2 or name HB1 )) (resid 23 and name HE# ) 3.0 1.2 1.2
assign (resid 23 and (name HB2 or name HB1 )) (resid 23 and name HG# ) 3.1 1.2 1.2
assign (resid 23 and (name HB2 or name HB1 )) (resid 27 and (name HB1 or name HB2 )) 4.6 1.8 1.8
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and name HD1# ) 4.1 1.6 1.6
assign (resid 23 and name HD# ) (resid 23 and name HG# ) 1.7 0.7 0.7
assign (resid 23 and name HD# ) (resid 27 and (name HB1 or name HB2 )) 4.1 1.6 1.6
assign (resid 23 and name HD# ) (resid 27 and name HG# ) 4.4 1.8 1.8
assign (resid 23 and name HE# ) (resid 24 and name HG2# ) 4.2 1.7 1.7
assign (resid 23 and name HE# ) (resid 27 and name HG# ) 4.7 1.9 1.9
assign (resid 23 and name HE# ) (resid 28 and name HD1# ) 3.8 1.5 1.5
assign (resid 23 and name HE# ) (resid 59 and (name HD2# or name HD1# )) 3.3 1.3 1.3
assign (resid 23 and name HG# ) (resid 27 and name HG# ) 4.7 1.9 1.9
assign (resid 23 and name HG# ) (resid 28 and name HD1# ) 3.1 1.2 1.2
assign (resid 24 and name HA ) (resid 24 and name HB ) 2.1 0.8 0.8
assign (resid 24 and name HA ) (resid 24 and name HG2# ) 1.9 0.8 0.8
assign (resid 24 and name HA ) (resid 27 and name HG# ) 5.5 2.2 2.2
assign (resid 24 and name HB ) (resid 24 and name HG2# ) 1.8 0.7 0.7
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assign (resid 25 and name HA ) (resid 28 and name HB ) 3.4 1.4 1.4
assign (resid 25 and name HA ) (resid 28 and name HD1# ) 2.9 1.2 1.2
assign (resid 25 and name HA ) (resid 28 and name HG2# ) 3.8 1.5 1.5
assign (resid 25 and name HA ) (resid 29 and (name HD1# or name HD2# )) 2.9 1.2 1.2
assign (resid 25 and name HA ) (resid 59 and (name HD1# or name HD2# )) 3.9 1.6 1.6
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assign (resid 25 and name HB# ) (resid 59 and (name HD2# or name HD1# )) 2.9 1.2 1.2
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assign (resid 26 and (name HB2 or name HB1 )) (resid 26 and name HE# ) 2.4 1.0 1.0
assign (resid 26 and (name HB2 or name HB1 )) (resid 26 and name HG# ) 2.0 0.8 0.8
assign (resid 26 and name HA ) (resid 26 and (name HB1 or name HB2 )) 2.2 0.9 0.9
assign (resid 26 and name HA ) (resid 26 and (name HB2 or name HB1 )) 2.4 1.0 1.0
assign (resid 26 and name HA ) (resid 26 and name HG# ) 2.4 1.0 1.0
assign (resid 27 and (name HB1 or name HB2 )) (resid 27 and name HG# ) 2.8 1.1 1.1
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assign (resid 27 and (name HB2 or name HB1 )) (resid 27 and name HG# ) 2.7 1.1 1.1
assign (resid 27 and name HA ) (resid 27 and (name HB1 or name HB2 )) 3.5 1.4 1.4
assign (resid 27 and name HA ) (resid 27 and (name HB2 or name HB1 )) 3.6 1.4 1.4
assign (resid 27 and name HA ) (resid 27 and name HG# ) 2.8 1.1 1.1
assign (resid 27 and name HA ) (resid 30 and (name HB1 or name HB2 )) 3.1 1.2 1.2
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assign (resid 27 and name HG# ) (resid 28 and (name HG12 or name HG13 )) 4.6 1.8 1.8
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assign (resid 28 and name HA ) (resid 28 and (name HG12 or name HG13 )) 2.8 1.1 1.1
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assign (resid 28 and name HA ) (resid 28 and name HB ) 3.3 1.3 1.3
assign (resid 28 and name HA ) (resid 28 and name HD1# ) 2.1 0.8 0.8
assign (resid 28 and name HA ) (resid 28 and name HG2# ) 2.1 0.8 0.8
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assign (resid 28 and name HA ) (resid 31 and name HB# ) 2.1 0.8 0.8
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assign (resid 28 and name HB ) (resid 28 and (name HG12 or name HG13 )) 3.4 1.4 1.4
assign (resid 28 and name HB ) (resid 28 and (name HG13 or name HG12 )) 3.8 1.5 1.5
assign (resid 28 and name HB ) (resid 28 and name HD1# ) 2.3 0.9 0.9
assign (resid 28 and name HB ) (resid 28 and name HG2# ) 2.0 0.8 0.8
assign (resid 28 and name HB ) (resid 29 and (name HD1# or name HD2# )) 2.7 1.1 1.1
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assign (resid 28 and name HB ) (resid 59 and (name HD2# or name HD1# )) 2.8 1.1 1.1
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assign (resid 28 and name HD1# ) (resid 59 and (name HD1# or name HD2# )) 1.9 0.8 0.8
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assign (resid 28 and name HD1# ) (resid 31 and name HB# ) 3.1 1.2 1.2
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assign (resid 28 and name HG2# ) (resid 29 and (name HD2# or name HD1# )) 2.3 0.9 0.9
assign (resid 28 and name HG2# ) (resid 29 and name HA ) 3.1 1.2 1.2
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assign (resid 28 and name HG2# ) (resid 31 and name HB# ) 2.4 1.0 1.0
assign (resid 28 and name HG2# ) (resid 32 and name HD# ) 2.4 1.0 1.0
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assign (resid 28 and name HG2# ) (resid 32 and name HZ ) 3.1 1.2 1.2
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assign (resid 29 and (name HB1 or name HB2 )) (resid 29 and name HG ) 3.3 1.3 1.3
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assign (resid 29 and (name HD2# or name HD1# )) (resid 55 and (name HA2 or name HA1 )) 2.8 1.1 1.1
assign (resid 29 and (name HD2# or name HD1# )) (resid 56 and name HA ) 3.5 1.4 1.4
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assign (resid 29 and name HA ) (resid 29 and (name HD1# or name HD2# )) 2.0 0.8 0.8
assign (resid 29 and name HA ) (resid 29 and (name HD2# or name HD1# )) 2.0 0.8 0.8
assign (resid 29 and name HA ) (resid 29 and name HG ) 2.4 1.0 1.0
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assign (resid 29 and name HA ) (resid 32 and (name HB2 or name HB1 )) 4.0 1.6 1.6
assign (resid 29 and name HA ) (resid 32 and name HD# ) 3.4 1.4 1.4
assign (resid 29 and name HA ) (resid 51 and (name HG2# or name HG1# )) 3.5 1.4 1.4
assign (resid 29 and name HG ) (resid 51 and (name HG1# or name HG2# )) 3.8 1.5 1.5
assign (resid 30 and (name HB1 or name HB2 )) (resid 34 and name HE# ) 2.9 1.2 1.2
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assign (resid 30 and name HA ) (resid 30 and (name HB1 or name HB2 )) 2.9 1.2 1.2
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assign (resid 31 and name HA ) (resid 34 and (name HG2 or name HG1 )) 3.2 1.3 1.3
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assign (resid 31 and name HA ) (resid 34 and name HB# ) 2.2 0.9 0.9
assign (resid 31 and name HA ) (resid 34 and name HD# ) 2.8 1.1 1.1
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assign (resid 31 and name HB# ) (resid 32 and name HA ) 3.6 1.4 1.4
assign (resid 31 and name HB# ) (resid 32 and name HD# ) 3.2 1.3 1.3
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assign (resid 31 and name HB# ) (resid 33 and name HA ) 5.0 2.0 2.0
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assign (resid 31 and name HB# ) (resid 34 and name HD# ) 2.5 1.0 1.0
assign (resid 31 and name HB# ) (resid 34 and name HE# ) 2.5 1.0 1.0
assign (resid 31 and name HB# ) (resid 35 and (name HB1 or name HB2 )) 3.7 1.5 1.5
assign (resid 31 and name HB# ) (resid 36 and (name HB2 or name HB1 )) 4.4 1.8 1.8
assign (resid 32 and (name HB1 or name HB2 )) (resid 32 and name HD# ) 3.6 1.4 1.4
assign (resid 32 and (name HB1 or name HB2 )) (resid 35 and name HE# ) 4.5 1.8 1.8
assign (resid 32 and (name HB1 or name HB2 )) (resid 51 and (name HG1# or name HG2# )) 3.0 1.2 1.2
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assign (resid 32 and (name HB2 or name HB1 )) (resid 32 and name HD# ) 3.4 1.4 1.4
assign (resid 32 and (name HB2 or name HB1 )) (resid 35 and name HE# ) 3.6 1.4 1.4
assign (resid 32 and (name HB2 or name HB1 )) (resid 51 and (name HG1# or name HG2# )) 2.7 1.1 1.1
assign (resid 32 and (name HB2 or name HB1 )) (resid 51 and (name HG2# or name HG1# )) 3.7 1.5 1.5
assign (resid 32 and name HA ) (resid 32 and (name HB1 or name HB2 )) 3.1 1.2 1.2
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assign (resid 32 and name HA ) (resid 32 and name HD# ) 2.6 1.0 1.0
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assign (resid 32 and name HA ) (resid 35 and (name HB1 or name HB2 )) 3.2 1.3 1.3
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assign (resid 32 and name HA ) (resid 35 and name HG# ) 2.9 1.2 1.2
assign (resid 32 and name HA ) (resid 51 and (name HG1# or name HG2# )) 3.7 1.5 1.5
assign (resid 32 and name HD# ) (resid 32 and name HZ ) 2.7 1.1 1.1
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assign (resid 32 and name HD# ) (resid 51 and (name HG1# or name HG2# )) 2.8 1.1 1.1
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assign (resid 34 and name HA ) (resid 34 and name HB# ) 1.8 0.7 0.7
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assign (resid 34 and name HB# ) (resid 34 and (name HG1 or name HG2 )) 1.8 0.7 0.7
assign (resid 34 and name HB# ) (resid 34 and (name HG2 or name HG1 )) 1.8 0.7 0.7
assign (resid 34 and name HB# ) (resid 34 and name HD# ) 1.9 0.8 0.8
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assign (resid 34 and name HD# ) (resid 34 and (name HG2 or name HG1 )) 1.7 0.7 0.7
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assign (resid 34 and name HE# ) (resid 34 and (name HG1 or name HG2 )) 1.7 0.7 0.7
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assign (resid 35 and (name HB1 or name HB2 )) (resid 35 and name HA ) 2.3 0.9 0.9
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assign (resid 39 and (name HD2# or name HD1# )) (resid 44 and name HA ) 3.3 1.7 1.7
assign (resid 39 and (name HD2# or name HD1# )) (resid 44 and name HB# ) 3.4 1.4 1.4
assign (resid 39 and name HA ) (resid 39 and name HG ) 3.5 1.4 1.4
assign (resid 39 and name HA ) (resid 40 and (name HB1 or name HB2 )) 4.5 1.8 1.8
assign (resid 39 and name HA ) (resid 40 and (name HB2 or name HB1 )) 4.4 1.8 1.8
assign (resid 39 and name HA ) (resid 40 and (name HD1 or name HD2 )) 2.6 1.0 1.0
assign (resid 39 and name HA ) (resid 40 and (name HD2 or name HD1 )) 2.7 1.1 1.1
assign (resid 39 and name HA ) (resid 40 and (name HG1 or name HG2 )) 3.2 1.3 1.3
assign (resid 39 and name HA ) (resid 40 and (name HG2 or name HG1 )) 3.6 1.4 1.4
assign (resid 39 and name HA ) (resid 40 and name HA ) 5.2 2.1 2.1
assign (resid 39 and name HA ) (resid 43 and (name HD1# or name HD2# )) 3.9 1.6 1.6
assign (resid 39 and name HA ) (resid 44 and name HB# ) 3.9 2.0 2.0
assign (resid 39 and name HG ) (resid 40 and (name HB1 or name HB2 )) 3.7 1.5 1.5
assign (resid 40 and (name HB1 or name HB2 )) (resid 40 and (name HD1 or name HD2 )) 3.2 1.3 1.3
assign (resid 40 and (name HB1 or name HB2 )) (resid 40 and (name HD2 or name HD1 )) 3.8 1.5 1.5
assign (resid 40 and (name HB1 or name HB2 )) (resid 40 and (name HG1 or name HG2 )) 2.4 1.0 1.0
assign (resid 40 and (name HB1 or name HB2 )) (resid 40 and (name HG2 or name HG1 )) 2.0 0.8 0.8
assign (resid 40 and (name HB1 or name HB2 )) (resid 41 and name HD# ) 4.5 1.8 1.8
assign (resid 40 and (name HB1 or name HB2 )) (resid 43 and (name HD1# or name HD2# )) 2.6 1.0 1.0
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assign (resid 40 and (name HB2 or name HB1 )) (resid 40 and (name HD1 or name HD2 )) 3.3 1.3 1.3
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assign (resid 40 and (name HB2 or name HB1 )) (resid 40 and (name HG1 or name HG2 )) 2.2 0.9 0.9
assign (resid 40 and (name HB2 or name HB1 )) (resid 40 and (name HG2 or name HG1 )) 1.9 0.8 0.8
assign (resid 40 and (name HB2 or name HB1 )) (resid 40 and (name HG2 or name HG1 )) 2.1 0.8 0.8
assign (resid 40 and (name HB2 or name HB1 )) (resid 43 and (name HD1# or name HD2# )) 2.6 1.0 1.0
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assign (resid 40 and (name HD1 or name HD2 )) (resid 40 and (name HG1 or name HG2 )) 2.4 1.0 1.0
assign (resid 40 and (name HD1 or name HD2 )) (resid 40 and (name HG2 or name HG1 )) 2.7 1.1 1.1
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assign (resid 40 and (name HD1 or name HD2 )) (resid 43 and (name HD1# or name HD2# )) 2.8 1.1 1.1
assign (resid 40 and (name HD1 or name HD2 )) (resid 43 and (name HD2# or name HD1# )) 4.4 1.8 1.8
assign (resid 40 and (name HD2 or name HD1 )) (resid 40 and (name HG1 or name HG2 )) 2.5 1.0 1.0
assign (resid 40 and (name HD2 or name HD1 )) (resid 40 and (name HG2 or name HG1 )) 2.9 1.2 1.2
assign (resid 40 and (name HD2 or name HD1 )) (resid 43 and (name HB1 or name HB2 )) 4.9 2.0 2.0
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assign (resid 40 and (name HD2 or name HD1 )) (resid 43 and (name HD1# or name HD2# )) 2.6 1.0 1.0
assign (resid 40 and (name HD2 or name HD1 )) (resid 43 and (name HD2# or name HD1# )) 3.2 1.3 1.3
assign (resid 40 and (name HG1 or name HG2 )) (resid 42 and name HB# ) 3.5 1.4 1.4
assign (resid 40 and (name HG1 or name HG2 )) (resid 43 and (name HB2 or name HB1 )) 4.3 1.7 1.7
assign (resid 40 and (name HG1 or name HG2 )) (resid 43 and (name HD1# or name HD2# )) 2.1 0.8 0.8
assign (resid 40 and (name HG2 or name HG1 )) (resid 42 and name HB# ) 3.9 1.6 1.6
assign (resid 40 and (name HG2 or name HG1 )) (resid 43 and (name HB1 or name HB2 )) 4.3 1.7 1.7
assign (resid 40 and (name HG2 or name HG1 )) (resid 43 and (name HD1# or name HD2# )) 2.3 0.9 0.9
assign (resid 40 and (name HG2 or name HG1 )) (resid 43 and name HA ) 3.9 2.0 2.0
assign (resid 40 and name HA ) (resid 40 and (name HB1 or name HB2 )) 1.9 0.8 0.8
assign (resid 40 and name HA ) (resid 40 and (name HB2 or name HB1 )) 2.0 0.8 0.8
assign (resid 40 and name HA ) (resid 40 and (name HD1 or name HD2 )) 3.9 1.6 1.6
assign (resid 40 and name HA ) (resid 40 and (name HD2 or name HD1 )) 4.5 1.8 1.8
assign (resid 40 and name HA ) (resid 40 and (name HG1 or name HG2 )) 2.6 1.0 1.0
assign (resid 40 and name HA ) (resid 40 and (name HG2 or name HG1 )) 2.6 1.0 1.0
assign (resid 40 and name HA ) (resid 41 and name HA ) 4.2 1.7 1.7
assign (resid 40 and name HA ) (resid 43 and (name HD1# or name HD2# )) 4.2 1.7 1.7
assign (resid 41 and name HA ) (resid 41 and name HB# ) 1.8 0.7 0.7
assign (resid 41 and name HA ) (resid 41 and name HG# ) 1.9 0.8 0.8
assign (resid 41 and name HA ) (resid 44 and name HB# ) 2.0 0.8 0.8
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assign (resid 41 and name HB# ) (resid 41 and name HG# ) 1.8 0.7 0.7
assign (resid 41 and name HB# ) (resid 42 and name HB# ) 3.8 1.5 1.5
assign (resid 41 and name HB# ) (resid 43 and (name HB2 or name HB1 )) 4.5 1.8 1.8
assign (resid 41 and name HB# ) (resid 44 and name HB# ) 3.9 1.6 1.6
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assign (resid 41 and name HD# ) (resid 41 and name HG# ) 1.6 0.6 0.6
assign (resid 41 and name HE# ) (resid 41 and name HG# ) 1.7 0.7 0.7
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assign (resid 41 and name HG# ) (resid 42 and name HA ) 3.8 1.5 1.5
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assign (resid 41 and name HG# ) (resid 44 and name HA ) 4.4 1.8 1.8
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assign (resid 42 and name HA ) (resid 42 and name HB# ) 1.9 0.8 0.8
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assign (resid 43 and (name HB1 or name HB2 )) (resid 43 and (name HD1# or name HD2# )) 2.2 0.9 0.9
assign (resid 43 and (name HB2 or name HB1 )) (resid 43 and (name HD1# or name HD2# )) 1.9 0.8 0.8
assign (resid 43 and (name HB2 or name HB1 )) (resid 43 and (name HD2# or name HD1# )) 1.9 0.8 0.8
assign (resid 43 and (name HD1# or name HD2# )) (resid 43 and name HG ) 1.9 0.8 0.8
assign (resid 43 and (name HD1# or name HD2# )) (resid 47 and name HA ) 3.9 1.6 1.6
assign (resid 43 and (name HD2# or name HD1# )) (resid 43 and name HG ) 1.8 0.7 0.7
assign (resid 43 and (name HD2# or name HD1# )) (resid 47 and (name HB2 or name HB1 )) 3.8 1.5 1.5
assign (resid 43 and name HA ) (resid 43 and (name HB1 or name HB2 )) 2.8 1.1 1.1
assign (resid 43 and name HA ) (resid 43 and (name HB2 or name HB1 )) 2.4 1.0 1.0
assign (resid 43 and name HA ) (resid 43 and (name HD1# or name HD2# )) 2.3 0.9 0.9
assign (resid 43 and name HA ) (resid 43 and (name HD2# or name HD1# )) 1.8 0.7 0.7
assign (resid 43 and name HA ) (resid 43 and name HG ) 2.6 1.0 1.0
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assign (resid 44 and name HA ) (resid 47 and (name HB1 or name HB2 )) 3.9 1.6 1.6
assign (resid 44 and name HA ) (resid 47 and (name HB2 or name HB1 )) 3.9 1.6 1.6
assign (resid 45 and name HA ) (resid 45 and name HB# ) 2.1 0.8 0.8
assign (resid 45 and name HA ) (resid 45 and (name HG1 or name HG2 )) 2.7 1.1 1.1
assign (resid 45 and name HA ) (resid 45 and (name HG2 or name HG1 )) 3.6 1.4 1.4
assign (resid 45 and name HA ) (resid 48 and (name HG2 or name HG1 )) 4.7 1.9 1.9
assign (resid 45 and name HB# ) (resid 45 and (name HG1 or name HG2 )) 2.4 1.0 1.0
assign (resid 46 and (name HB1 or name HB2 )) (resid 47 and (name HB2 or name HB1 )) 3.8 1.5 1.5
assign (resid 46 and name HA ) (resid 47 and (name HB2 or name HB1 )) 4.7 1.9 1.9
assign (resid 47 and (name HB2 or name HB1 )) (resid 50 and (name HG1# or name HG2# )) 3.8 1.5 1.5
assign (resid 47 and (name HB2 or name HB1 )) (resid 50 and (name HG2# or name HG1# )) 5.0 2.0 2.0
assign (resid 47 and name HA ) (resid 47 and (name HB1 or name HB2 )) 3.2 1.3 1.3
assign (resid 47 and name HA ) (resid 47 and (name HB2 or name HB1 )) 2.8 1.1 1.1
assign (resid 47 and name HA ) (resid 50 and (name HG1# or name HG2# )) 2.3 0.9 0.9
assign (resid 47 and name HA ) (resid 50 and (name HG2# or name HG1# )) 2.9 1.2 1.2
assign (resid 47 and name HA ) (resid 50 and name HB ) 2.8 1.1 1.1
assign (resid 48 and (name HG2 or name HG1 )) (resid 51 and (name HG1# or name HG2# )) 4.5 1.8 1.8
assign (resid 48 and (name HG2 or name HG1 )) (resid 51 and name HA ) 5.0 2.0 2.0
assign (resid 48 and name HA ) (resid 48 and name HB# ) 3.3 1.3 1.3
assign (resid 48 and name HA ) (resid 51 and (name HG1# or name HG2# )) 3.8 1.5 1.5
assign (resid 48 and name HA ) (resid 51 and name HB ) 3.9 1.6 1.6
assign (resid 48 and name HB# ) (resid 48 and (name HG1 or name HG2 )) 2.6 1.0 1.0
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assign (resid 49 and name HB# ) (resid 50 and (name HG1# or name HG2# )) 3.7 1.5 1.5
assign (resid 50 and (name HG1# or name HG2# )) (resid 53 and name HA ) 3.2 1.3 1.3
assign (resid 50 and (name HG1# or name HG2# )) (resid 53 and name HG2# ) 3.5 1.4 1.4
assign (resid 50 and (name HG1# or name HG2# )) (resid 54 and name HD# ) 2.5 1.0 1.0
assign (resid 50 and (name HG1# or name HG2# )) (resid 54 and name HE# ) 2.7 1.1 1.1
assign (resid 50 and (name HG2# or name HG1# )) (resid 53 and name HA ) 3.3 1.3 1.3
assign (resid 50 and (name HG2# or name HG1# )) (resid 53 and name HG2# ) 3.5 1.4 1.4
assign (resid 50 and (name HG2# or name HG1# )) (resid 54 and (name HB1 or name HB2 )) 3.7 1.5 1.5
assign (resid 50 and (name HG2# or name HG1# )) (resid 54 and (name HB2 or name HB1 )) 3.3 1.3 1.3
assign (resid 50 and (name HG2# or name HG1# )) (resid 54 and name HA ) 3.8 1.5 1.5
assign (resid 50 and (name HG2# or name HG1# )) (resid 54 and name HD# ) 2.0 0.8 0.8
assign (resid 50 and (name HG2# or name HG1# )) (resid 54 and name HE# ) 2.3 0.9 0.9
assign (resid 50 and name HA ) (resid 50 and (name HG1# or name HG2# )) 1.9 0.8 0.8
assign (resid 50 and name HA ) (resid 50 and (name HG2# or name HG1# )) 2.0 0.8 0.8
assign (resid 50 and name HA ) (resid 50 and name HB ) 2.6 1.0 1.0
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assign (resid 50 and name HA ) (resid 53 and name HG2# ) 2.9 1.2 1.2
assign (resid 50 and name HA ) (resid 54 and name HD# ) 2.3 1.2 1.2
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assign (resid 50 and name HB ) (resid 50 and (name HG1# or name HG2# )) 1.8 0.7 0.7
assign (resid 50 and name HB ) (resid 50 and (name HG2# or name HG1# )) 1.9 0.8 0.8
assign (resid 50 and name HB ) (resid 53 and name HA ) 5.2 2.1 2.1
assign (resid 50 and name HB ) (resid 54 and name HD# ) 3.8 1.5 1.5
assign (resid 50 and name HB ) (resid 54 and name HE# ) 4.3 1.7 1.7
assign (resid 51 and (name HG1# or name HG2# )) (resid 52 and name HA ) 4.1 1.6 1.6
assign (resid 51 and (name HG1# or name HG2# )) (resid 55 and (name HA2 or name HA1 )) 5.0 2.0 2.0
assign (resid 51 and (name HG2# or name HG1# )) (resid 52 and name HA ) 4.8 1.9 1.9
assign (resid 51 and (name HG2# or name HG1# )) (resid 55 and (name HA2 or name HA1 )) 4.0 1.6 1.6
assign (resid 51 and name HA ) (resid 51 and (name HG1# or name HG2# )) 1.9 0.8 0.8
assign (resid 51 and name HA ) (resid 51 and (name HG2# or name HG1# )) 2.4 1.0 1.0
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assign (resid 51 and name HA ) (resid 55 and (name HA1 or name HA2 )) 3.7 1.5 1.5
assign (resid 51 and name HA ) (resid 55 and (name HA2 or name HA1 )) 4.2 1.7 1.7
assign (resid 51 and name HA ) (resid 58 and name HD1# ) 3.4 1.4 1.4
assign (resid 51 and name HB ) (resid 51 and (name HG1# or name HG2# )) 1.8 0.7 0.7
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assign (resid 53 and name HA ) (resid 53 and name HB ) 2.1 0.8 0.8
assign (resid 53 and name HA ) (resid 53 and name HG2# ) 1.8 0.7 0.7
assign (resid 53 and name HA ) (resid 54 and name HA ) 4.5 1.8 1.8
assign (resid 53 and name HA ) (resid 54 and name HD# ) 2.5 1.3 1.3
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assign (resid 53 and name HB ) (resid 53 and name HG2# ) 1.8 0.7 0.7
assign (resid 53 and name HB ) (resid 54 and name HD# ) 3.7 1.5 1.5
assign (resid 53 and name HB ) (resid 54 and name HE# ) 4.8 1.9 1.9
assign (resid 53 and name HG2# ) (resid 54 and name HA ) 2.8 1.1 1.1
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assign (resid 53 and name HG2# ) (resid 54 and name HE# ) 2.1 0.8 0.8
assign (resid 54 and (name HB1 or name HB2 )) (resid 54 and name HD# ) 2.5 1.0 1.0
assign (resid 54 and (name HB1 or name HB2 )) (resid 54 and name HE# ) 3.5 1.4 1.4
assign (resid 54 and (name HB1 or name HB2 )) (resid 58 and name HD1# ) 2.8 1.1 1.1
assign (resid 54 and (name HB2 or name HB1 )) (resid 54 and name HD# ) 2.5 1.0 1.0
assign (resid 54 and (name HB2 or name HB1 )) (resid 54 and name HE# ) 3.9 1.6 1.6
assign (resid 54 and (name HB2 or name HB1 )) (resid 58 and name HD1# ) 2.9 1.2 1.2
assign (resid 54 and name HA ) (resid 54 and (name HB1 or name HB2 )) 2.5 1.0 1.0
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assign (resid 54 and name HA ) (resid 57 and (name HB1 or name HB2 )) 2.7 1.1 1.1
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assign (resid 54 and name HA ) (resid 58 and (name HG12 or name HG13 )) 4.3 1.7 1.7
assign (resid 54 and name HA ) (resid 58 and name HD1# ) 3.2 1.3 1.3
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assign (resid 54 and name HD# ) (resid 57 and (name HB1 or name HB2 )) 3.5 1.4 1.4
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assign (resid 54 and name HD# ) (resid 58 and name HD1# ) 2.6 1.0 1.0
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assign (resid 54 and name HE# ) (resid 57 and (name HB2 or name HB1 )) 5.0 2.0 2.0
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assign (resid 55 and (name HA1 or name HA2 )) (resid 58 and name HB ) 3.5 1.4 1.4
assign (resid 55 and (name HA1 or name HA2 )) (resid 58 and name HD1# ) 3.1 1.2 1.2
assign (resid 55 and (name HA1 or name HA2 )) (resid 58 and name HG2# ) 3.6 1.4 1.4
assign (resid 55 and (name HA2 or name HA1 )) (resid 58 and name HB ) 3.3 1.3 1.3
assign (resid 55 and (name HA2 or name HA1 )) (resid 58 and name HD1# ) 2.8 1.1 1.1
assign (resid 55 and (name HA2 or name HA1 )) (resid 58 and name HG2# ) 3.5 1.4 1.4
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assign (resid 56 and name HA ) (resid 59 and (name HB1 or name HB2 )) 2.9 1.2 1.2
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assign (resid 56 and name HA ) (resid 59 and (name HD1# or name HD2# )) 2.1 0.8 0.8
assign (resid 56 and name HA ) (resid 59 and (name HD2# or name HD1# )) 3.5 1.4 1.4
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assign (resid 56 and name HB# ) (resid 59 and (name HB2 or name HB1 )) 3.8 1.5 1.5
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assign (resid 57 and (name HB1 or name HB2 )) (resid 58 and name HA ) 4.3 1.7 1.7
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assign (resid 57 and (name HB1 or name HB2 )) (resid 61 and name HD1# ) 3.5 1.8 1.8
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assign (resid 57 and (name HB2 or name HB1 )) (resid 58 and name HG2# ) 2.9 1.2 1.2
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assign (resid 57 and (name HB2 or name HB1 )) (resid 61 and (name HG12 or name HG13 )) 3.1 1.2 1.2
assign (resid 57 and name HA ) (resid 57 and (name HB1 or name HB2 )) 1.8 0.7 0.7
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assign (resid 58 and (name HG12 or name HG13 )) (resid 59 and (name HD1# or name HD2# )) 2.7 1.1 1.1
assign (resid 58 and (name HG12 or name HG13 )) (resid 59 and (name HD2# or name HD1# )) 2.9 1.2 1.2
assign (resid 58 and (name HG12 or name HG13 )) (resid 59 and name HA ) 2.5 1.0 1.0
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assign (resid 58 and (name HG13 or name HG12 )) (resid 58 and name HG2# ) 1.9 0.8 0.8
assign (resid 58 and name HA ) (resid 58 and (name HG12 or name HG13 )) 2.3 0.9 0.9
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assign (resid 58 and name HD1# ) (resid 59 and name HG ) 2.7 1.1 1.1
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assign (resid 59 and (name HB1 or name HB2 )) (resid 59 and (name HD2# or name HD1# )) 2.1 0.8 0.8
assign (resid 59 and (name HB1 or name HB2 )) (resid 59 and name HG ) 1.9 0.8 0.8
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assign (resid 59 and (name HB2 or name HB1 )) (resid 59 and (name HD2# or name HD1# )) 1.9 0.8 0.8
assign (resid 59 and (name HB2 or name HB1 )) (resid 59 and name HG ) 2.0 0.8 0.8
assign (resid 59 and (name HD1# or name HD2# )) (resid 59 and name HG ) 1.7 0.7 0.7
assign (resid 59 and (name HD2# or name HD1# )) (resid 59 and name HG ) 1.8 0.7 0.7
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assign (resid 61 and name HA ) (resid 61 and (name HG12 or name HG13 )) 2.2 0.9 0.9
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assign (resid 61 and name HA ) (resid 61 and name HD1# ) 1.9 0.8 0.8
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assign (resid 61 and name HB ) (resid 61 and (name HG12 or name HG13 )) 2.3 0.9 0.9
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assign (resid 61 and name HG2# ) (resid 66 and name HB ) 2.8 1.1 1.1
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assign (resid 62 and (name HB2 or name HB1 )) (resid 62 and name HG ) 2.5 1.0 1.0
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assign (resid 62 and name HA ) (resid 62 and (name HB2 or name HB1 )) 2.6 1.0 1.0
assign (resid 62 and name HA ) (resid 62 and (name HD1# or name HD2# )) 2.7 1.1 1.1
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assign (resid 62 and name HA ) (resid 62 and name HG ) 2.9 1.2 1.2
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assign (resid 66 and (name HG1# or name HG2# )) (resid 70 and name HB# ) 2.4 1.0 1.0
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assign (resid 66 and name HA ) (resid 66 and (name HG1# or name HG2# )) 1.9 0.8 0.8
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assign (resid 66 and name HB ) (resid 66 and (name HG1# or name HG2# )) 1.8 0.7 0.7
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assign (resid 67 and name HA ) (resid 67 and (name HB1 or name HB2 )) 3.3 1.3 1.3
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assign (resid 67 and (name HB2 or name HB1 )) (resid 68 and name HD# ) 2.8 1.1 1.1
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assign (resid 67 and (name HB2 or name HB1 )) (resid 70 and name HG ) 3.8 1.5 1.5
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assign (resid 68 and (name HG2 or name HG1 )) (resid 69 and name HA ) 4.5 1.8 1.8
assign (resid 68 and name HA ) (resid 68 and (name HB1 or name HB2 )) 3.5 1.4 1.4
assign (resid 68 and name HA ) (resid 68 and (name HB2 or name HB1 )) 2.9 1.2 1.2
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assign (resid 68 and name HA ) (resid 68 and (name HG2 or name HG1 )) 3.8 1.5 1.5
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assign (resid 68 and name HA ) (resid 71 and (name HG1# or name HG2# )) 2.6 1.0 1.0
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assign (resid 68 and name HA ) (resid 71 and name HB ) 2.9 1.2 1.2
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assign (resid 70 and (name HD1# or name HD2# )) (resid 70 and name HG ) 1.9 0.8 0.8
assign (resid 70 and (name HD1# or name HD2# )) (resid 71 and name HA ) 3.3 1.3 1.3
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assign (resid 70 and (name HD1# or name HD2# )) (resid 74 and name HE# ) 2.4 1.0 1.0
assign (resid 70 and (name HD2# or name HD1# )) (resid 70 and name HG ) 1.8 0.7 0.7
assign (resid 70 and (name HD2# or name HD1# )) (resid 73 and (name HB1 or name HB2 )) 3.2 1.3 1.3
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assign (resid 70 and name HA ) (resid 70 and (name HD1# or name HD2# )) 2.2 0.9 0.9
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assign (resid 71 and name HA ) (resid 71 and (name HG1# or name HG2# )) 1.9 0.8 0.8
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assign (resid 71 and name HA ) (resid 74 and (name HG1 or name HG2 )) 3.6 1.4 1.4
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assign (resid 71 and name HB ) (resid 71 and (name HG1# or name HG2# )) 1.9 0.8 0.8
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assign (resid 74 and name HA ) (resid 74 and (name HB1 or name HB2 )) 2.8 1.1 1.1
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assign (resid 74 and name HA ) (resid 74 and (name HG1 or name HG2 )) 2.2 0.9 0.9
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assign (resid 81 and name HB# ) (resid 81 and (name HD2# or name HD1# )) 1.8 0.7 0.7
assign (resid 81 and name HB# ) (resid 81 and name HG ) 1.6 0.6 0.6
assign (resid 81 and name HB# ) (resid 82 and (name HG1# or name HG2# )) 3.7 1.5 1.5
assign (resid 81 and name HB# ) (resid 82 and (name HG2# or name HG1# )) 2.5 1.0 1.0
assign (resid 81 and name HB# ) (resid 82 and name HA ) 3.6 1.4 1.4
assign (resid 81 and name HG ) (resid 82 and (name HG2# or name HG1# )) 4.0 1.6 1.6
assign (resid 82 and (name HG1# or name HG2# )) (resid 83 and (name HD1 or name HD2 )) 2.6 1.0 1.0
assign (resid 82 and (name HG1# or name HG2# )) (resid 83 and (name HD2 or name HD1 )) 2.0 0.8 0.8
assign (resid 82 and (name HG1# or name HG2# )) (resid 83 and name HA ) 4.0 1.6 1.6
assign (resid 82 and (name HG1# or name HG2# )) (resid 83 and (name HG1 or name HG2 )) 3.4 1.4 1.4
assign (resid 82 and (name HG1# or name HG2# )) (resid 84 and name HA ) 4.5 1.8 1.8
assign (resid 82 and (name HG1# or name HG2# )) (resid 84 and name HD# ) 4.0 1.6 1.6
assign (resid 82 and (name HG2# or name HG1# )) (resid 83 and (name HD1 or name HD2 )) 2.6 1.0 1.0
assign (resid 82 and (name HG2# or name HG1# )) (resid 83 and (name HD2 or name HD1 )) 2.7 1.1 1.1
assign (resid 82 and (name HG2# or name HG1# )) (resid 83 and (name HG1 or name HG2 )) 4.4 1.8 1.8
assign (resid 82 and (name HG2# or name HG1# )) (resid 83 and (name HG2 or name HG1 )) 5.1 2.0 2.0
assign (resid 82 and (name HG2# or name HG1# )) (resid 83 and name HA ) 4.5 1.8 1.8
assign (resid 82 and (name HG2# or name HG1# )) (resid 84 and name HA ) 3.5 1.4 1.4
assign (resid 82 and (name HG2# or name HG1# )) (resid 84 and name HG# ) 3.1 1.2 1.2
assign (resid 82 and (name HG2# or name HG1# )) (resid 84 and name HD# ) 4.3 1.7 1.7
assign (resid 82 and name HA ) (resid 82 and (name HG1# or name HG2# )) 1.8 0.7 0.7
assign (resid 82 and name HA ) (resid 82 and (name HG2# or name HG1# )) 1.8 0.7 0.7
assign (resid 82 and name HA ) (resid 82 and name HB ) 1.9 0.8 0.8
assign (resid 82 and name HA ) (resid 83 and (name HB2 or name HB1 )) 4.0 1.6 1.6
assign (resid 82 and name HA ) (resid 83 and (name HD1 or name HD2 )) 1.7 0.7 0.7
assign (resid 82 and name HA ) (resid 83 and (name HD2 or name HD1 )) 1.7 0.7 0.7
assign (resid 82 and name HA ) (resid 83 and (name HG1 or name HG2 )) 2.8 1.1 1.1
assign (resid 82 and name HA ) (resid 83 and (name HG2 or name HG1 )) 3.4 1.4 1.4
assign (resid 82 and name HB ) (resid 82 and (name HG1# or name HG2# )) 1.7 0.7 0.7
assign (resid 82 and name HB ) (resid 82 and (name HG2# or name HG1# )) 1.7 0.7 0.7
assign (resid 82 and name HB ) (resid 83 and (name HD1 or name HD2 )) 2.7 1.1 1.1
assign (resid 82 and name HB ) (resid 83 and (name HD2 or name HD1 )) 2.0 0.8 0.8
assign (resid 83 and (name HB1 or name HB2 )) (resid 83 and (name HD1 or name HD2 )) 2.3 0.9 0.9
assign (resid 83 and (name HB1 or name HB2 )) (resid 83 and (name HD2 or name HD1 )) 2.6 1.0 1.0
assign (resid 83 and (name HB1 or name HB2 )) (resid 83 and (name HG1 or name HG2 )) 1.8 0.7 0.7
assign (resid 83 and (name HB1 or name HB2 )) (resid 83 and (name HG2 or name HG1 )) 1.7 0.7 0.7
assign (resid 83 and (name HB2 or name HB1 )) (resid 83 and (name HD1 or name HD2 )) 2.5 1.0 1.0
assign (resid 83 and (name HB2 or name HB1 )) (resid 83 and (name HD2 or name HD1 )) 2.2 0.9 0.9
assign (resid 83 and (name HB2 or name HB1 )) (resid 83 and (name HG1 or name HG2 )) 1.7 0.7 0.7
assign (resid 83 and (name HB2 or name HB1 )) (resid 83 and (name HG2 or name HG1 )) 1.6 0.6 0.6
assign (resid 83 and (name HD1 or name HD2 )) (resid 83 and (name HG2 or name HG1 )) 1.9 0.8 0.8
assign (resid 83 and (name HD2 or name HD1 )) (resid 83 and (name HG1 or name HG2 )) 1.8 0.7 0.7
assign (resid 83 and name HA ) (resid 83 and (name HB1 or name HB2 )) 1.8 0.7 0.7
assign (resid 83 and name HA ) (resid 83 and (name HB2 or name HB1 )) 1.9 0.8 0.8
assign (resid 83 and name HA ) (resid 83 and (name HD1 or name HD2 )) 2.3 0.9 0.9
assign (resid 83 and name HA ) (resid 83 and (name HD2 or name HD1 )) 3.0 1.2 1.2
assign (resid 83 and name HA ) (resid 83 and (name HG1 or name HG2 )) 2.8 1.1 1.1
assign (resid 83 and name HA ) (resid 83 and (name HG2 or name HG1 )) 2.1 0.8 0.8
assign (resid 83 and name HA ) (resid 84 and name HA ) 3.7 1.5 1.5
assign (resid 83 and name HA ) (resid 84 and name HG# ) 3.8 1.5 1.5
assign (resid 84 and (name HB1 or name HB2 )) (resid 84 and name HD# ) 2.0 0.8 0.8
assign (resid 84 and (name HB1 or name HB2 )) (resid 84 and name HG# ) 1.7 0.7 0.7
assign (resid 84 and (name HB2 or name HB1 )) (resid 84 and name HD# ) 2.3 0.9 0.9
assign (resid 84 and (name HB2 or name HB1 )) (resid 84 and name HG# ) 1.7 0.7 0.7
assign (resid 84 and name HA ) (resid 84 and (name HB1 or name HB2 )) 2.1 0.8 0.8
assign (resid 84 and name HA ) (resid 84 and (name HB2 or name HB1 )) 2.1 0.8 0.8
assign (resid 84 and name HA ) (resid 84 and name HB# ) 2.0 0.8 0.8
assign (resid 84 and name HA ) (resid 84 and name HD# ) 2.3 0.9 0.9
assign (resid 84 and name HA ) (resid 84 and name HG# ) 2.1 0.8 0.8
assign (resid 84 and name HD# ) (resid 84 and name HG# ) 1.8 0.7 0.7

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1           HT1      SER   1  23.035   3.651  10.472
    2   2H    SER   1           HT2      SER   1  24.360   2.606  10.673
    3   3H    SER   1           HT3      SER   1  22.778   1.985  10.660
    4    HA   SER   1           HA       SER   1  23.275   3.464   8.291
    5   1HB   SER   1          HB2       SER   1  25.622   2.798   8.737
    6   2HB   SER   1          HB1       SER   1  25.112   1.118   8.875
    7    HG   SER   1           HG       SER   1  25.814   1.488   6.784
    8    H    ASP   2           HN       ASP   2  22.089   0.955  10.217
    9    HA   ASP   2           HA       ASP   2  20.293   0.076   8.069
   10   1HB   ASP   2          HB2       ASP   2  22.173  -1.899   9.406
   11   2HB   ASP   2          HB1       ASP   2  20.872  -2.314   8.290
   12    H    VAL   3           HN       VAL   3  19.787   1.440  10.471
   13    HA   VAL   3           HA       VAL   3  18.846  -0.524  12.448
   14    HB   VAL   3           HB       VAL   3  18.575   2.466  12.357
   15   1HG1  VAL   3          HG11      VAL   3  16.845   1.554  13.765
   16   2HG1  VAL   3          HG12      VAL   3  18.117   2.159  14.825
   17   3HG1  VAL   3          HG13      VAL   3  17.981   0.429  14.511
   18   1HG2  VAL   3          HG21      VAL   3  20.491   0.673  13.870
   19   2HG2  VAL   3          HG22      VAL   3  20.386   2.425  14.046
   20   3HG2  VAL   3          HG23      VAL   3  20.914   1.722  12.517
   21    H    TYR   4           HN       TYR   4  17.387   2.003  10.390
   22    HA   TYR   4           HA       TYR   4  14.684   1.170  11.026
   23   1HB   TYR   4          HB2       TYR   4  15.956   3.096   9.103
   24   2HB   TYR   4          HB1       TYR   4  14.286   2.617   8.807
   25    HD1  TYR   4           HD1      TYR   4  15.925   2.955  12.145
   26    HD2  TYR   4           HD2      TYR   4  13.142   4.638   9.339
   27    HE1  TYR   4           HE1      TYR   4  15.152   4.541  13.873
   28    HE2  TYR   4           HE2      TYR   4  12.366   6.232  11.072
   29    HH   TYR   4           HH       TYR   4  13.272   7.257  13.164
   30    H    CYS   5           HN       CYS   5  17.026   0.310   8.549
   31    HA   CYS   5           HA       CYS   5  15.295  -0.895   6.659
   32   1HB   CYS   5          HB2       CYS   5  18.021  -1.931   7.493
   33   2HB   CYS   5          HB1       CYS   5  17.216  -2.198   5.947
   34    H    GLU   6           HN       GLU   6  16.711  -2.217   9.646
   35    HA   GLU   6           HA       GLU   6  15.486  -4.828   9.296
   36   1HB   GLU   6          HB2       GLU   6  16.587  -3.503  11.795
   37   2HB   GLU   6          HB1       GLU   6  16.201  -5.216  11.626
   38   1HG   GLU   6          HG2       GLU   6  17.865  -5.418   9.816
   39   2HG   GLU   6          HG1       GLU   6  18.252  -3.705   9.978
   40    H    VAL   7           HN       VAL   7  14.768  -2.025  11.403
   41    HA   VAL   7           HA       VAL   7  12.421  -3.088  12.596
   42    HB   VAL   7           HB       VAL   7  12.979  -0.191  11.884
   43   1HG1  VAL   7          HG11      VAL   7  11.120  -1.535  13.859
   44   2HG1  VAL   7          HG12      VAL   7  10.683  -0.456  12.534
   45   3HG1  VAL   7          HG13      VAL   7  11.537   0.177  13.942
   46   1HG2  VAL   7          HG21      VAL   7  14.759  -1.468  13.240
   47   2HG2  VAL   7          HG22      VAL   7  13.545  -1.575  14.514
   48   3HG2  VAL   7          HG23      VAL   7  14.115   0.003  13.969
   49    H    CYS   8           HN       CYS   8  12.940  -1.503   9.489
   50    HA   CYS   8           HA       CYS   8  10.099  -1.289   8.873
   51   1HB   CYS   8          HB2       CYS   8  11.754   0.231   7.853
   52   2HB   CYS   8          HB1       CYS   8  12.534  -1.141   7.068
   53    H    GLU   9           HN       GLU   9  12.455  -3.781   8.740
   54    HA   GLU   9           HA       GLU   9  10.903  -5.338   6.711
   55   1HB   GLU   9          HB2       GLU   9  13.458  -5.359   6.668
   56   2HB   GLU   9          HB1       GLU   9  13.394  -6.296   8.168
   57   1HG   GLU   9          HG2       GLU   9  12.069  -8.024   7.069
   58   2HG   GLU   9          HG1       GLU   9  12.026  -7.077   5.581
   59    H    PHE  10           HN       PHE  10  11.586  -5.270  10.160
   60    HA   PHE  10           HA       PHE  10  10.357  -7.866  10.657
   61   1HB   PHE  10          HB2       PHE  10  12.048  -6.976  12.197
   62   2HB   PHE  10          HB1       PHE  10  11.019  -5.586  12.546
   63    HD1  PHE  10           HD1      PHE  10   9.456  -5.702  14.305
   64    HD2  PHE  10           HD2      PHE  10  11.015  -9.331  12.614
   65    HE1  PHE  10           HE1      PHE  10   8.283  -7.018  16.048
   66    HE2  PHE  10           HE2      PHE  10   9.841 -10.646  14.358
   67    HZ   PHE  10           HZ       PHE  10   8.475  -9.491  16.075
   68    H    LEU  11           HN       LEU  11   9.277  -4.508  10.624
   69    HA   LEU  11           HA       LEU  11   6.650  -5.213  11.761
   70   1HB   LEU  11          HB2       LEU  11   7.631  -2.616  10.540
   71   2HB   LEU  11          HB1       LEU  11   6.132  -2.829  11.440
   72    HG   LEU  11           HG       LEU  11   8.893  -3.375  12.573
   73   1HD1  LEU  11          HD11      LEU  11   7.074  -1.008  13.099
   74   2HD1  LEU  11          HD12      LEU  11   8.452  -0.961  12.000
   75   3HD1  LEU  11          HD13      LEU  11   8.706  -1.255  13.721
   76   1HD2  LEU  11          HD21      LEU  11   7.386  -4.628  13.874
   77   2HD2  LEU  11          HD22      LEU  11   6.082  -3.458  13.677
   78   3HD2  LEU  11          HD23      LEU  11   7.436  -3.099  14.747
   79    H    VAL  12           HN       VAL  12   7.848  -3.959   8.619
   80    HA   VAL  12           HA       VAL  12   5.332  -4.097   7.298
   81    HB   VAL  12           HB       VAL  12   8.071  -4.482   6.061
   82   1HG1  VAL  12          HG11      VAL  12   6.834  -3.387   4.098
   83   2HG1  VAL  12          HG12      VAL  12   5.348  -3.752   4.973
   84   3HG1  VAL  12          HG13      VAL  12   6.411  -5.060   4.457
   85   1HG2  VAL  12          HG21      VAL  12   6.501  -1.905   6.306
   86   2HG2  VAL  12          HG22      VAL  12   8.190  -2.107   5.845
   87   3HG2  VAL  12          HG23      VAL  12   7.692  -2.387   7.513
   88    H    LYS  13           HN       LYS  13   7.609  -6.600   8.146
   89    HA   LYS  13           HA       LYS  13   6.428  -8.567   6.293
   90   1HB   LYS  13          HB2       LYS  13   8.814  -8.631   6.808
   91   2HB   LYS  13          HB1       LYS  13   8.449  -8.859   8.514
   92   1HG   LYS  13          HG2       LYS  13   6.993 -10.898   7.125
   93   2HG   LYS  13          HG1       LYS  13   8.591 -10.863   6.394
   94   1HD   LYS  13          HD2       LYS  13   8.809 -12.386   8.183
   95   2HD   LYS  13          HD1       LYS  13   9.503 -10.893   8.812
   96   1HE   LYS  13          HE2       LYS  13   7.419 -10.368   9.973
   97   2HE   LYS  13          HE1       LYS  13   6.638 -11.782   9.266
   98   1HZ   LYS  13          HZ1       LYS  13   7.290 -12.547  11.319
   99   2HZ   LYS  13          HZ2       LYS  13   8.737 -11.657  11.325
  100   3HZ   LYS  13          HZ3       LYS  13   8.592 -13.040  10.350
  101    H    GLU  14           HN       GLU  14   6.514  -7.962   9.819
  102    HA   GLU  14           HA       GLU  14   4.852 -10.202  10.522
  103   1HB   GLU  14          HB2       GLU  14   6.287  -8.892  12.127
  104   2HB   GLU  14          HB1       GLU  14   5.122  -7.572  12.010
  105   1HG   GLU  14          HG2       GLU  14   3.344  -9.012  12.858
  106   2HG   GLU  14          HG1       GLU  14   4.440 -10.395  12.882
  107    H    VAL  15           HN       VAL  15   4.113  -6.762   9.947
  108    HA   VAL  15           HA       VAL  15   1.317  -6.940  10.408
  109    HB   VAL  15           HB       VAL  15   2.706  -4.822  10.003
  110   1HG1  VAL  15          HG11      VAL  15   3.035  -4.077   7.754
  111   2HG1  VAL  15          HG12      VAL  15   2.084  -5.409   7.101
  112   3HG1  VAL  15          HG13      VAL  15   3.658  -5.723   7.826
  113   1HG2  VAL  15          HG21      VAL  15   0.735  -3.737   8.718
  114   2HG2  VAL  15          HG22      VAL  15   0.374  -4.529  10.251
  115   3HG2  VAL  15          HG23      VAL  15   0.018  -5.350   8.733
  116    H    THR  16           HN       THR  16   3.226  -7.452   7.448
  117    HA   THR  16           HA       THR  16   1.147  -8.011   5.654
  118    HB   THR  16           HB       THR  16   3.176  -9.896   5.055
  119    HG1  THR  16           HG1      THR  16   4.146  -7.589   6.343
  120   1HG2  THR  16          HG21      THR  16   4.005  -8.015   3.556
  121   2HG2  THR  16          HG22      THR  16   2.755  -7.002   4.289
  122   3HG2  THR  16          HG23      THR  16   2.295  -8.446   3.374
  123    H    LYS  17           HN       LYS  17   2.785 -10.300   7.881
  124    HA   LYS  17           HA       LYS  17   1.460 -12.652   7.204
  125   1HB   LYS  17          HB2       LYS  17   2.461 -11.566   9.824
  126   2HB   LYS  17          HB1       LYS  17   1.537 -13.065   9.831
  127   1HG   LYS  17          HG2       LYS  17   3.113 -14.013   8.156
  128   2HG   LYS  17          HG1       LYS  17   4.058 -12.525   8.231
  129   1HD   LYS  17          HD2       LYS  17   4.661 -12.899  10.504
  130   2HD   LYS  17          HD1       LYS  17   3.440 -14.157  10.699
  131   1HE   LYS  17          HE2       LYS  17   5.844 -14.345   8.859
  132   2HE   LYS  17          HE1       LYS  17   5.721 -15.110  10.444
  133   1HZ   LYS  17          HZ1       LYS  17   5.092 -16.741   8.907
  134   2HZ   LYS  17          HZ2       LYS  17   4.124 -15.666   8.015
  135   3HZ   LYS  17          HZ3       LYS  17   3.630 -16.180   9.557
  136    H    LEU  18           HN       LEU  18   0.200  -9.975   9.192
  137    HA   LEU  18           HA       LEU  18  -2.390 -11.388   9.479
  138   1HB   LEU  18          HB2       LEU  18  -2.674 -10.061  11.311
  139   2HB   LEU  18          HB1       LEU  18  -0.992  -9.607  11.087
  140    HG   LEU  18           HG       LEU  18  -1.821  -7.727   9.579
  141   1HD1  LEU  18          HD11      LEU  18  -4.019  -7.585   9.072
  142   2HD1  LEU  18          HD12      LEU  18  -4.456  -7.529  10.777
  143   3HD1  LEU  18          HD13      LEU  18  -4.317  -9.082   9.953
  144   1HD2  LEU  18          HD21      LEU  18  -2.721  -7.729  12.475
  145   2HD2  LEU  18          HD22      LEU  18  -2.381  -6.301  11.498
  146   3HD2  LEU  18          HD23      LEU  18  -1.078  -7.414  11.916
  147    H    ILE  19           HN       ILE  19  -1.076  -8.533   7.828
  148    HA   ILE  19           HA       ILE  19  -3.545  -7.716   6.617
  149    HB   ILE  19           HB       ILE  19  -0.682  -7.085   6.508
  150   1HG1  ILE  19          HG12      ILE  19  -3.030  -5.280   5.945
  151   2HG1  ILE  19          HG11      ILE  19  -2.504  -5.706   7.574
  152   1HG2  ILE  19          HG21      ILE  19  -0.820  -5.852   4.321
  153   2HG2  ILE  19          HG22      ILE  19  -2.305  -6.738   3.988
  154   3HG2  ILE  19          HG23      ILE  19  -0.780  -7.605   4.172
  155   1HD1  ILE  19          HD11      ILE  19  -1.263  -3.884   5.609
  156   2HD1  ILE  19          HD12      ILE  19  -0.114  -4.937   6.440
  157   3HD1  ILE  19          HD13      ILE  19  -1.174  -3.868   7.366
  158    H    ASP  20           HN       ASP  20  -1.358 -10.280   6.027
  159    HA   ASP  20           HA       ASP  20  -1.246 -10.783   3.363
  160   1HB   ASP  20          HB2       ASP  20  -0.446 -12.365   5.077
  161   2HB   ASP  20          HB1       ASP  20  -2.111 -12.823   5.440
  162    H    ASN  21           HN       ASN  21  -4.166 -11.488   5.353
  163    HA   ASN  21           HA       ASN  21  -5.873 -10.949   3.041
  164   1HB   ASN  21          HB2       ASN  21  -5.556 -13.753   4.129
  165   2HB   ASN  21          HB1       ASN  21  -6.965 -13.247   3.195
  166   1HD2  ASN  21          HD21      ASN  21  -5.954 -11.726   1.157
  167   2HD2  ASN  21          HD22      ASN  21  -4.826 -12.600   0.238
  168    H    ASN  22           HN       ASN  22  -5.551 -10.096   5.942
  169    HA   ASN  22           HA       ASN  22  -7.867 -11.150   7.338
  170   1HB   ASN  22          HB2       ASN  22  -7.479  -9.391   8.967
  171   2HB   ASN  22          HB1       ASN  22  -5.924 -10.079   8.506
  172   1HD2  ASN  22          HD21      ASN  22  -5.919  -8.699   5.850
  173   2HD2  ASN  22          HD22      ASN  22  -5.594  -7.066   6.183
  174    H    LYS  23           HN       LYS  23  -7.237  -8.314   5.323
  175    HA   LYS  23           HA       LYS  23 -10.161  -7.644   5.395
  176   1HB   LYS  23          HB2       LYS  23  -9.534  -5.389   4.790
  177   2HB   LYS  23          HB1       LYS  23  -8.577  -5.878   6.183
  178   1HG   LYS  23          HG2       LYS  23  -6.819  -5.102   4.919
  179   2HG   LYS  23          HG1       LYS  23  -6.908  -6.703   4.191
  180   1HD   LYS  23          HD2       LYS  23  -8.702  -5.514   2.610
  181   2HD   LYS  23          HD1       LYS  23  -7.844  -4.061   3.107
  182   1HE   LYS  23          HE2       LYS  23  -6.563  -6.510   1.860
  183   2HE   LYS  23          HE1       LYS  23  -6.886  -4.988   1.033
  184   1HZ   LYS  23          HZ1       LYS  23  -5.014  -4.159   1.838
  185   2HZ   LYS  23          HZ2       LYS  23  -4.658  -5.659   2.550
  186   3HZ   LYS  23          HZ3       LYS  23  -5.504  -4.477   3.430
  187    H    THR  24           HN       THR  24 -11.279  -8.049   3.559
  188    HA   THR  24           HA       THR  24  -9.831  -9.020   1.192
  189    HB   THR  24           HB       THR  24 -12.189  -9.338   0.304
  190    HG1  THR  24           HG1      THR  24 -12.803  -7.656   2.092
  191   1HG2  THR  24          HG21      THR  24 -12.616 -11.256   1.723
  192   2HG2  THR  24          HG22      THR  24 -11.651 -10.560   3.024
  193   3HG2  THR  24          HG23      THR  24 -10.870 -11.091   1.535
  194    H    GLU  25           HN       GLU  25 -11.314  -8.171  -0.929
  195    HA   GLU  25           HA       GLU  25 -10.629  -5.270  -1.051
  196   1HB   GLU  25          HB2       GLU  25 -11.412  -6.951  -3.428
  197   2HB   GLU  25          HB1       GLU  25 -10.353  -5.541  -3.362
  198   1HG   GLU  25          HG2       GLU  25  -8.786  -6.965  -1.925
  199   2HG   GLU  25          HG1       GLU  25  -9.770  -8.348  -2.401
  200    H    LYS  26           HN       LYS  26 -13.268  -6.797  -0.106
  201    HA   LYS  26           HA       LYS  26 -15.237  -5.579  -1.920
  202   1HB   LYS  26          HB2       LYS  26 -15.419  -7.225   0.610
  203   2HB   LYS  26          HB1       LYS  26 -16.840  -6.453  -0.089
  204   1HG   LYS  26          HG2       LYS  26 -16.723  -7.726  -2.066
  205   2HG   LYS  26          HG1       LYS  26 -15.039  -8.173  -1.797
  206   1HD   LYS  26          HD2       LYS  26 -17.110  -9.042   0.213
  207   2HD   LYS  26          HD1       LYS  26 -16.984  -9.916  -1.311
  208   1HE   LYS  26          HE2       LYS  26 -14.725 -10.539  -0.892
  209   2HE   LYS  26          HE1       LYS  26 -14.565  -9.378   0.424
  210   1HZ   LYS  26          HZ1       LYS  26 -16.660 -11.401   0.649
  211   2HZ   LYS  26          HZ2       LYS  26 -15.695 -10.697   1.858
  212   3HZ   LYS  26          HZ3       LYS  26 -15.058 -11.915   0.859
  213    H    GLU  27           HN       GLU  27 -14.052  -5.161   1.406
  214    HA   GLU  27           HA       GLU  27 -15.723  -2.821   1.827
  215   1HB   GLU  27          HB2       GLU  27 -14.669  -2.634   3.975
  216   2HB   GLU  27          HB1       GLU  27 -14.914  -4.353   3.678
  217   1HG   GLU  27          HG2       GLU  27 -12.538  -4.430   2.794
  218   2HG   GLU  27          HG1       GLU  27 -12.339  -2.787   3.404
  219    H    ILE  28           HN       ILE  28 -12.803  -3.395   0.183
  220    HA   ILE  28           HA       ILE  28 -11.667  -0.727   0.630
  221    HB   ILE  28           HB       ILE  28 -10.983  -2.904  -1.374
  222   1HG1  ILE  28          HG12      ILE  28 -10.469  -3.615   0.896
  223   2HG1  ILE  28          HG11      ILE  28  -8.971  -3.218   0.071
  224   1HG2  ILE  28          HG21      ILE  28 -10.241  -0.885  -2.332
  225   2HG2  ILE  28          HG22      ILE  28  -8.818  -1.519  -1.511
  226   3HG2  ILE  28          HG23      ILE  28  -9.753  -0.221  -0.775
  227   1HD1  ILE  28          HD11      ILE  28 -10.358  -1.750   2.282
  228   2HD1  ILE  28          HD12      ILE  28  -9.383  -0.824   1.142
  229   3HD1  ILE  28          HD13      ILE  28  -8.646  -2.116   2.083
  230    H    LEU  29           HN       LEU  29 -12.504  -2.368  -2.429
  231    HA   LEU  29           HA       LEU  29 -12.814  -0.111  -4.014
  232   1HB   LEU  29          HB2       LEU  29 -14.561  -2.592  -4.111
  233   2HB   LEU  29          HB1       LEU  29 -14.325  -1.449  -5.430
  234    HG   LEU  29           HG       LEU  29 -11.961  -2.830  -4.146
  235   1HD1  LEU  29          HD11      LEU  29 -12.145  -4.461  -6.104
  236   2HD1  LEU  29          HD12      LEU  29 -13.808  -3.900  -6.287
  237   3HD1  LEU  29          HD13      LEU  29 -13.303  -4.689  -4.792
  238   1HD2  LEU  29          HD21      LEU  29 -11.061  -2.498  -6.497
  239   2HD2  LEU  29          HD22      LEU  29 -11.378  -1.005  -5.612
  240   3HD2  LEU  29          HD23      LEU  29 -12.509  -1.556  -6.848
  241    H    ASP  30           HN       ASP  30 -15.022  -1.368  -1.590
  242    HA   ASP  30           HA       ASP  30 -17.242   0.359  -2.335
  243   1HB   ASP  30          HB2       ASP  30 -17.562  -1.698  -0.974
  244   2HB   ASP  30          HB1       ASP  30 -16.619  -0.967   0.326
  245    H    ALA  31           HN       ALA  31 -14.725   0.445   0.190
  246    HA   ALA  31           HA       ALA  31 -15.320   2.863   1.437
  247   1HB   ALA  31          HB1       ALA  31 -13.396   1.349   1.996
  248   2HB   ALA  31          HB2       ALA  31 -12.987   3.064   1.974
  249   3HB   ALA  31          HB3       ALA  31 -12.534   2.029   0.616
  250    H    PHE  32           HN       PHE  32 -13.362   2.449  -1.538
  251    HA   PHE  32           HA       PHE  32 -12.906   5.177  -2.050
  252   1HB   PHE  32          HB2       PHE  32 -13.325   2.829  -3.914
  253   2HB   PHE  32          HB1       PHE  32 -13.027   4.450  -4.537
  254    HD1  PHE  32           HD1      PHE  32 -11.574   1.531  -2.907
  255    HD2  PHE  32           HD2      PHE  32 -10.903   5.646  -3.947
  256    HE1  PHE  32           HE1      PHE  32  -9.146   1.236  -2.513
  257    HE2  PHE  32           HE2      PHE  32  -8.475   5.349  -3.550
  258    HZ   PHE  32           HZ       PHE  32  -7.597   3.145  -2.833
  259    H    ASP  33           HN       ASP  33 -15.810   3.215  -2.758
  260    HA   ASP  33           HA       ASP  33 -17.205   5.294  -4.143
  261   1HB   ASP  33          HB2       ASP  33 -18.492   3.207  -2.363
  262   2HB   ASP  33          HB1       ASP  33 -19.190   3.995  -3.779
  263    H    LYS  34           HN       LYS  34 -16.124   5.105  -0.972
  264    HA   LYS  34           HA       LYS  34 -18.236   6.978   0.045
  265   1HB   LYS  34          HB2       LYS  34 -16.098   5.538   1.648
  266   2HB   LYS  34          HB1       LYS  34 -17.527   6.369   2.267
  267   1HG   LYS  34          HG2       LYS  34 -18.993   4.738   1.195
  268   2HG   LYS  34          HG1       LYS  34 -17.606   3.945   0.456
  269   1HD   LYS  34          HD2       LYS  34 -16.780   3.767   2.996
  270   2HD   LYS  34          HD1       LYS  34 -18.503   3.922   3.325
  271   1HE   LYS  34          HE2       LYS  34 -17.375   1.875   1.393
  272   2HE   LYS  34          HE1       LYS  34 -17.658   1.543   3.098
  273   1HZ   LYS  34          HZ1       LYS  34 -19.555   1.850   0.938
  274   2HZ   LYS  34          HZ2       LYS  34 -19.985   2.644   2.378
  275   3HZ   LYS  34          HZ3       LYS  34 -19.687   0.972   2.383
  276    H    MET  35           HN       MET  35 -14.710   6.595   0.682
  277    HA   MET  35           HA       MET  35 -14.392   9.368   1.342
  278   1HB   MET  35          HB2       MET  35 -12.101   7.758   0.220
  279   2HB   MET  35          HB1       MET  35 -12.070   9.003   1.456
  280   1HG   MET  35          HG2       MET  35 -12.706   7.546   3.144
  281   2HG   MET  35          HG1       MET  35 -13.621   6.507   2.060
  282   1HE   MET  35          HE1       MET  35 -11.071   5.662  -0.352
  283   2HE   MET  35          HE2       MET  35 -12.737   5.497   0.174
  284   3HE   MET  35          HE3       MET  35 -11.612   4.176   0.448
  285    H    CYS  36           HN       CYS  36 -13.682   7.571  -1.661
  286    HA   CYS  36           HA       CYS  36 -12.904  10.004  -3.058
  287   1HB   CYS  36          HB2       CYS  36 -12.130   7.613  -3.589
  288   2HB   CYS  36          HB1       CYS  36 -13.712   7.384  -4.334
  289    H    SER  37           HN       SER  37 -15.657   9.572  -1.756
  290    HA   SER  37           HA       SER  37 -17.464   9.897  -4.080
  291   1HB   SER  37          HB2       SER  37 -19.226   9.555  -2.579
  292   2HB   SER  37          HB1       SER  37 -17.948   8.580  -1.863
  293    HG   SER  37           HG       SER  37 -18.948   9.956  -0.331
  294    H    LYS  38           HN       LYS  38 -16.145  11.710  -1.348
  295    HA   LYS  38           HA       LYS  38 -17.625  14.152  -2.085
  296   1HB   LYS  38          HB2       LYS  38 -16.473  15.133  -0.134
  297   2HB   LYS  38          HB1       LYS  38 -17.247  13.606   0.294
  298   1HG   LYS  38          HG2       LYS  38 -14.958  12.522  -0.264
  299   2HG   LYS  38          HG1       LYS  38 -14.314  14.159  -0.164
  300   1HD   LYS  38          HD2       LYS  38 -15.362  14.336   2.128
  301   2HD   LYS  38          HD1       LYS  38 -15.745  12.617   2.014
  302   1HE   LYS  38          HE2       LYS  38 -13.636  12.893   3.213
  303   2HE   LYS  38          HE1       LYS  38 -13.326  12.137   1.649
  304   1HZ   LYS  38          HZ1       LYS  38 -12.422  14.055   0.798
  305   2HZ   LYS  38          HZ2       LYS  38 -11.890  14.127   2.411
  306   3HZ   LYS  38          HZ3       LYS  38 -13.214  15.065   1.907
  307    H    LEU  39           HN       LEU  39 -14.677  12.664  -2.953
  308    HA   LEU  39           HA       LEU  39 -12.894  14.790  -3.227
  309   1HB   LEU  39          HB2       LEU  39 -13.132  12.132  -4.309
  310   2HB   LEU  39          HB1       LEU  39 -12.811  13.184  -5.663
  311    HG   LEU  39           HG       LEU  39 -10.937  14.036  -3.736
  312   1HD1  LEU  39          HD11      LEU  39 -10.831  11.030  -3.799
  313   2HD1  LEU  39          HD12      LEU  39 -11.651  11.900  -2.501
  314   3HD1  LEU  39          HD13      LEU  39  -9.924  12.144  -2.773
  315   1HD2  LEU  39          HD21      LEU  39  -9.297  13.098  -5.241
  316   2HD2  LEU  39          HD22      LEU  39 -10.643  13.688  -6.214
  317   3HD2  LEU  39          HD23      LEU  39 -10.478  11.961  -5.893
  318    HA   PRO  40           HA       PRO  40 -14.886  17.635  -6.029
  319   1HB   PRO  40          HB2       PRO  40 -12.436  17.955  -7.633
  320   2HB   PRO  40          HB1       PRO  40 -13.246  19.145  -6.604
  321   1HG   PRO  40          HG2       PRO  40 -10.812  17.779  -6.021
  322   2HG   PRO  40          HG1       PRO  40 -11.743  18.793  -4.908
  323   1HD   PRO  40          HD2       PRO  40 -11.439  15.911  -4.853
  324   2HD   PRO  40          HD1       PRO  40 -12.313  16.937  -3.701
  325    H    LYS  41           HN       LYS  41 -15.259  17.748  -8.540
  326    HA   LYS  41           HA       LYS  41 -15.826  15.101  -9.464
  327   1HB   LYS  41          HB2       LYS  41 -17.171  16.952 -10.236
  328   2HB   LYS  41          HB1       LYS  41 -15.765  17.714 -10.965
  329   1HG   LYS  41          HG2       LYS  41 -16.173  14.920 -11.865
  330   2HG   LYS  41          HG1       LYS  41 -17.518  15.984 -12.271
  331   1HD   LYS  41          HD2       LYS  41 -15.706  17.607 -13.195
  332   2HD   LYS  41          HD1       LYS  41 -14.624  16.214 -13.116
  333   1HE   LYS  41          HE2       LYS  41 -16.277  14.931 -14.469
  334   2HE   LYS  41          HE1       LYS  41 -17.236  16.402 -14.615
  335   1HZ   LYS  41          HZ1       LYS  41 -15.999  16.795 -16.414
  336   2HZ   LYS  41          HZ2       LYS  41 -14.825  15.644 -15.986
  337   3HZ   LYS  41          HZ3       LYS  41 -14.758  17.212 -15.335
  338    H    SER  42           HN       SER  42 -13.579  17.482 -10.806
  339    HA   SER  42           HA       SER  42 -12.302  16.013 -12.754
  340   1HB   SER  42          HB2       SER  42 -10.902  17.771 -10.729
  341   2HB   SER  42          HB1       SER  42 -10.312  17.368 -12.340
  342    HG   SER  42           HG       SER  42 -12.463  18.293 -13.014
  343    H    LEU  43           HN       LEU  43 -10.979  16.233  -9.445
  344    HA   LEU  43           HA       LEU  43  -9.211  14.002  -9.911
  345   1HB   LEU  43          HB2       LEU  43  -9.964  15.535  -7.420
  346   2HB   LEU  43          HB1       LEU  43  -8.764  14.242  -7.424
  347    HG   LEU  43           HG       LEU  43  -8.528  16.508  -9.404
  348   1HD1  LEU  43          HD11      LEU  43  -7.670  16.549  -6.499
  349   2HD1  LEU  43          HD12      LEU  43  -8.757  17.679  -7.305
  350   3HD1  LEU  43          HD13      LEU  43  -7.044  17.656  -7.721
  351   1HD2  LEU  43          HD21      LEU  43  -6.559  14.670  -7.996
  352   2HD2  LEU  43          HD22      LEU  43  -6.086  15.994  -9.058
  353   3HD2  LEU  43          HD23      LEU  43  -7.001  14.635  -9.703
  354    H    SER  44           HN       SER  44 -12.508  13.948  -9.420
  355    HA   SER  44           HA       SER  44 -12.499  11.560  -7.667
  356   1HB   SER  44          HB2       SER  44 -14.432  12.819  -7.230
  357   2HB   SER  44          HB1       SER  44 -14.641  13.243  -8.922
  358    HG   SER  44           HG       SER  44 -14.892  10.630  -7.854
  359    H    GLU  45           HN       GLU  45 -12.507  12.530 -10.961
  360    HA   GLU  45           HA       GLU  45 -13.429   9.967 -11.992
  361   1HB   GLU  45          HB2       GLU  45 -12.150  12.347 -13.366
  362   2HB   GLU  45          HB1       GLU  45 -12.803  10.939 -14.203
  363   1HG   GLU  45          HG2       GLU  45 -14.429  12.669 -12.322
  364   2HG   GLU  45          HG1       GLU  45 -14.397  12.893 -14.072
  365    H    GLU  46           HN       GLU  46 -10.391  11.671 -11.453
  366    HA   GLU  46           HA       GLU  46  -8.791   9.559 -12.694
  367   1HB   GLU  46          HB2       GLU  46  -7.957  11.876 -10.922
  368   2HB   GLU  46          HB1       GLU  46  -6.866  10.852 -11.855
  369   1HG   GLU  46          HG2       GLU  46  -7.988  11.563 -13.942
  370   2HG   GLU  46          HG1       GLU  46  -9.056  12.608 -13.003
  371    H    CYS  47           HN       CYS  47 -10.169  10.181  -9.595
  372    HA   CYS  47           HA       CYS  47  -8.289   8.449  -8.137
  373   1HB   CYS  47          HB2       CYS  47  -9.104  10.124  -6.729
  374   2HB   CYS  47          HB1       CYS  47 -10.703  10.089  -7.456
  375    H    GLN  48           HN       GLN  48 -11.336   8.144  -9.819
  376    HA   GLN  48           HA       GLN  48 -11.832   5.464  -8.639
  377   1HB   GLN  48          HB2       GLN  48 -13.394   7.298 -10.470
  378   2HB   GLN  48          HB1       GLN  48 -13.837   5.600 -10.289
  379   1HG   GLN  48          HG2       GLN  48 -13.454   7.410  -7.898
  380   2HG   GLN  48          HG1       GLN  48 -15.008   7.270  -8.721
  381   1HE2  GLN  48          HE21      GLN  48 -13.908   6.247  -5.970
  382   2HE2  GLN  48          HE22      GLN  48 -14.393   4.620  -5.948
  383    H    GLU  49           HN       GLU  49 -10.627   7.096 -11.460
  384    HA   GLU  49           HA       GLU  49 -10.702   4.811 -13.202
  385   1HB   GLU  49          HB2       GLU  49 -10.528   7.178 -14.001
  386   2HB   GLU  49          HB1       GLU  49  -8.902   7.248 -13.323
  387   1HG   GLU  49          HG2       GLU  49  -8.717   6.737 -15.677
  388   2HG   GLU  49          HG1       GLU  49  -8.292   5.290 -14.767
  389    H    VAL  50           HN       VAL  50  -8.230   6.337 -11.144
  390    HA   VAL  50           HA       VAL  50  -6.166   4.438 -11.743
  391    HB   VAL  50           HB       VAL  50  -5.771   6.650 -10.620
  392   1HG1  VAL  50          HG11      VAL  50  -6.711   5.250  -8.110
  393   2HG1  VAL  50          HG12      VAL  50  -7.772   6.303  -9.046
  394   3HG1  VAL  50          HG13      VAL  50  -6.303   6.954  -8.317
  395   1HG2  VAL  50          HG21      VAL  50  -3.950   5.819  -9.309
  396   2HG2  VAL  50          HG22      VAL  50  -4.210   4.594 -10.556
  397   3HG2  VAL  50          HG23      VAL  50  -4.822   4.337  -8.920
  398    H    VAL  51           HN       VAL  51  -8.667   4.581  -9.202
  399    HA   VAL  51           HA       VAL  51  -7.946   2.418  -7.579
  400    HB   VAL  51           HB       VAL  51 -10.620   3.433  -8.573
  401   1HG1  VAL  51          HG11      VAL  51 -11.656   1.936  -6.795
  402   2HG1  VAL  51          HG12      VAL  51 -10.136   1.046  -6.779
  403   3HG1  VAL  51          HG13      VAL  51 -11.104   1.109  -8.251
  404   1HG2  VAL  51          HG21      VAL  51 -10.757   4.487  -6.499
  405   2HG2  VAL  51          HG22      VAL  51  -9.011   4.499  -6.737
  406   3HG2  VAL  51          HG23      VAL  51  -9.747   3.283  -5.697
  407    H    ASP  52           HN       ASP  52  -9.818   2.230 -10.642
  408    HA   ASP  52           HA       ASP  52  -9.966  -0.592 -10.800
  409   1HB   ASP  52          HB2       ASP  52 -11.089   0.965 -12.402
  410   2HB   ASP  52          HB1       ASP  52  -9.514   1.345 -13.099
  411    H    THR  53           HN       THR  53  -7.361   1.669 -11.487
  412    HA   THR  53           HA       THR  53  -5.569  -0.437 -12.433
  413    HB   THR  53           HB       THR  53  -5.051   2.465 -11.951
  414    HG1  THR  53           HG1      THR  53  -6.450   1.400 -13.761
  415   1HG2  THR  53          HG21      THR  53  -2.981   2.106 -13.201
  416   2HG2  THR  53          HG22      THR  53  -3.375   0.398 -13.386
  417   3HG2  THR  53          HG23      THR  53  -3.001   1.048 -11.793
  418    H    TYR  54           HN       TYR  54  -6.372   1.092  -9.474
  419    HA   TYR  54           HA       TYR  54  -4.197  -0.450  -8.101
  420   1HB   TYR  54          HB2       TYR  54  -5.150   2.364  -7.539
  421   2HB   TYR  54          HB1       TYR  54  -4.225   1.415  -6.380
  422    HD1  TYR  54           HD1      TYR  54  -1.885   1.580  -6.436
  423    HD2  TYR  54           HD2      TYR  54  -4.149   2.399  -9.953
  424    HE1  TYR  54           HE1      TYR  54   0.191   2.278  -7.604
  425    HE2  TYR  54           HE2      TYR  54  -2.114   3.115 -11.144
  426    HH   TYR  54           HH       TYR  54   0.822   2.339 -10.345
  427    H    GLY  55           HN       GLY  55  -6.194  -1.950  -8.085
  428   1HA   GLY  55          HA2       GLY  55  -7.751  -1.423  -5.590
  429   2HA   GLY  55          HA1       GLY  55  -8.594  -1.915  -7.059
  430    H    SER  56           HN       SER  56  -7.300  -3.933  -8.109
  431    HA   SER  56           HA       SER  56  -7.427  -6.018  -6.015
  432   1HB   SER  56          HB2       SER  56  -7.767  -7.519  -7.756
  433   2HB   SER  56          HB1       SER  56  -8.356  -6.043  -8.515
  434    HG   SER  56           HG       SER  56  -6.182  -5.781  -9.330
  435    H    SER  57           HN       SER  57  -5.031  -4.260  -7.801
  436    HA   SER  57           HA       SER  57  -2.904  -6.243  -7.248
  437   1HB   SER  57          HB2       SER  57  -2.725  -3.476  -8.484
  438   2HB   SER  57          HB1       SER  57  -1.404  -4.640  -8.373
  439    HG   SER  57           HG       SER  57  -2.979  -6.081  -9.524
  440    H    ILE  58           HN       ILE  58  -3.255  -2.743  -6.648
  441    HA   ILE  58           HA       ILE  58  -1.379  -2.181  -4.781
  442    HB   ILE  58           HB       ILE  58  -3.196  -0.672  -5.471
  443   1HG1  ILE  58          HG12      ILE  58  -2.749  -0.993  -2.490
  444   2HG1  ILE  58          HG11      ILE  58  -1.874   0.076  -3.595
  445   1HG2  ILE  58          HG21      ILE  58  -4.931  -1.814  -3.339
  446   2HG2  ILE  58          HG22      ILE  58  -4.965  -2.523  -4.964
  447   3HG2  ILE  58          HG23      ILE  58  -5.384  -0.829  -4.716
  448   1HD1  ILE  58          HD11      ILE  58  -4.738   0.303  -2.647
  449   2HD1  ILE  58          HD12      ILE  58  -4.158   1.176  -4.068
  450   3HD1  ILE  58          HD13      ILE  58  -3.441   1.491  -2.486
  451    H    LEU  59           HN       LEU  59  -4.373  -3.929  -4.032
  452    HA   LEU  59           HA       LEU  59  -3.507  -4.374  -1.268
  453   1HB   LEU  59          HB2       LEU  59  -5.727  -6.015  -2.481
  454   2HB   LEU  59          HB1       LEU  59  -5.567  -5.398  -0.841
  455    HG   LEU  59           HG       LEU  59  -5.988  -3.617  -3.215
  456   1HD1  LEU  59          HD11      LEU  59  -8.047  -4.814  -1.372
  457   2HD1  LEU  59          HD12      LEU  59  -7.866  -5.149  -3.095
  458   3HD1  LEU  59          HD13      LEU  59  -8.368  -3.548  -2.557
  459   1HD2  LEU  59          HD21      LEU  59  -6.666  -3.106  -0.323
  460   2HD2  LEU  59          HD22      LEU  59  -6.521  -1.927  -1.624
  461   3HD2  LEU  59          HD23      LEU  59  -5.082  -2.713  -0.986
  462    H    SER  60           HN       SER  60  -3.472  -6.238  -4.284
  463    HA   SER  60           HA       SER  60  -2.464  -8.637  -2.805
  464   1HB   SER  60          HB2       SER  60  -3.139  -8.317  -5.740
  465   2HB   SER  60          HB1       SER  60  -2.805  -9.828  -4.900
  466    HG   SER  60           HG       SER  60  -5.105  -8.457  -5.091
  467    H    ILE  61           HN       ILE  61  -1.099  -5.927  -4.064
  468    HA   ILE  61           HA       ILE  61   1.145  -7.245  -5.440
  469    HB   ILE  61           HB       ILE  61  -0.066  -5.080  -6.122
  470   1HG1  ILE  61          HG12      ILE  61   1.938  -5.895  -7.241
  471   2HG1  ILE  61          HG11      ILE  61   1.960  -4.143  -7.125
  472   1HG2  ILE  61          HG21      ILE  61   0.124  -3.993  -3.924
  473   2HG2  ILE  61          HG22      ILE  61   0.733  -3.018  -5.255
  474   3HG2  ILE  61          HG23      ILE  61   1.864  -3.833  -4.187
  475   1HD1  ILE  61          HD11      ILE  61   3.359  -4.447  -5.001
  476   2HD1  ILE  61          HD12      ILE  61   4.143  -4.848  -6.528
  477   3HD1  ILE  61          HD13      ILE  61   3.532  -6.129  -5.493
  478    H    LEU  62           HN       LEU  62   1.146  -4.799  -2.745
  479    HA   LEU  62           HA       LEU  62   3.769  -5.321  -1.919
  480   1HB   LEU  62          HB2       LEU  62   1.342  -4.476  -0.344
  481   2HB   LEU  62          HB1       LEU  62   2.901  -4.704   0.439
  482    HG   LEU  62           HG       LEU  62   3.765  -3.154  -1.555
  483   1HD1  LEU  62          HD11      LEU  62   1.342  -1.558  -1.353
  484   2HD1  LEU  62          HD12      LEU  62   1.033  -3.107  -2.116
  485   3HD1  LEU  62          HD13      LEU  62   2.267  -2.047  -2.770
  486   1HD2  LEU  62          HD21      LEU  62   2.254  -2.048   0.825
  487   2HD2  LEU  62          HD22      LEU  62   3.517  -1.214  -0.080
  488   3HD2  LEU  62          HD23      LEU  62   3.909  -2.652   0.861
  489    H    LEU  63           HN       LEU  63   1.057  -7.398  -1.652
  490    HA   LEU  63           HA       LEU  63   2.101  -8.948   0.569
  491   1HB   LEU  63          HB2       LEU  63  -0.216  -9.315  -1.326
  492   2HB   LEU  63          HB1       LEU  63   0.136 -10.408   0.013
  493    HG   LEU  63           HG       LEU  63   0.068  -8.435   1.549
  494   1HD1  LEU  63          HD11      LEU  63  -0.527  -7.024  -1.006
  495   2HD1  LEU  63          HD12      LEU  63   0.398  -6.488   0.394
  496   3HD1  LEU  63          HD13      LEU  63  -1.358  -6.477   0.451
  497   1HD2  LEU  63          HD21      LEU  63  -1.878  -9.970   1.182
  498   2HD2  LEU  63          HD22      LEU  63  -2.478  -8.846  -0.037
  499   3HD2  LEU  63          HD23      LEU  63  -2.362  -8.339   1.648
  500    H    GLU  64           HN       GLU  64   1.562  -9.733  -2.931
  501    HA   GLU  64           HA       GLU  64   3.534 -11.976  -2.550
  502   1HB   GLU  64          HB2       GLU  64   1.127 -11.782  -4.365
  503   2HB   GLU  64          HB1       GLU  64   2.285 -13.114  -4.383
  504   1HG   GLU  64          HG2       GLU  64   1.769 -13.611  -2.026
  505   2HG   GLU  64          HG1       GLU  64   0.625 -12.268  -1.988
  506    H    GLU  65           HN       GLU  65   2.215 -10.020  -5.274
  507    HA   GLU  65           HA       GLU  65   4.301 -10.594  -7.055
  508   1HB   GLU  65          HB2       GLU  65   2.953  -7.904  -6.753
  509   2HB   GLU  65          HB1       GLU  65   3.731  -8.523  -8.207
  510   1HG   GLU  65          HG2       GLU  65   2.088 -10.386  -8.255
  511   2HG   GLU  65          HG1       GLU  65   1.292  -9.692  -6.842
  512    H    VAL  66           HN       VAL  66   4.420  -9.061  -4.135
  513    HA   VAL  66           HA       VAL  66   7.244  -8.255  -4.514
  514    HB   VAL  66           HB       VAL  66   4.894  -6.585  -3.700
  515   1HG1  VAL  66          HG11      VAL  66   6.187  -6.273  -1.769
  516   2HG1  VAL  66          HG12      VAL  66   6.623  -4.913  -2.806
  517   3HG1  VAL  66          HG13      VAL  66   7.694  -6.303  -2.673
  518   1HG2  VAL  66          HG21      VAL  66   7.368  -6.042  -5.337
  519   2HG2  VAL  66          HG22      VAL  66   6.005  -4.942  -5.134
  520   3HG2  VAL  66          HG23      VAL  66   5.784  -6.483  -5.971
  521    H    SER  67           HN       SER  67   8.373  -8.122  -2.445
  522    HA   SER  67           HA       SER  67   7.140  -9.839  -0.335
  523   1HB   SER  67          HB2       SER  67   9.945  -9.317  -1.257
  524   2HB   SER  67          HB1       SER  67   9.705  -9.732   0.437
  525    HG   SER  67           HG       SER  67   8.253 -11.446  -0.703
  526    HA   PRO  68           HA       PRO  68   6.688  -6.347   2.329
  527   1HB   PRO  68          HB2       PRO  68   7.897  -7.466   4.690
  528   2HB   PRO  68          HB1       PRO  68   6.173  -7.381   4.295
  529   1HG   PRO  68          HG2       PRO  68   7.953  -9.716   4.196
  530   2HG   PRO  68          HG1       PRO  68   6.188  -9.665   4.069
  531   1HD   PRO  68          HD2       PRO  68   7.993 -10.181   1.944
  532   2HD   PRO  68          HD1       PRO  68   6.266  -9.805   1.783
  533    H    GLU  69           HN       GLU  69   9.868  -7.965   2.607
  534    HA   GLU  69           HA       GLU  69  11.301  -5.727   3.624
  535   1HB   GLU  69          HB2       GLU  69  12.126  -8.120   3.489
  536   2HB   GLU  69          HB1       GLU  69  12.437  -7.840   1.777
  537   1HG   GLU  69          HG2       GLU  69  13.928  -5.961   2.347
  538   2HG   GLU  69          HG1       GLU  69  13.619  -6.235   4.062
  539    H    LEU  70           HN       LEU  70  10.819  -6.763   0.225
  540    HA   LEU  70           HA       LEU  70  12.399  -4.798  -1.011
  541   1HB   LEU  70          HB2       LEU  70  11.463  -6.499  -2.386
  542   2HB   LEU  70          HB1       LEU  70   9.830  -6.149  -1.839
  543    HG   LEU  70           HG       LEU  70   9.846  -4.012  -3.017
  544   1HD1  LEU  70          HD11      LEU  70  11.853  -3.553  -4.540
  545   2HD1  LEU  70          HD12      LEU  70  12.717  -4.778  -3.613
  546   3HD1  LEU  70          HD13      LEU  70  12.137  -3.319  -2.819
  547   1HD2  LEU  70          HD21      LEU  70   9.414  -6.274  -4.225
  548   2HD2  LEU  70          HD22      LEU  70  10.989  -6.015  -4.969
  549   3HD2  LEU  70          HD23      LEU  70   9.691  -4.847  -5.219
  550    H    VAL  71           HN       VAL  71   8.971  -4.564   0.014
  551    HA   VAL  71           HA       VAL  71   8.335  -2.009  -0.870
  552    HB   VAL  71           HB       VAL  71   7.712  -2.836   1.968
  553   1HG1  VAL  71          HG11      VAL  71   6.956  -0.613   0.794
  554   2HG1  VAL  71          HG12      VAL  71   5.772  -1.548   1.697
  555   3HG1  VAL  71          HG13      VAL  71   5.822  -1.652  -0.064
  556   1HG2  VAL  71          HG21      VAL  71   7.354  -4.835   0.742
  557   2HG2  VAL  71          HG22      VAL  71   6.678  -3.976  -0.636
  558   3HG2  VAL  71          HG23      VAL  71   5.766  -4.088   0.872
  559    H    CYS  72           HN       CYS  72  10.049  -2.770   2.194
  560    HA   CYS  72           HA       CYS  72  10.544  -0.132   3.055
  561   1HB   CYS  72          HB2       CYS  72  12.388  -2.523   3.168
  562   2HB   CYS  72          HB1       CYS  72  12.636  -1.023   4.058
  563    H    SER  73           HN       SER  73  12.072  -1.983   0.475
  564    HA   SER  73           HA       SER  73  14.135   0.009  -0.027
  565   1HB   SER  73          HB2       SER  73  13.504  -2.620  -0.975
  566   2HB   SER  73          HB1       SER  73  13.624  -1.569  -2.382
  567    HG   SER  73           HG       SER  73  15.631  -0.806  -1.363
  568    H    MET  74           HN       MET  74  11.125  -0.923  -1.778
  569    HA   MET  74           HA       MET  74  11.107   1.142  -3.688
  570   1HB   MET  74          HB2       MET  74   8.802  -0.099  -2.152
  571   2HB   MET  74          HB1       MET  74   8.571   1.016  -3.496
  572   1HG   MET  74          HG2       MET  74  10.090  -0.593  -4.837
  573   2HG   MET  74          HG1       MET  74   9.781  -1.743  -3.539
  574   1HE   MET  74          HE1       MET  74   7.723  -2.853  -2.990
  575   2HE   MET  74          HE2       MET  74   6.112  -2.551  -3.643
  576   3HE   MET  74          HE3       MET  74   6.868  -1.357  -2.583
  577    H    LEU  75           HN       LEU  75   9.936   1.200  -0.337
  578    HA   LEU  75           HA       LEU  75   9.007   3.903  -0.366
  579   1HB   LEU  75          HB2       LEU  75  10.085   2.283   1.961
  580   2HB   LEU  75          HB1       LEU  75   9.110   3.745   2.097
  581    HG   LEU  75           HG       LEU  75   8.073   1.401   0.503
  582   1HD1  LEU  75          HD11      LEU  75   8.303   1.594   3.490
  583   2HD1  LEU  75          HD12      LEU  75   8.396   0.182   2.445
  584   3HD1  LEU  75          HD13      LEU  75   6.833   0.897   2.808
  585   1HD2  LEU  75          HD21      LEU  75   6.836   3.494   0.354
  586   2HD2  LEU  75          HD22      LEU  75   6.782   3.629   2.112
  587   3HD2  LEU  75          HD23      LEU  75   5.893   2.342   1.297
  588    H    HIS  76           HN       HIS  76  12.205   2.528  -0.070
  589    HA   HIS  76           HA       HIS  76  14.289   3.575  -0.020
  590   1HB   HIS  76          HB2       HIS  76  12.626   5.234  -1.533
  591   2HB   HIS  76          HB1       HIS  76  13.296   6.349  -0.351
  592    HD1  HIS  76           HD1      HIS  76  15.846   6.820  -0.471
  593    HD2  HIS  76           HD2      HIS  76  14.510   4.098  -3.330
  594    HE1  HIS  76           HE1      HIS  76  17.747   6.527  -2.120
  595    H    LEU  77           HN       LEU  77  13.019   3.082   2.415
  596    HA   LEU  77           HA       LEU  77  13.135   5.480   4.068
  597   1HB   LEU  77          HB2       LEU  77  11.796   3.074   4.326
  598   2HB   LEU  77          HB1       LEU  77  13.154   2.814   5.417
  599    HG   LEU  77           HG       LEU  77  12.547   5.203   6.301
  600   1HD1  LEU  77          HD11      LEU  77  10.313   5.933   6.002
  601   2HD1  LEU  77          HD12      LEU  77   9.807   4.379   5.338
  602   3HD1  LEU  77          HD13      LEU  77  10.831   5.453   4.386
  603   1HD2  LEU  77          HD21      LEU  77  10.739   2.834   6.869
  604   2HD2  LEU  77          HD22      LEU  77  11.005   4.208   7.941
  605   3HD2  LEU  77          HD23      LEU  77  12.326   3.093   7.593
  606    H    CYS  78           HN       CYS  78  15.280   2.877   3.161
  607    HA   CYS  78           HA       CYS  78  17.206   3.435   5.302
  608   1HB   CYS  78          HB2       CYS  78  17.479   1.797   2.759
  609   2HB   CYS  78          HB1       CYS  78  18.680   1.874   4.046
  610    H    SER  79           HN       SER  79  16.433   5.710   3.668
  611    HA   SER  79           HA       SER  79  18.366   6.330   1.669
  612   1HB   SER  79          HB2       SER  79  17.728   8.692   2.089
  613   2HB   SER  79          HB1       SER  79  16.316   7.648   1.960
  614    HG   SER  79           HG       SER  79  16.174   7.632   4.198
  615    H    GLY  80           HN       GLY  80  20.520   6.145   2.111
  616   1HA   GLY  80          HA2       GLY  80  21.601   6.865   4.750
  617   2HA   GLY  80          HA1       GLY  80  22.529   6.262   3.374
  618    H    LEU  81           HN       LEU  81  21.257   8.241   1.595
  619    HA   LEU  81           HA       LEU  81  22.588  10.748   2.495
  620   1HB   LEU  81          HB2       LEU  81  22.993  11.066  -0.054
  621   2HB   LEU  81          HB1       LEU  81  24.068   9.988   0.823
  622    HG   LEU  81           HG       LEU  81  23.251   9.080  -1.379
  623   1HD1  LEU  81          HD11      LEU  81  23.674   7.714   0.986
  624   2HD1  LEU  81          HD12      LEU  81  23.465   6.972  -0.595
  625   3HD1  LEU  81          HD13      LEU  81  22.091   7.113   0.494
  626   1HD2  LEU  81          HD21      LEU  81  20.902  10.070  -1.072
  627   2HD2  LEU  81          HD22      LEU  81  20.574   8.698  -0.013
  628   3HD2  LEU  81          HD23      LEU  81  20.983   8.427  -1.701
  629    H    VAL  82           HN       VAL  82  21.763  12.464   0.625
  630    HA   VAL  82           HA       VAL  82  18.881  12.480   1.070
  631    HB   VAL  82           HB       VAL  82  19.056  14.625  -0.407
  632   1HG1  VAL  82          HG11      VAL  82  19.791  15.923   1.546
  633   2HG1  VAL  82          HG12      VAL  82  20.467  14.465   2.273
  634   3HG1  VAL  82          HG13      VAL  82  18.723  14.607   2.039
  635   1HG2  VAL  82          HG21      VAL  82  21.344  13.974  -1.256
  636   2HG2  VAL  82          HG22      VAL  82  21.966  14.243   0.372
  637   3HG2  VAL  82          HG23      VAL  82  21.281  15.585  -0.544
  638    HA   PRO  83           HA       PRO  83  18.039  10.117  -2.591
  639   1HB   PRO  83          HB2       PRO  83  15.626  11.786  -3.013
  640   2HB   PRO  83          HB1       PRO  83  15.756  10.036  -2.768
  641   1HG   PRO  83          HG2       PRO  83  14.888  11.871  -0.829
  642   2HG   PRO  83          HG1       PRO  83  15.446  10.223  -0.511
  643   1HD   PRO  83          HD2       PRO  83  16.798  12.749   0.131
  644   2HD   PRO  83          HD1       PRO  83  17.212  11.089   0.632
  645    H    ARG  84           HN       ARG  84  18.509  10.449  -4.819
  646    HA   ARG  84           HA       ARG  84  19.422  13.145  -5.563
  647   1HB   ARG  84          HB2       ARG  84  19.457  10.456  -6.964
  648   2HB   ARG  84          HB1       ARG  84  19.941  11.938  -7.783
  649   1HG   ARG  84          HG2       ARG  84  21.993  11.166  -6.974
  650   2HG   ARG  84          HG1       ARG  84  21.514  12.264  -5.686
  651   1HD   ARG  84          HD2       ARG  84  22.306  10.117  -4.772
  652   2HD   ARG  84          HD1       ARG  84  20.600  10.362  -4.405
  653    HE   ARG  84           HE       ARG  84  20.554   8.932  -6.771
  654   1HH1  ARG  84          HH21      ARG  84  22.049   8.599  -3.683
  655   2HH1  ARG  84          HH22      ARG  84  22.037   6.867  -3.715
  656   1HH2  ARG  84          HH11      ARG  84  20.530   6.671  -6.832
  657   2HH2  ARG  84          HH12      ARG  84  21.177   5.776  -5.498
  Start of MODEL    2
    1   1H    SER   1           HT1      SER   1  24.565   3.288   5.534
    2   2H    SER   1           HT2      SER   1  24.211   1.745   6.150
    3   3H    SER   1           HT3      SER   1  24.793   2.962   7.183
    4    HA   SER   1           HA       SER   1  22.734   3.580   7.640
    5   1HB   SER   1          HB2       SER   1  22.434   3.907   4.640
    6   2HB   SER   1          HB1       SER   1  21.388   4.621   5.863
    7    HG   SER   1           HG       SER   1  23.238   5.906   4.957
    8    H    ASP   2           HN       ASP   2  21.450   1.977   8.424
    9    HA   ASP   2           HA       ASP   2  19.613   0.574   6.700
   10   1HB   ASP   2          HB2       ASP   2  21.663  -0.734   6.209
   11   2HB   ASP   2          HB1       ASP   2  21.842  -1.076   7.930
   12    H    VAL   3           HN       VAL   3  19.295   2.161   8.985
   13    HA   VAL   3           HA       VAL   3  18.898   0.385  11.290
   14    HB   VAL   3           HB       VAL   3  18.122   3.266  10.952
   15   1HG1  VAL   3          HG11      VAL   3  16.968   2.130  12.794
   16   2HG1  VAL   3          HG12      VAL   3  18.167   3.257  13.432
   17   3HG1  VAL   3          HG13      VAL   3  18.512   1.527  13.399
   18   1HG2  VAL   3          HG21      VAL   3  20.635   2.024  12.097
   19   2HG2  VAL   3          HG22      VAL   3  20.230   3.739  12.180
   20   3HG2  VAL   3          HG23      VAL   3  20.534   2.979  10.618
   21    H    TYR   4           HN       TYR   4  16.734   2.623   9.517
   22    HA   TYR   4           HA       TYR   4  14.328   1.535  10.551
   23   1HB   TYR   4          HB2       TYR   4  14.392   2.594   7.737
   24   2HB   TYR   4          HB1       TYR   4  13.220   2.895   9.019
   25    HD1  TYR   4           HD1      TYR   4  14.995   4.807   7.140
   26    HD2  TYR   4           HD2      TYR   4  15.158   3.587  11.257
   27    HE1  TYR   4           HE1      TYR   4  16.175   6.908   7.716
   28    HE2  TYR   4           HE2      TYR   4  16.341   5.686  11.830
   29    HH   TYR   4           HH       TYR   4  16.440   8.097  10.739
   30    H    CYS   5           HN       CYS   5  16.214   0.612   7.683
   31    HA   CYS   5           HA       CYS   5  14.475  -1.141   6.411
   32   1HB   CYS   5          HB2       CYS   5  17.333  -1.959   6.930
   33   2HB   CYS   5          HB1       CYS   5  16.364  -2.195   5.474
   34    H    GLU   6           HN       GLU   6  16.144  -1.616   9.472
   35    HA   GLU   6           HA       GLU   6  15.303  -4.432   9.662
   36   1HB   GLU   6          HB2       GLU   6  16.617  -2.605  11.696
   37   2HB   GLU   6          HB1       GLU   6  16.384  -4.344  11.882
   38   1HG   GLU   6          HG2       GLU   6  17.764  -4.747   9.876
   39   2HG   GLU   6          HG1       GLU   6  18.002  -3.009   9.692
   40    H    VAL   7           HN       VAL   7  14.320  -1.286  10.947
   41    HA   VAL   7           HA       VAL   7  12.397  -2.445  12.811
   42    HB   VAL   7           HB       VAL   7  12.399   0.399  11.787
   43   1HG1  VAL   7          HG11      VAL   7  11.537   0.843  14.067
   44   2HG1  VAL   7          HG12      VAL   7  11.623  -0.882  14.426
   45   3HG1  VAL   7          HG13      VAL   7  10.505  -0.292  13.196
   46   1HG2  VAL   7          HG21      VAL   7  14.209  -0.942  13.808
   47   2HG2  VAL   7          HG22      VAL   7  13.903   0.794  13.834
   48   3HG2  VAL   7          HG23      VAL   7  14.671   0.055  12.430
   49    H    CYS   8           HN       CYS   8  12.165  -0.787   9.652
   50    HA   CYS   8           HA       CYS   8   9.316  -0.983   9.481
   51   1HB   CYS   8          HB2       CYS   8   9.535  -0.242   7.251
   52   2HB   CYS   8          HB1       CYS   8  10.912   0.477   8.080
   53    H    GLU   9           HN       GLU   9  11.876  -3.051   8.060
   54    HA   GLU   9           HA       GLU   9  10.140  -4.900   6.787
   55   1HB   GLU   9          HB2       GLU   9  11.890  -6.541   6.797
   56   2HB   GLU   9          HB1       GLU   9  12.689  -4.989   6.598
   57   1HG   GLU   9          HG2       GLU   9  13.010  -5.000   9.152
   58   2HG   GLU   9          HG1       GLU   9  12.490  -6.683   9.104
   59    H    PHE  10           HN       PHE  10  11.271  -4.878  10.161
   60    HA   PHE  10           HA       PHE  10  10.070  -7.307  10.984
   61   1HB   PHE  10          HB2       PHE  10  11.619  -6.009  12.402
   62   2HB   PHE  10          HB1       PHE  10  10.401  -4.746  12.577
   63    HD1  PHE  10           HD1      PHE  10   8.517  -5.011  14.049
   64    HD2  PHE  10           HD2      PHE  10  11.224  -8.276  13.363
   65    HE1  PHE  10           HE1      PHE  10   7.494  -6.255  15.934
   66    HE2  PHE  10           HE2      PHE  10  10.200  -9.519  15.248
   67    HZ   PHE  10           HZ       PHE  10   8.335  -8.510  16.534
   68    H    LEU  11           HN       LEU  11   8.687  -4.026  10.802
   69    HA   LEU  11           HA       LEU  11   6.095  -4.940  11.806
   70   1HB   LEU  11          HB2       LEU  11   6.906  -2.337  10.476
   71   2HB   LEU  11          HB1       LEU  11   5.358  -2.634  11.263
   72    HG   LEU  11           HG       LEU  11   7.973  -3.018  12.732
   73   1HD1  LEU  11          HD11      LEU  11   7.462  -0.694  13.686
   74   2HD1  LEU  11          HD12      LEU  11   6.389  -0.481  12.303
   75   3HD1  LEU  11          HD13      LEU  11   8.114  -0.744  12.048
   76   1HD2  LEU  11          HD21      LEU  11   6.404  -2.421  14.675
   77   2HD2  LEU  11          HD22      LEU  11   6.122  -3.978  13.906
   78   3HD2  LEU  11          HD23      LEU  11   5.075  -2.610  13.534
   79    H    VAL  12           HN       VAL  12   7.263  -3.717   8.651
   80    HA   VAL  12           HA       VAL  12   4.885  -4.156   7.208
   81    HB   VAL  12           HB       VAL  12   7.717  -4.481   6.179
   82   1HG1  VAL  12          HG11      VAL  12   5.067  -3.905   4.826
   83   2HG1  VAL  12          HG12      VAL  12   6.097  -5.313   4.586
   84   3HG1  VAL  12          HG13      VAL  12   6.632  -3.728   4.033
   85   1HG2  VAL  12          HG21      VAL  12   5.999  -1.992   6.073
   86   2HG2  VAL  12          HG22      VAL  12   7.732  -2.134   5.777
   87   3HG2  VAL  12          HG23      VAL  12   7.101  -2.295   7.414
   88    H    LYS  13           HN       LYS  13   7.240  -6.459   8.379
   89    HA   LYS  13           HA       LYS  13   6.283  -8.631   6.643
   90   1HB   LYS  13          HB2       LYS  13   8.627  -8.490   7.376
   91   2HB   LYS  13          HB1       LYS  13   8.103  -8.690   9.045
   92   1HG   LYS  13          HG2       LYS  13   6.889 -10.834   7.596
   93   2HG   LYS  13          HG1       LYS  13   8.543 -10.741   7.005
   94   1HD   LYS  13          HD2       LYS  13   8.693 -12.194   8.851
   95   2HD   LYS  13          HD1       LYS  13   9.221 -10.645   9.507
   96   1HE   LYS  13          HE2       LYS  13   6.894 -10.241  10.317
   97   2HE   LYS  13          HE1       LYS  13   6.447 -11.847   9.749
   98   1HZ   LYS  13          HZ1       LYS  13   7.598 -12.857  11.395
   99   2HZ   LYS  13          HZ2       LYS  13   7.276 -11.398  12.206
  100   3HZ   LYS  13          HZ3       LYS  13   8.789 -11.653  11.475
  101    H    GLU  14           HN       GLU  14   5.943  -7.622  10.047
  102    HA   GLU  14           HA       GLU  14   4.377  -9.922  10.845
  103   1HB   GLU  14          HB2       GLU  14   4.707  -7.140  11.997
  104   2HB   GLU  14          HB1       GLU  14   3.654  -8.345  12.737
  105   1HG   GLU  14          HG2       GLU  14   6.585  -8.830  12.143
  106   2HG   GLU  14          HG1       GLU  14   5.987  -8.266  13.702
  107    H    VAL  15           HN       VAL  15   3.479  -6.573  10.035
  108    HA   VAL  15           HA       VAL  15   0.679  -6.864  10.139
  109    HB   VAL  15           HB       VAL  15   2.080  -4.741   9.735
  110   1HG1  VAL  15          HG11      VAL  15   1.721  -5.540   6.837
  111   2HG1  VAL  15          HG12      VAL  15   3.234  -5.736   7.719
  112   3HG1  VAL  15          HG13      VAL  15   2.562  -4.126   7.470
  113   1HG2  VAL  15          HG21      VAL  15  -0.545  -5.443   8.446
  114   2HG2  VAL  15          HG22      VAL  15   0.159  -3.858   8.121
  115   3HG2  VAL  15          HG23      VAL  15  -0.214  -4.336   9.775
  116    H    THR  16           HN       THR  16   2.960  -7.714   7.572
  117    HA   THR  16           HA       THR  16   1.043  -8.415   5.595
  118    HB   THR  16           HB       THR  16   3.191 -10.235   5.313
  119    HG1  THR  16           HG1      THR  16   4.499  -7.945   5.850
  120   1HG2  THR  16          HG21      THR  16   4.066  -8.417   3.754
  121   2HG2  THR  16          HG22      THR  16   2.703  -7.428   4.298
  122   3HG2  THR  16          HG23      THR  16   2.405  -8.958   3.459
  123    H    LYS  17           HN       LYS  17   2.555 -10.403   8.155
  124    HA   LYS  17           HA       LYS  17   1.405 -12.876   7.584
  125   1HB   LYS  17          HB2       LYS  17   2.107 -11.508  10.174
  126   2HB   LYS  17          HB1       LYS  17   1.286 -13.065  10.223
  127   1HG   LYS  17          HG2       LYS  17   3.065 -14.024   8.776
  128   2HG   LYS  17          HG1       LYS  17   3.901 -12.470   8.805
  129   1HD   LYS  17          HD2       LYS  17   4.318 -12.622  11.146
  130   2HD   LYS  17          HD1       LYS  17   3.173 -13.951  11.338
  131   1HE   LYS  17          HE2       LYS  17   4.612 -15.424  10.015
  132   2HE   LYS  17          HE1       LYS  17   5.737 -14.097   9.724
  133   1HZ   LYS  17          HZ1       LYS  17   6.234 -13.980  12.038
  134   2HZ   LYS  17          HZ2       LYS  17   6.402 -15.601  11.556
  135   3HZ   LYS  17          HZ3       LYS  17   5.026 -15.107  12.422
  136    H    LEU  18           HN       LEU  18  -0.158 -10.055   9.070
  137    HA   LEU  18           HA       LEU  18  -2.686 -11.582   9.356
  138   1HB   LEU  18          HB2       LEU  18  -3.152 -10.105  11.026
  139   2HB   LEU  18          HB1       LEU  18  -1.494  -9.553  10.848
  140    HG   LEU  18           HG       LEU  18  -2.361  -7.915   9.091
  141   1HD1  LEU  18          HD11      LEU  18  -4.541  -7.946   8.490
  142   2HD1  LEU  18          HD12      LEU  18  -5.069  -7.818  10.165
  143   3HD1  LEU  18          HD13      LEU  18  -4.761  -9.404   9.456
  144   1HD2  LEU  18          HD21      LEU  18  -1.764  -7.291  11.405
  145   2HD2  LEU  18          HD22      LEU  18  -3.408  -7.667  11.926
  146   3HD2  LEU  18          HD23      LEU  18  -3.120  -6.331  10.810
  147    H    ILE  19           HN       ILE  19  -1.333  -8.934   7.451
  148    HA   ILE  19           HA       ILE  19  -3.796  -8.415   5.999
  149    HB   ILE  19           HB       ILE  19  -0.940  -7.595   5.923
  150   1HG1  ILE  19          HG12      ILE  19  -3.402  -5.913   5.542
  151   2HG1  ILE  19          HG11      ILE  19  -2.777  -6.345   7.135
  152   1HG2  ILE  19          HG21      ILE  19  -1.126  -8.047   3.611
  153   2HG2  ILE  19          HG22      ILE  19  -1.346  -6.311   3.787
  154   3HG2  ILE  19          HG23      ILE  19  -2.747  -7.354   3.540
  155   1HD1  ILE  19          HD11      ILE  19  -1.700  -4.306   6.777
  156   2HD1  ILE  19          HD12      ILE  19  -1.575  -4.564   5.040
  157   3HD1  ILE  19          HD13      ILE  19  -0.487  -5.420   6.132
  158    H    ASP  20           HN       ASP  20  -1.417 -10.845   5.921
  159    HA   ASP  20           HA       ASP  20  -0.872 -11.565   3.358
  160   1HB   ASP  20          HB2       ASP  20  -0.321 -12.929   5.371
  161   2HB   ASP  20          HB1       ASP  20  -1.987 -13.512   5.404
  162    H    ASN  21           HN       ASN  21  -4.075 -11.930   4.886
  163    HA   ASN  21           HA       ASN  21  -5.310 -11.991   2.231
  164   1HB   ASN  21          HB2       ASN  21  -5.541 -14.360   4.102
  165   2HB   ASN  21          HB1       ASN  21  -6.553 -14.106   2.678
  166   1HD2  ASN  21          HD21      ASN  21  -3.176 -14.684   3.703
  167   2HD2  ASN  21          HD22      ASN  21  -2.646 -15.253   2.194
  168    H    ASN  22           HN       ASN  22  -5.439 -10.189   4.441
  169    HA   ASN  22           HA       ASN  22  -8.269 -10.569   5.375
  170   1HB   ASN  22          HB2       ASN  22  -6.010  -8.957   6.604
  171   2HB   ASN  22          HB1       ASN  22  -7.660  -9.041   7.227
  172   1HD2  ASN  22          HD21      ASN  22  -5.665 -11.713   5.866
  173   2HD2  ASN  22          HD22      ASN  22  -5.692 -12.651   7.282
  174    H    LYS  23           HN       LYS  23  -5.902  -8.304   4.042
  175    HA   LYS  23           HA       LYS  23  -7.828  -6.161   3.784
  176   1HB   LYS  23          HB2       LYS  23  -4.969  -6.642   3.077
  177   2HB   LYS  23          HB1       LYS  23  -5.808  -5.488   2.041
  178   1HG   LYS  23          HG2       LYS  23  -5.897  -5.330   5.057
  179   2HG   LYS  23          HG1       LYS  23  -4.659  -4.513   4.101
  180   1HD   LYS  23          HD2       LYS  23  -6.108  -2.882   3.401
  181   2HD   LYS  23          HD1       LYS  23  -7.392  -4.038   3.067
  182   1HE   LYS  23          HE2       LYS  23  -8.132  -4.034   5.321
  183   2HE   LYS  23          HE1       LYS  23  -6.662  -3.240   5.886
  184   1HZ   LYS  23          HZ1       LYS  23  -8.778  -2.058   4.171
  185   2HZ   LYS  23          HZ2       LYS  23  -7.306  -1.293   4.536
  186   3HZ   LYS  23          HZ3       LYS  23  -8.418  -1.637   5.774
  187    H    THR  24           HN       THR  24  -9.385  -7.822   2.749
  188    HA   THR  24           HA       THR  24  -8.914  -8.667   0.041
  189    HB   THR  24           HB       THR  24 -11.390  -9.020  -0.006
  190    HG1  THR  24           HG1      THR  24 -11.312  -8.078   2.658
  191   1HG2  THR  24          HG21      THR  24  -9.815 -10.689   0.969
  192   2HG2  THR  24          HG22      THR  24 -11.405 -10.729   1.732
  193   3HG2  THR  24          HG23      THR  24 -10.053  -9.946   2.551
  194    H    GLU  25           HN       GLU  25 -10.945  -7.773  -1.515
  195    HA   GLU  25           HA       GLU  25 -10.315  -4.856  -1.797
  196   1HB   GLU  25          HB2       GLU  25 -11.388  -5.347  -4.146
  197   2HB   GLU  25          HB1       GLU  25  -9.747  -5.891  -3.817
  198   1HG   GLU  25          HG2       GLU  25 -12.117  -7.677  -3.274
  199   2HG   GLU  25          HG1       GLU  25 -11.380  -7.596  -4.872
  200    H    LYS  26           HN       LYS  26 -12.532  -6.380  -0.180
  201    HA   LYS  26           HA       LYS  26 -14.954  -5.182  -1.382
  202   1HB   LYS  26          HB2       LYS  26 -14.869  -6.533   1.315
  203   2HB   LYS  26          HB1       LYS  26 -16.180  -6.488   0.135
  204   1HG   LYS  26          HG2       LYS  26 -13.575  -8.004  -0.134
  205   2HG   LYS  26          HG1       LYS  26 -15.175  -8.696   0.128
  206   1HD   LYS  26          HD2       LYS  26 -15.900  -7.574  -2.030
  207   2HD   LYS  26          HD1       LYS  26 -14.198  -7.206  -2.317
  208   1HE   LYS  26          HE2       LYS  26 -13.627  -9.562  -2.248
  209   2HE   LYS  26          HE1       LYS  26 -15.286  -9.981  -1.821
  210   1HZ   LYS  26          HZ1       LYS  26 -14.329  -8.794  -4.365
  211   2HZ   LYS  26          HZ2       LYS  26 -15.971  -8.922  -3.949
  212   3HZ   LYS  26          HZ3       LYS  26 -15.029 -10.322  -4.143
  213    H    GLU  27           HN       GLU  27 -13.082  -4.970   1.640
  214    HA   GLU  27           HA       GLU  27 -14.567  -2.672   2.577
  215   1HB   GLU  27          HB2       GLU  27 -11.819  -3.607   3.451
  216   2HB   GLU  27          HB1       GLU  27 -12.907  -2.551   4.351
  217   1HG   GLU  27          HG2       GLU  27 -14.596  -4.527   4.197
  218   2HG   GLU  27          HG1       GLU  27 -13.186  -5.503   3.786
  219    H    ILE  28           HN       ILE  28 -12.167  -3.111   0.233
  220    HA   ILE  28           HA       ILE  28 -11.003  -0.413   0.536
  221    HB   ILE  28           HB       ILE  28 -10.524  -2.533  -1.569
  222   1HG1  ILE  28          HG12      ILE  28  -9.941  -3.455   0.592
  223   2HG1  ILE  28          HG11      ILE  28  -8.449  -3.003  -0.223
  224   1HG2  ILE  28          HG21      ILE  28  -8.378  -1.245  -1.819
  225   2HG2  ILE  28          HG22      ILE  28  -9.070  -0.018  -0.759
  226   3HG2  ILE  28          HG23      ILE  28  -9.825  -0.373  -2.314
  227   1HD1  ILE  28          HD11      ILE  28  -8.125  -2.137   1.913
  228   2HD1  ILE  28          HD12      ILE  28  -9.815  -1.676   2.091
  229   3HD1  ILE  28          HD13      ILE  28  -8.748  -0.736   1.048
  230    H    LEU  29           HN       LEU  29 -12.138  -2.132  -2.373
  231    HA   LEU  29           HA       LEU  29 -12.661   0.099  -3.924
  232   1HB   LEU  29          HB2       LEU  29 -14.430  -2.363  -3.860
  233   2HB   LEU  29          HB1       LEU  29 -14.217  -1.258  -5.217
  234    HG   LEU  29           HG       LEU  29 -11.991  -2.911  -3.982
  235   1HD1  LEU  29          HD11      LEU  29 -13.445  -4.451  -5.066
  236   2HD1  LEU  29          HD12      LEU  29 -12.166  -4.120  -6.234
  237   3HD1  LEU  29          HD13      LEU  29 -13.741  -3.343  -6.408
  238   1HD2  LEU  29          HD21      LEU  29 -10.944  -2.257  -6.289
  239   2HD2  LEU  29          HD22      LEU  29 -10.960  -1.051  -5.005
  240   3HD2  LEU  29          HD23      LEU  29 -12.158  -0.976  -6.297
  241    H    ASP  30           HN       ASP  30 -14.540  -1.113  -1.231
  242    HA   ASP  30           HA       ASP  30 -16.850   0.590  -1.776
  243   1HB   ASP  30          HB2       ASP  30 -17.023  -1.481  -0.393
  244   2HB   ASP  30          HB1       ASP  30 -15.978  -0.735   0.817
  245    H    ALA  31           HN       ALA  31 -14.136   0.651   0.553
  246    HA   ALA  31           HA       ALA  31 -14.607   3.083   1.820
  247   1HB   ALA  31          HB1       ALA  31 -12.234   3.286   2.162
  248   2HB   ALA  31          HB2       ALA  31 -11.900   2.198   0.810
  249   3HB   ALA  31          HB3       ALA  31 -12.664   1.581   2.274
  250    H    PHE  32           HN       PHE  32 -12.782   2.680  -1.248
  251    HA   PHE  32           HA       PHE  32 -12.410   5.418  -1.774
  252   1HB   PHE  32          HB2       PHE  32 -12.852   3.062  -3.625
  253   2HB   PHE  32          HB1       PHE  32 -12.620   4.690  -4.259
  254    HD1  PHE  32           HD1      PHE  32 -11.030   1.815  -2.659
  255    HD2  PHE  32           HD2      PHE  32 -10.494   5.923  -3.798
  256    HE1  PHE  32           HE1      PHE  32  -8.576   1.581  -2.382
  257    HE2  PHE  32           HE2      PHE  32  -8.045   5.683  -3.513
  258    HZ   PHE  32           HZ       PHE  32  -7.088   3.508  -2.804
  259    H    ASP  33           HN       ASP  33 -15.302   3.395  -2.348
  260    HA   ASP  33           HA       ASP  33 -16.801   5.429  -3.686
  261   1HB   ASP  33          HB2       ASP  33 -17.398   2.934  -3.412
  262   2HB   ASP  33          HB1       ASP  33 -18.011   3.378  -1.819
  263    H    LYS  34           HN       LYS  34 -15.546   5.340  -0.591
  264    HA   LYS  34           HA       LYS  34 -17.649   7.177   0.511
  265   1HB   LYS  34          HB2       LYS  34 -15.391   5.802   2.012
  266   2HB   LYS  34          HB1       LYS  34 -16.778   6.647   2.706
  267   1HG   LYS  34          HG2       LYS  34 -18.310   4.988   1.792
  268   2HG   LYS  34          HG1       LYS  34 -16.983   4.186   0.959
  269   1HD   LYS  34          HD2       LYS  34 -15.958   4.053   3.431
  270   2HD   LYS  34          HD1       LYS  34 -17.650   4.210   3.891
  271   1HE   LYS  34          HE2       LYS  34 -16.678   2.133   1.908
  272   2HE   LYS  34          HE1       LYS  34 -16.806   1.830   3.637
  273   1HZ   LYS  34          HZ1       LYS  34 -19.194   2.969   2.977
  274   2HZ   LYS  34          HZ2       LYS  34 -18.914   1.313   3.235
  275   3HZ   LYS  34          HZ3       LYS  34 -18.865   1.952   1.661
  276    H    MET  35           HN       MET  35 -14.097   6.888   1.009
  277    HA   MET  35           HA       MET  35 -13.791   9.682   1.556
  278   1HB   MET  35          HB2       MET  35 -11.537   8.070   0.359
  279   2HB   MET  35          HB1       MET  35 -11.458   9.356   1.550
  280   1HG   MET  35          HG2       MET  35 -11.972   7.948   3.316
  281   2HG   MET  35          HG1       MET  35 -12.937   6.864   2.324
  282   1HE   MET  35          HE1       MET  35 -10.575   6.011  -0.213
  283   2HE   MET  35          HE2       MET  35 -12.170   5.731   0.465
  284   3HE   MET  35          HE3       MET  35 -10.926   4.506   0.654
  285    H    CYS  36           HN       CYS  36 -13.173   7.810  -1.423
  286    HA   CYS  36           HA       CYS  36 -12.544  10.225  -2.927
  287   1HB   CYS  36          HB2       CYS  36 -11.627   7.924  -3.435
  288   2HB   CYS  36          HB1       CYS  36 -13.231   7.477  -4.002
  289    H    SER  37           HN       SER  37 -15.183   9.849  -1.500
  290    HA   SER  37           HA       SER  37 -17.122   9.964  -3.745
  291   1HB   SER  37          HB2       SER  37 -17.479   8.700  -1.501
  292   2HB   SER  37          HB1       SER  37 -17.785  10.289  -0.817
  293    HG   SER  37           HG       SER  37 -19.572  10.463  -1.990
  294    H    LYS  38           HN       LYS  38 -16.018  11.886  -0.967
  295    HA   LYS  38           HA       LYS  38 -17.513  14.254  -1.718
  296   1HB   LYS  38          HB2       LYS  38 -16.152  15.344   0.059
  297   2HB   LYS  38          HB1       LYS  38 -16.879  13.836   0.616
  298   1HG   LYS  38          HG2       LYS  38 -14.656  12.719  -0.115
  299   2HG   LYS  38          HG1       LYS  38 -14.004  14.357  -0.156
  300   1HD   LYS  38          HD2       LYS  38 -14.828  14.639   2.222
  301   2HD   LYS  38          HD1       LYS  38 -15.201  12.914   2.223
  302   1HE   LYS  38          HE2       LYS  38 -12.886  12.342   1.830
  303   2HE   LYS  38          HE1       LYS  38 -12.460  14.035   1.581
  304   1HZ   LYS  38          HZ1       LYS  38 -13.298  12.715   4.094
  305   2HZ   LYS  38          HZ2       LYS  38 -13.305  14.404   3.913
  306   3HZ   LYS  38          HZ3       LYS  38 -11.850  13.538   3.774
  307    H    LEU  39           HN       LEU  39 -14.477  12.901  -2.650
  308    HA   LEU  39           HA       LEU  39 -12.864  15.037  -3.270
  309   1HB   LEU  39          HB2       LEU  39 -13.090  12.328  -4.147
  310   2HB   LEU  39          HB1       LEU  39 -12.988  13.275  -5.611
  311    HG   LEU  39           HG       LEU  39 -10.947  14.340  -3.932
  312   1HD1  LEU  39          HD11      LEU  39 -10.698  11.341  -3.962
  313   2HD1  LEU  39          HD12      LEU  39 -11.360  12.212  -2.577
  314   3HD1  LEU  39          HD13      LEU  39  -9.701  12.516  -3.101
  315   1HD2  LEU  39          HD21      LEU  39  -9.451  13.455  -5.612
  316   2HD2  LEU  39          HD22      LEU  39 -10.935  13.977  -6.414
  317   3HD2  LEU  39          HD23      LEU  39 -10.651  12.262  -6.111
  318    HA   PRO  40           HA       PRO  40 -15.203  17.588  -6.101
  319   1HB   PRO  40          HB2       PRO  40 -12.899  18.199  -7.782
  320   2HB   PRO  40          HB1       PRO  40 -13.711  19.258  -6.621
  321   1HG   PRO  40          HG2       PRO  40 -11.134  18.016  -6.332
  322   2HG   PRO  40          HG1       PRO  40 -11.990  19.001  -5.136
  323   1HD   PRO  40          HD2       PRO  40 -11.560  16.140  -5.097
  324   2HD   PRO  40          HD1       PRO  40 -12.377  17.137  -3.877
  325    H    LYS  41           HN       LYS  41 -16.378  16.841  -7.848
  326    HA   LYS  41           HA       LYS  41 -16.274  14.401  -9.001
  327   1HB   LYS  41          HB2       LYS  41 -17.927  16.272  -9.508
  328   2HB   LYS  41          HB1       LYS  41 -16.783  16.803 -10.740
  329   1HG   LYS  41          HG2       LYS  41 -18.345  15.361 -11.840
  330   2HG   LYS  41          HG1       LYS  41 -16.837  14.462 -11.682
  331   1HD   LYS  41          HD2       LYS  41 -17.727  12.945 -10.196
  332   2HD   LYS  41          HD1       LYS  41 -18.747  14.141  -9.405
  333   1HE   LYS  41          HE2       LYS  41 -20.357  14.060 -11.192
  334   2HE   LYS  41          HE1       LYS  41 -19.297  13.047 -12.172
  335   1HZ   LYS  41          HZ1       LYS  41 -21.113  12.286 -10.125
  336   2HZ   LYS  41          HZ2       LYS  41 -19.544  11.747  -9.759
  337   3HZ   LYS  41          HZ3       LYS  41 -20.275  11.309 -11.229
  338    H    SER  42           HN       SER  42 -14.629  17.156 -10.493
  339    HA   SER  42           HA       SER  42 -13.406  15.967 -12.660
  340   1HB   SER  42          HB2       SER  42 -12.012  17.851 -10.741
  341   2HB   SER  42          HB1       SER  42 -11.597  17.594 -12.434
  342    HG   SER  42           HG       SER  42 -14.231  18.169 -12.099
  343    H    LEU  43           HN       LEU  43 -11.733  16.202  -9.487
  344    HA   LEU  43           HA       LEU  43  -9.877  14.104 -10.335
  345   1HB   LEU  43          HB2       LEU  43 -10.184  15.784  -7.856
  346   2HB   LEU  43          HB1       LEU  43  -9.170  14.343  -7.806
  347    HG   LEU  43           HG       LEU  43  -7.960  15.242  -9.844
  348   1HD1  LEU  43          HD11      LEU  43  -9.587  17.685  -9.099
  349   2HD1  LEU  43          HD12      LEU  43  -9.626  16.811 -10.630
  350   3HD1  LEU  43          HD13      LEU  43  -8.185  17.717 -10.169
  351   1HD2  LEU  43          HD21      LEU  43  -7.942  16.816  -7.255
  352   2HD2  LEU  43          HD22      LEU  43  -6.671  16.896  -8.478
  353   3HD2  LEU  43          HD23      LEU  43  -6.985  15.381  -7.626
  354    H    SER  44           HN       SER  44 -13.018  13.974  -9.244
  355    HA   SER  44           HA       SER  44 -12.661  11.650  -7.478
  356   1HB   SER  44          HB2       SER  44 -14.906  11.865  -6.977
  357   2HB   SER  44          HB1       SER  44 -14.651  13.492  -7.592
  358    HG   SER  44           HG       SER  44 -16.073  11.403  -8.643
  359    H    GLU  45           HN       GLU  45 -13.132  12.491 -10.767
  360    HA   GLU  45           HA       GLU  45 -13.934   9.824 -11.601
  361   1HB   GLU  45          HB2       GLU  45 -14.804  11.201 -13.217
  362   2HB   GLU  45          HB1       GLU  45 -13.700  12.503 -12.795
  363   1HG   GLU  45          HG2       GLU  45 -11.959  11.583 -14.163
  364   2HG   GLU  45          HG1       GLU  45 -12.862  10.088 -14.416
  365    H    GLU  46           HN       GLU  46 -11.041  11.847 -11.518
  366    HA   GLU  46           HA       GLU  46  -9.384   9.862 -12.868
  367   1HB   GLU  46          HB2       GLU  46  -8.564  12.280 -11.235
  368   2HB   GLU  46          HB1       GLU  46  -7.528  11.365 -12.331
  369   1HG   GLU  46          HG2       GLU  46  -8.998  11.956 -14.221
  370   2HG   GLU  46          HG1       GLU  46 -10.036  12.872 -13.128
  371    H    CYS  47           HN       CYS  47 -10.400  10.487  -9.615
  372    HA   CYS  47           HA       CYS  47  -8.196   9.077  -8.328
  373   1HB   CYS  47          HB2       CYS  47  -9.183  10.558  -6.831
  374   2HB   CYS  47          HB1       CYS  47 -10.787  10.297  -7.492
  375    H    GLN  48           HN       GLN  48 -11.396   8.249  -9.567
  376    HA   GLN  48           HA       GLN  48 -11.328   5.560  -8.392
  377   1HB   GLN  48          HB2       GLN  48 -13.219   7.076 -10.196
  378   2HB   GLN  48          HB1       GLN  48 -13.390   5.332  -9.984
  379   1HG   GLN  48          HG2       GLN  48 -13.220   7.231  -7.637
  380   2HG   GLN  48          HG1       GLN  48 -14.756   6.803  -8.392
  381   1HE2  GLN  48          HE21      GLN  48 -14.859   5.934  -5.926
  382   2HE2  GLN  48          HE22      GLN  48 -14.435   4.301  -5.746
  383    H    GLU  49           HN       GLU  49 -10.242   7.211 -11.195
  384    HA   GLU  49           HA       GLU  49 -10.248   4.967 -12.975
  385   1HB   GLU  49          HB2       GLU  49  -8.829   7.615 -12.926
  386   2HB   GLU  49          HB1       GLU  49  -8.317   6.392 -14.086
  387   1HG   GLU  49          HG2       GLU  49 -10.426   6.353 -15.159
  388   2HG   GLU  49          HG1       GLU  49 -11.223   7.169 -13.816
  389    H    VAL  50           HN       VAL  50  -7.760   6.395 -10.843
  390    HA   VAL  50           HA       VAL  50  -5.766   4.433 -11.479
  391    HB   VAL  50           HB       VAL  50  -6.028   5.953  -8.876
  392   1HG1  VAL  50          HG11      VAL  50  -4.407   4.213  -8.698
  393   2HG1  VAL  50          HG12      VAL  50  -3.485   5.678  -9.030
  394   3HG1  VAL  50          HG13      VAL  50  -3.786   4.513 -10.324
  395   1HG2  VAL  50          HG21      VAL  50  -4.348   7.491 -10.100
  396   2HG2  VAL  50          HG22      VAL  50  -6.046   7.628 -10.561
  397   3HG2  VAL  50          HG23      VAL  50  -4.923   6.728 -11.584
  398    H    VAL  51           HN       VAL  51  -8.239   4.603  -8.907
  399    HA   VAL  51           HA       VAL  51  -7.556   2.388  -7.329
  400    HB   VAL  51           HB       VAL  51 -10.282   3.281  -8.351
  401   1HG1  VAL  51          HG11      VAL  51 -11.149   1.987  -6.353
  402   2HG1  VAL  51          HG12      VAL  51  -9.560   1.234  -6.243
  403   3HG1  VAL  51          HG13      VAL  51 -10.554   0.988  -7.679
  404   1HG2  VAL  51          HG21      VAL  51  -9.147   3.601  -5.572
  405   2HG2  VAL  51          HG22      VAL  51 -10.446   4.512  -6.343
  406   3HG2  VAL  51          HG23      VAL  51  -8.775   4.765  -6.843
  407    H    ASP  52           HN       ASP  52  -9.447   2.308 -10.383
  408    HA   ASP  52           HA       ASP  52  -9.666  -0.508 -10.590
  409   1HB   ASP  52          HB2       ASP  52 -10.783   1.112 -12.135
  410   2HB   ASP  52          HB1       ASP  52  -9.213   1.461 -12.861
  411    H    THR  53           HN       THR  53  -7.024   1.710 -11.304
  412    HA   THR  53           HA       THR  53  -5.306  -0.414 -12.335
  413    HB   THR  53           HB       THR  53  -4.693   2.453 -11.761
  414    HG1  THR  53           HG1      THR  53  -5.037   1.134 -14.220
  415   1HG2  THR  53          HG21      THR  53  -2.650   2.083 -13.038
  416   2HG2  THR  53          HG22      THR  53  -3.104   0.402 -13.313
  417   3HG2  THR  53          HG23      THR  53  -2.690   0.948 -11.691
  418    H    TYR  54           HN       TYR  54  -6.018   1.045  -9.314
  419    HA   TYR  54           HA       TYR  54  -3.890  -0.626  -8.024
  420   1HB   TYR  54          HB2       TYR  54  -4.711   2.204  -7.346
  421   2HB   TYR  54          HB1       TYR  54  -3.791   1.176  -6.252
  422    HD1  TYR  54           HD1      TYR  54  -3.782   2.302  -9.780
  423    HD2  TYR  54           HD2      TYR  54  -1.448   1.239  -6.379
  424    HE1  TYR  54           HE1      TYR  54  -1.756   2.990 -11.006
  425    HE2  TYR  54           HE2      TYR  54   0.621   1.900  -7.585
  426    HH   TYR  54           HH       TYR  54   1.476   2.553  -9.548
  427    H    GLY  55           HN       GLY  55  -5.940  -2.050  -7.991
  428   1HA   GLY  55          HA2       GLY  55  -7.410  -1.527  -5.447
  429   2HA   GLY  55          HA1       GLY  55  -8.324  -1.925  -6.905
  430    H    SER  56           HN       SER  56  -7.370  -4.013  -8.039
  431    HA   SER  56           HA       SER  56  -7.472  -6.120  -5.994
  432   1HB   SER  56          HB2       SER  56  -7.988  -7.545  -7.747
  433   2HB   SER  56          HB1       SER  56  -8.438  -6.017  -8.496
  434    HG   SER  56           HG       SER  56  -6.110  -6.008  -9.170
  435    H    SER  57           HN       SER  57  -5.037  -4.402  -7.682
  436    HA   SER  57           HA       SER  57  -2.989  -6.512  -7.301
  437   1HB   SER  57          HB2       SER  57  -2.874  -3.755  -8.561
  438   2HB   SER  57          HB1       SER  57  -1.461  -4.789  -8.352
  439    HG   SER  57           HG       SER  57  -2.088  -5.633 -10.171
  440    H    ILE  58           HN       ILE  58  -2.900  -3.002  -6.697
  441    HA   ILE  58           HA       ILE  58  -1.027  -2.595  -4.836
  442    HB   ILE  58           HB       ILE  58  -2.761  -0.952  -5.463
  443   1HG1  ILE  58          HG12      ILE  58  -2.223  -1.340  -2.505
  444   2HG1  ILE  58          HG11      ILE  58  -1.373  -0.265  -3.625
  445   1HG2  ILE  58          HG21      ILE  58  -4.639  -2.684  -4.923
  446   2HG2  ILE  58          HG22      ILE  58  -4.933  -0.969  -4.643
  447   3HG2  ILE  58          HG23      ILE  58  -4.512  -2.005  -3.295
  448   1HD1  ILE  58          HD11      ILE  58  -4.163   0.016  -2.493
  449   2HD1  ILE  58          HD12      ILE  58  -3.687   0.878  -3.958
  450   3HD1  ILE  58          HD13      ILE  58  -2.837   1.182  -2.440
  451    H    LEU  59           HN       LEU  59  -4.114  -4.125  -4.040
  452    HA   LEU  59           HA       LEU  59  -3.281  -4.657  -1.293
  453   1HB   LEU  59          HB2       LEU  59  -5.541  -6.152  -2.636
  454   2HB   LEU  59          HB1       LEU  59  -5.365  -5.704  -0.941
  455    HG   LEU  59           HG       LEU  59  -5.709  -3.708  -3.149
  456   1HD1  LEU  59          HD11      LEU  59  -7.788  -4.926  -1.349
  457   2HD1  LEU  59          HD12      LEU  59  -7.656  -5.153  -3.093
  458   3HD1  LEU  59          HD13      LEU  59  -8.061  -3.564  -2.440
  459   1HD2  LEU  59          HD21      LEU  59  -6.348  -2.218  -1.264
  460   2HD2  LEU  59          HD22      LEU  59  -4.701  -2.815  -1.099
  461   3HD2  LEU  59          HD23      LEU  59  -5.999  -3.534  -0.143
  462    H    SER  60           HN       SER  60  -3.940  -6.732  -4.148
  463    HA   SER  60           HA       SER  60  -2.839  -9.099  -2.861
  464   1HB   SER  60          HB2       SER  60  -4.642  -9.058  -4.640
  465   2HB   SER  60          HB1       SER  60  -3.368  -8.713  -5.806
  466    HG   SER  60           HG       SER  60  -2.771 -10.725  -5.699
  467    H    ILE  61           HN       ILE  61  -1.226  -6.482  -4.041
  468    HA   ILE  61           HA       ILE  61   0.947  -8.032  -5.341
  469    HB   ILE  61           HB       ILE  61  -0.191  -5.759  -6.078
  470   1HG1  ILE  61          HG12      ILE  61   1.651  -7.005  -7.237
  471   2HG1  ILE  61          HG11      ILE  61   1.687  -5.270  -7.471
  472   1HG2  ILE  61          HG21      ILE  61   2.070  -4.723  -4.368
  473   2HG2  ILE  61          HG22      ILE  61   0.345  -4.516  -4.054
  474   3HG2  ILE  61          HG23      ILE  61   1.075  -3.784  -5.473
  475   1HD1  ILE  61          HD11      ILE  61   3.441  -5.049  -5.792
  476   2HD1  ILE  61          HD12      ILE  61   3.928  -6.226  -7.011
  477   3HD1  ILE  61          HD13      ILE  61   3.352  -6.775  -5.442
  478    H    LEU  62           HN       LEU  62   0.794  -5.538  -2.775
  479    HA   LEU  62           HA       LEU  62   3.425  -5.974  -1.833
  480   1HB   LEU  62          HB2       LEU  62   1.014  -5.012  -0.301
  481   2HB   LEU  62          HB1       LEU  62   2.686  -4.874   0.247
  482    HG   LEU  62           HG       LEU  62   1.633  -3.716  -2.335
  483   1HD1  LEU  62          HD11      LEU  62   2.223  -2.388   0.318
  484   2HD1  LEU  62          HD12      LEU  62   0.638  -2.558  -0.434
  485   3HD1  LEU  62          HD13      LEU  62   1.858  -1.523  -1.176
  486   1HD2  LEU  62          HD21      LEU  62   3.887  -2.351  -1.909
  487   2HD2  LEU  62          HD22      LEU  62   3.865  -3.883  -2.777
  488   3HD2  LEU  62          HD23      LEU  62   4.327  -3.842  -1.072
  489    H    LEU  63           HN       LEU  63   1.126  -8.290  -1.935
  490    HA   LEU  63           HA       LEU  63   1.778  -9.463   0.723
  491   1HB   LEU  63          HB2       LEU  63   0.034 -10.923  -1.216
  492   2HB   LEU  63          HB1       LEU  63  -0.135 -10.736   0.527
  493    HG   LEU  63           HG       LEU  63  -0.868  -8.786  -1.654
  494   1HD1  LEU  63          HD11      LEU  63  -2.506 -10.520  -1.042
  495   2HD1  LEU  63          HD12      LEU  63  -3.082  -8.931  -0.542
  496   3HD1  LEU  63          HD13      LEU  63  -2.401 -10.036   0.648
  497   1HD2  LEU  63          HD21      LEU  63  -0.181  -7.121  -0.236
  498   2HD2  LEU  63          HD22      LEU  63  -0.095  -8.196   1.159
  499   3HD2  LEU  63          HD23      LEU  63  -1.638  -7.509   0.668
  500    H    GLU  64           HN       GLU  64   1.910 -10.434  -2.746
  501    HA   GLU  64           HA       GLU  64   4.058 -12.394  -1.969
  502   1HB   GLU  64          HB2       GLU  64   1.804 -12.744  -3.953
  503   2HB   GLU  64          HB1       GLU  64   3.127 -13.891  -3.724
  504   1HG   GLU  64          HG2       GLU  64   1.274 -13.014  -1.491
  505   2HG   GLU  64          HG1       GLU  64   1.019 -14.472  -2.451
  506    H    GLU  65           HN       GLU  65   2.648 -10.893  -4.922
  507    HA   GLU  65           HA       GLU  65   4.894 -11.284  -6.558
  508   1HB   GLU  65          HB2       GLU  65   3.200  -8.772  -6.551
  509   2HB   GLU  65          HB1       GLU  65   4.095  -9.442  -7.916
  510   1HG   GLU  65          HG2       GLU  65   1.788 -10.802  -6.495
  511   2HG   GLU  65          HG1       GLU  65   1.684  -9.986  -8.056
  512    H    VAL  66           HN       VAL  66   4.585  -9.542  -3.771
  513    HA   VAL  66           HA       VAL  66   7.274  -8.327  -4.062
  514    HB   VAL  66           HB       VAL  66   4.632  -7.051  -3.542
  515   1HG1  VAL  66          HG11      VAL  66   5.671  -6.469  -1.493
  516   2HG1  VAL  66          HG12      VAL  66   5.816  -5.067  -2.550
  517   3HG1  VAL  66          HG13      VAL  66   7.205  -6.126  -2.295
  518   1HG2  VAL  66          HG21      VAL  66   7.120  -6.117  -4.943
  519   2HG2  VAL  66          HG22      VAL  66   5.564  -5.286  -4.928
  520   3HG2  VAL  66          HG23      VAL  66   5.717  -6.869  -5.700
  521    H    SER  67           HN       SER  67   8.461  -8.543  -2.163
  522    HA   SER  67           HA       SER  67   7.195 -10.041   0.054
  523   1HB   SER  67          HB2       SER  67   9.294 -10.951   0.095
  524   2HB   SER  67          HB1       SER  67   9.902  -9.707  -0.990
  525    HG   SER  67           HG       SER  67  10.556  -8.554   0.680
  526    HA   PRO  68           HA       PRO  68   6.550  -6.555   2.650
  527   1HB   PRO  68          HB2       PRO  68   7.809  -7.433   5.053
  528   2HB   PRO  68          HB1       PRO  68   6.110  -7.649   4.597
  529   1HG   PRO  68          HG2       PRO  68   8.284  -9.649   4.607
  530   2HG   PRO  68          HG1       PRO  68   6.534  -9.908   4.530
  531   1HD   PRO  68          HD2       PRO  68   8.345 -10.209   2.372
  532   2HD   PRO  68          HD1       PRO  68   6.576 -10.122   2.249
  533    H    GLU  69           HN       GLU  69   9.843  -7.882   3.162
  534    HA   GLU  69           HA       GLU  69  11.060  -5.433   3.959
  535   1HB   GLU  69          HB2       GLU  69  12.085  -7.729   4.150
  536   2HB   GLU  69          HB1       GLU  69  12.384  -7.679   2.412
  537   1HG   GLU  69          HG2       GLU  69  13.799  -5.722   2.653
  538   2HG   GLU  69          HG1       GLU  69  13.398  -5.595   4.366
  539    H    LEU  70           HN       LEU  70  10.560  -6.849   0.732
  540    HA   LEU  70           HA       LEU  70  12.096  -5.042  -0.779
  541   1HB   LEU  70          HB2       LEU  70  11.104  -6.930  -1.878
  542   2HB   LEU  70          HB1       LEU  70   9.484  -6.446  -1.391
  543    HG   LEU  70           HG       LEU  70   9.610  -4.469  -2.832
  544   1HD1  LEU  70          HD11      LEU  70  11.904  -3.872  -2.780
  545   2HD1  LEU  70          HD12      LEU  70  11.628  -4.394  -4.435
  546   3HD1  LEU  70          HD13      LEU  70  12.424  -5.473  -3.291
  547   1HD2  LEU  70          HD21      LEU  70  10.578  -6.827  -4.459
  548   2HD2  LEU  70          HD22      LEU  70   9.406  -5.591  -4.916
  549   3HD2  LEU  70          HD23      LEU  70   8.982  -6.805  -3.712
  550    H    VAL  71           HN       VAL  71   8.678  -4.752   0.249
  551    HA   VAL  71           HA       VAL  71   8.005  -2.322  -0.911
  552    HB   VAL  71           HB       VAL  71   7.324  -2.813   1.990
  553   1HG1  VAL  71          HG11      VAL  71   5.227  -1.835   1.386
  554   2HG1  VAL  71          HG12      VAL  71   5.569  -2.000  -0.336
  555   3HG1  VAL  71          HG13      VAL  71   6.462  -0.832   0.630
  556   1HG2  VAL  71          HG21      VAL  71   6.494  -4.406  -0.433
  557   2HG2  VAL  71          HG22      VAL  71   5.482  -4.321   1.010
  558   3HG2  VAL  71          HG23      VAL  71   7.106  -4.986   1.105
  559    H    CYS  72           HN       CYS  72   9.640  -2.713   2.265
  560    HA   CYS  72           HA       CYS  72  10.061  -0.004   2.872
  561   1HB   CYS  72          HB2       CYS  72  11.905  -2.362   3.252
  562   2HB   CYS  72          HB1       CYS  72  12.263  -0.758   3.879
  563    H    SER  73           HN       SER  73  11.682  -2.011   0.474
  564    HA   SER  73           HA       SER  73  13.710  -0.036  -0.171
  565   1HB   SER  73          HB2       SER  73  12.947  -1.889  -2.346
  566   2HB   SER  73          HB1       SER  73  14.512  -1.658  -1.575
  567    HG   SER  73           HG       SER  73  13.551  -3.728  -1.171
  568    H    MET  74           HN       MET  74  10.779  -1.123  -1.981
  569    HA   MET  74           HA       MET  74  10.768   0.908  -3.923
  570   1HB   MET  74          HB2       MET  74   8.291  -0.106  -2.499
  571   2HB   MET  74          HB1       MET  74   8.380   0.561  -4.127
  572   1HG   MET  74          HG2       MET  74  10.062  -1.379  -4.583
  573   2HG   MET  74          HG1       MET  74   9.377  -2.100  -3.126
  574   1HE   MET  74          HE1       MET  74   6.527  -1.883  -2.845
  575   2HE   MET  74          HE2       MET  74   7.414  -3.400  -2.993
  576   3HE   MET  74          HE3       MET  74   5.921  -3.169  -3.909
  577    H    LEU  75           HN       LEU  75   9.497   1.007  -0.605
  578    HA   LEU  75           HA       LEU  75   8.458   3.687  -0.767
  579   1HB   LEU  75          HB2       LEU  75   9.477   2.196   1.673
  580   2HB   LEU  75          HB1       LEU  75   8.415   3.601   1.688
  581    HG   LEU  75           HG       LEU  75   7.614   1.112   0.182
  582   1HD1  LEU  75          HD11      LEU  75   7.603   1.548   3.158
  583   2HD1  LEU  75          HD12      LEU  75   7.892   0.070   2.244
  584   3HD1  LEU  75          HD13      LEU  75   6.253   0.681   2.422
  585   1HD2  LEU  75          HD21      LEU  75   6.097   3.367   1.532
  586   2HD2  LEU  75          HD22      LEU  75   5.338   1.975   0.762
  587   3HD2  LEU  75          HD23      LEU  75   6.278   3.110  -0.204
  588    H    HIS  76           HN       HIS  76  11.532   2.643  -1.149
  589    HA   HIS  76           HA       HIS  76  13.662   3.550  -0.751
  590   1HB   HIS  76          HB2       HIS  76  13.846   5.846  -1.546
  591   2HB   HIS  76          HB1       HIS  76  12.687   4.968  -2.549
  592    HD1  HIS  76           HD1      HIS  76  12.910   7.677   0.042
  593    HD2  HIS  76           HD2      HIS  76   9.985   5.780  -2.237
  594    HE1  HIS  76           HE1      HIS  76  10.804   9.063   0.287
  595    H    LEU  77           HN       LEU  77  12.555   3.004   1.638
  596    HA   LEU  77           HA       LEU  77  12.656   5.364   3.354
  597   1HB   LEU  77          HB2       LEU  77  11.011   3.623   3.831
  598   2HB   LEU  77          HB1       LEU  77  12.276   2.397   3.900
  599    HG   LEU  77           HG       LEU  77  13.230   3.404   5.866
  600   1HD1  LEU  77          HD11      LEU  77  11.277   5.607   5.223
  601   2HD1  LEU  77          HD12      LEU  77  12.993   5.726   5.612
  602   3HD1  LEU  77          HD13      LEU  77  11.826   5.373   6.885
  603   1HD2  LEU  77          HD21      LEU  77  10.214   3.159   5.982
  604   2HD2  LEU  77          HD22      LEU  77  11.260   3.165   7.402
  605   3HD2  LEU  77          HD23      LEU  77  11.383   1.863   6.218
  606    H    CYS  78           HN       CYS  78  14.702   2.714   2.355
  607    HA   CYS  78           HA       CYS  78  16.674   3.175   4.493
  608   1HB   CYS  78          HB2       CYS  78  16.790   1.442   2.001
  609   2HB   CYS  78          HB1       CYS  78  18.025   1.486   3.257
  610    H    SER  79           HN       SER  79  17.808   2.719   1.238
  611    HA   SER  79           HA       SER  79  19.686   4.840   1.371
  612   1HB   SER  79          HB2       SER  79  18.463   3.570  -1.096
  613   2HB   SER  79          HB1       SER  79  19.946   4.519  -1.059
  614    HG   SER  79           HG       SER  79  20.022   2.604   0.822
  615    H    GLY  80           HN       GLY  80  18.655   6.777   2.008
  616   1HA   GLY  80          HA2       GLY  80  16.403   7.835   0.449
  617   2HA   GLY  80          HA1       GLY  80  17.226   8.658   1.776
  618    H    LEU  81           HN       LEU  81  19.856   8.122   0.590
  619    HA   LEU  81           HA       LEU  81  19.834  10.000  -1.726
  620   1HB   LEU  81          HB2       LEU  81  22.165  10.653  -0.741
  621   2HB   LEU  81          HB1       LEU  81  20.720  11.331   0.000
  622    HG   LEU  81           HG       LEU  81  20.755   9.626   1.733
  623   1HD1  LEU  81          HD11      LEU  81  23.067   8.550   0.107
  624   2HD1  LEU  81          HD12      LEU  81  21.671   7.680   0.743
  625   3HD1  LEU  81          HD13      LEU  81  22.946   8.211   1.834
  626   1HD2  LEU  81          HD21      LEU  81  23.387  11.053   1.291
  627   2HD2  LEU  81          HD22      LEU  81  22.923  10.295   2.815
  628   3HD2  LEU  81          HD23      LEU  81  21.991  11.652   2.185
  629    H    VAL  82           HN       VAL  82  22.396   9.807  -2.516
  630    HA   VAL  82           HA       VAL  82  22.505   7.031  -3.381
  631    HB   VAL  82           HB       VAL  82  24.688   7.829  -4.521
  632   1HG1  VAL  82          HG11      VAL  82  22.026   9.086  -5.246
  633   2HG1  VAL  82          HG12      VAL  82  22.550   7.457  -5.682
  634   3HG1  VAL  82          HG13      VAL  82  23.394   8.862  -6.338
  635   1HG2  VAL  82          HG21      VAL  82  24.876  10.252  -4.786
  636   2HG2  VAL  82          HG22      VAL  82  24.899   9.865  -3.066
  637   3HG2  VAL  82          HG23      VAL  82  23.432  10.504  -3.808
  638    HA   PRO  83           HA       PRO  83  24.941   5.778   0.121
  639   1HB   PRO  83          HB2       PRO  83  26.261   3.762  -1.585
  640   2HB   PRO  83          HB1       PRO  83  25.245   3.528  -0.153
  641   1HG   PRO  83          HG2       PRO  83  24.445   3.058  -2.811
  642   2HG   PRO  83          HG1       PRO  83  23.373   3.213  -1.413
  643   1HD   PRO  83          HD2       PRO  83  23.747   5.107  -3.628
  644   2HD   PRO  83          HD1       PRO  83  22.521   5.106  -2.334
  645    H    ARG  84           HN       ARG  84  27.073   6.361   0.820
  646    HA   ARG  84           HA       ARG  84  28.721   7.813  -1.124
  647   1HB   ARG  84          HB2       ARG  84  28.933   7.270   1.844
  648   2HB   ARG  84          HB1       ARG  84  30.268   8.003   0.960
  649   1HG   ARG  84          HG2       ARG  84  29.059   9.857   1.769
  650   2HG   ARG  84          HG1       ARG  84  28.507   9.710   0.105
  651   1HD   ARG  84          HD2       ARG  84  26.635  10.057   1.697
  652   2HD   ARG  84          HD1       ARG  84  26.503   8.525   0.839
  653    HE   ARG  84           HE       ARG  84  27.856   7.868   3.167
  654   1HH1  ARG  84          HH21      ARG  84  24.939   9.506   2.337
  655   2HH1  ARG  84          HH22      ARG  84  24.106   9.035   3.782
  656   1HH2  ARG  84          HH11      ARG  84  26.785   7.244   5.061
  657   2HH2  ARG  84          HH12      ARG  84  25.151   7.755   5.324
  Start of MODEL    3
    1   1H    SER   1           HT1      SER   1  20.438   7.419   5.528
    2   2H    SER   1           HT2      SER   1  21.452   6.629   6.638
    3   3H    SER   1           HT3      SER   1  21.314   8.323   6.665
    4    HA   SER   1           HA       SER   1  19.940   7.802   8.391
    5   1HB   SER   1          HB2       SER   1  17.631   7.980   7.587
    6   2HB   SER   1          HB1       SER   1  18.675   9.042   6.646
    7    HG   SER   1           HG       SER   1  18.771   6.774   5.409
    8    H    ASP   2           HN       ASP   2  18.299   6.278   9.343
    9    HA   ASP   2           HA       ASP   2  17.987   3.644   8.154
   10   1HB   ASP   2          HB2       ASP   2  19.227   2.442   9.974
   11   2HB   ASP   2          HB1       ASP   2  20.281   3.373   8.910
   12    H    VAL   3           HN       VAL   3  16.168   5.562   9.128
   13    HA   VAL   3           HA       VAL   3  15.228   4.476  11.734
   14    HB   VAL   3           HB       VAL   3  14.218   6.883  10.260
   15   1HG1  VAL   3          HG11      VAL   3  13.277   7.499  12.414
   16   2HG1  VAL   3          HG12      VAL   3  14.055   6.116  13.183
   17   3HG1  VAL   3          HG13      VAL   3  12.755   5.862  12.018
   18   1HG2  VAL   3          HG21      VAL   3  16.572   7.245  10.718
   19   2HG2  VAL   3          HG22      VAL   3  16.382   6.641  12.364
   20   3HG2  VAL   3          HG23      VAL   3  15.635   8.168  11.894
   21    H    TYR   4           HN       TYR   4  13.531   5.776   8.880
   22    HA   TYR   4           HA       TYR   4  11.229   4.122   9.306
   23   1HB   TYR   4          HB2       TYR   4  12.207   5.912   7.107
   24   2HB   TYR   4          HB1       TYR   4  10.879   4.815   6.743
   25    HD1  TYR   4           HD1      TYR   4   9.148   6.453   6.495
   26    HD2  TYR   4           HD2      TYR   4  11.491   6.329  10.100
   27    HE1  TYR   4           HE1      TYR   4   7.551   7.997   7.593
   28    HE2  TYR   4           HE2      TYR   4   9.897   7.870  11.189
   29    HH   TYR   4           HH       TYR   4   6.870   8.469  10.087
   30    H    CYS   5           HN       CYS   5  13.957   3.786   6.998
   31    HA   CYS   5           HA       CYS   5  13.087   1.549   5.578
   32   1HB   CYS   5          HB2       CYS   5  15.785   2.479   6.480
   33   2HB   CYS   5          HB1       CYS   5  15.662   0.870   5.773
   34    H    GLU   6           HN       GLU   6  14.317   1.689   8.882
   35    HA   GLU   6           HA       GLU   6  14.282  -1.228   9.193
   36   1HB   GLU   6          HB2       GLU   6  14.578   0.961  11.270
   37   2HB   GLU   6          HB1       GLU   6  14.894  -0.756  11.523
   38   1HG   GLU   6          HG2       GLU   6  16.658  -0.685   9.794
   39   2HG   GLU   6          HG1       GLU   6  16.351   1.035   9.555
   40    H    VAL   7           HN       VAL   7  12.527   1.469  10.750
   41    HA   VAL   7           HA       VAL   7  10.581  -0.086  12.079
   42    HB   VAL   7           HB       VAL   7  10.230   2.681  10.887
   43   1HG1  VAL   7          HG11      VAL   7   8.101   1.801  11.566
   44   2HG1  VAL   7          HG12      VAL   7   8.628   2.895  12.844
   45   3HG1  VAL   7          HG13      VAL   7   8.777   1.150  13.059
   46   1HG2  VAL   7          HG21      VAL   7  11.133   3.560  12.902
   47   2HG2  VAL   7          HG22      VAL   7  12.239   2.264  12.452
   48   3HG2  VAL   7          HG23      VAL   7  11.043   1.998  13.720
   49    H    CYS   8           HN       CYS   8  10.862   0.694   8.696
   50    HA   CYS   8           HA       CYS   8   8.047   0.182   8.105
   51   1HB   CYS   8          HB2       CYS   8   8.640   0.499   5.806
   52   2HB   CYS   8          HB1       CYS   8   9.563   1.679   6.733
   53    H    GLU   9           HN       GLU   9  11.079  -1.624   7.402
   54    HA   GLU   9           HA       GLU   9   9.877  -3.869   6.224
   55   1HB   GLU   9          HB2       GLU   9  11.750  -5.267   6.984
   56   2HB   GLU   9          HB1       GLU   9  12.335  -3.736   6.354
   57   1HG   GLU   9          HG2       GLU   9  12.881  -2.928   8.514
   58   2HG   GLU   9          HG1       GLU   9  11.849  -4.098   9.322
   59    H    PHE  10           HN       PHE  10   9.984  -3.024   9.637
   60    HA   PHE  10           HA       PHE  10   8.942  -5.593  10.523
   61   1HB   PHE  10          HB2       PHE  10  10.271  -4.188  12.029
   62   2HB   PHE  10          HB1       PHE  10   9.056  -2.913  11.932
   63    HD1  PHE  10           HD1      PHE  10   9.627  -6.433  13.006
   64    HD2  PHE  10           HD2      PHE  10   7.086  -2.979  13.269
   65    HE1  PHE  10           HE1      PHE  10   8.350  -7.513  14.836
   66    HE2  PHE  10           HE2      PHE  10   5.809  -4.059  15.100
   67    HZ   PHE  10           HZ       PHE  10   6.441  -6.325  15.883
   68    H    LEU  11           HN       LEU  11   7.505  -2.455   9.702
   69    HA   LEU  11           HA       LEU  11   4.863  -3.253  10.662
   70   1HB   LEU  11          HB2       LEU  11   5.782  -0.928   8.955
   71   2HB   LEU  11          HB1       LEU  11   4.128  -1.139   9.517
   72    HG   LEU  11           HG       LEU  11   6.517  -1.043  11.382
   73   1HD1  LEU  11          HD11      LEU  11   6.353   1.082  10.173
   74   2HD1  LEU  11          HD12      LEU  11   5.825   1.298  11.842
   75   3HD1  LEU  11          HD13      LEU  11   4.633   1.183  10.549
   76   1HD2  LEU  11          HD21      LEU  11   4.753  -2.005  12.595
   77   2HD2  LEU  11          HD22      LEU  11   3.517  -1.092  11.733
   78   3HD2  LEU  11          HD23      LEU  11   4.521  -0.296  12.942
   79    H    VAL  12           HN       VAL  12   6.198  -2.631   7.387
   80    HA   VAL  12           HA       VAL  12   3.895  -3.482   5.984
   81    HB   VAL  12           HB       VAL  12   5.282  -3.644   4.049
   82   1HG1  VAL  12          HG11      VAL  12   6.480  -1.584   5.924
   83   2HG1  VAL  12          HG12      VAL  12   4.984  -1.376   5.015
   84   3HG1  VAL  12          HG13      VAL  12   6.520  -1.528   4.161
   85   1HG2  VAL  12          HG21      VAL  12   7.847  -3.512   4.420
   86   2HG2  VAL  12          HG22      VAL  12   7.046  -5.061   4.658
   87   3HG2  VAL  12          HG23      VAL  12   7.486  -4.080   6.053
   88    H    LYS  13           HN       LYS  13   6.419  -5.377   7.513
   89    HA   LYS  13           HA       LYS  13   5.653  -7.888   6.194
   90   1HB   LYS  13          HB2       LYS  13   7.939  -7.514   6.936
   91   2HB   LYS  13          HB1       LYS  13   7.389  -7.331   8.598
   92   1HG   LYS  13          HG2       LYS  13   6.342  -9.842   7.645
   93   2HG   LYS  13          HG1       LYS  13   8.031  -9.780   7.163
   94   1HD   LYS  13          HD2       LYS  13   8.059 -10.753   9.319
   95   2HD   LYS  13          HD1       LYS  13   8.526  -9.076   9.594
   96   1HE   LYS  13          HE2       LYS  13   6.251  -8.512  10.270
   97   2HE   LYS  13          HE1       LYS  13   5.700 -10.140   9.878
   98   1HZ   LYS  13          HZ1       LYS  13   7.533  -9.302  12.042
   99   2HZ   LYS  13          HZ2       LYS  13   7.422 -10.919  11.530
  100   3HZ   LYS  13          HZ3       LYS  13   6.061 -10.133  12.177
  101    H    GLU  14           HN       GLU  14   5.050  -6.344   9.358
  102    HA   GLU  14           HA       GLU  14   3.623  -8.606  10.462
  103   1HB   GLU  14          HB2       GLU  14   4.610  -6.749  11.829
  104   2HB   GLU  14          HB1       GLU  14   3.358  -5.676  11.203
  105   1HG   GLU  14          HG2       GLU  14   1.613  -7.103  12.158
  106   2HG   GLU  14          HG1       GLU  14   2.832  -8.244  12.728
  107    H    VAL  15           HN       VAL  15   2.494  -5.520   9.045
  108    HA   VAL  15           HA       VAL  15  -0.271  -6.057   9.155
  109    HB   VAL  15           HB       VAL  15   0.800  -3.898   8.400
  110   1HG1  VAL  15          HG11      VAL  15   1.019  -5.313   5.733
  111   2HG1  VAL  15          HG12      VAL  15   2.381  -5.053   6.817
  112   3HG1  VAL  15          HG13      VAL  15   1.536  -3.673   6.123
  113   1HG2  VAL  15          HG21      VAL  15  -0.943  -3.453   6.646
  114   2HG2  VAL  15          HG22      VAL  15  -1.582  -4.212   8.103
  115   3HG2  VAL  15          HG23      VAL  15  -1.319  -5.176   6.650
  116    H    THR  16           HN       THR  16   2.180  -7.116   6.809
  117    HA   THR  16           HA       THR  16   0.509  -8.362   4.936
  118    HB   THR  16           HB       THR  16   2.790 -10.075   5.436
  119    HG1  THR  16           HG1      THR  16   3.925  -7.713   5.053
  120   1HG2  THR  16          HG21      THR  16   2.243  -7.885   3.426
  121   2HG2  THR  16          HG22      THR  16   1.878  -9.607   3.227
  122   3HG2  THR  16          HG23      THR  16   3.563  -9.054   3.308
  123    H    LYS  17           HN       LYS  17   1.826  -9.693   7.987
  124    HA   LYS  17           HA       LYS  17   0.831 -12.278   7.891
  125   1HB   LYS  17          HB2       LYS  17   1.641 -10.444   9.996
  126   2HB   LYS  17          HB1       LYS  17   0.267 -11.392  10.552
  127   1HG   LYS  17          HG2       LYS  17   1.441 -13.463  10.026
  128   2HG   LYS  17          HG1       LYS  17   2.777 -12.560   9.308
  129   1HD   LYS  17          HD2       LYS  17   3.223 -11.497  11.501
  130   2HD   LYS  17          HD1       LYS  17   1.911 -12.436  12.215
  131   1HE   LYS  17          HE2       LYS  17   4.340 -13.639  10.856
  132   2HE   LYS  17          HE1       LYS  17   4.150 -13.469  12.601
  133   1HZ   LYS  17          HZ1       LYS  17   3.217 -15.524  10.985
  134   2HZ   LYS  17          HZ2       LYS  17   1.847 -14.668  11.512
  135   3HZ   LYS  17          HZ3       LYS  17   2.941 -15.306  12.643
  136    H    LEU  18           HN       LEU  18  -1.008  -9.324   8.717
  137    HA   LEU  18           HA       LEU  18  -3.494 -10.957   8.821
  138   1HB   LEU  18          HB2       LEU  18  -4.188  -8.175   8.747
  139   2HB   LEU  18          HB1       LEU  18  -4.289  -9.269  10.115
  140    HG   LEU  18           HG       LEU  18  -1.707  -7.887   9.379
  141   1HD1  LEU  18          HD11      LEU  18  -2.270  -6.169  11.010
  142   2HD1  LEU  18          HD12      LEU  18  -3.824  -6.945  11.320
  143   3HD1  LEU  18          HD13      LEU  18  -3.504  -6.213   9.747
  144   1HD2  LEU  18          HD21      LEU  18  -2.684  -8.856  12.066
  145   2HD2  LEU  18          HD22      LEU  18  -1.027  -8.511  11.568
  146   3HD2  LEU  18          HD23      LEU  18  -1.857  -9.938  10.944
  147    H    ILE  19           HN       ILE  19  -2.373  -8.112   6.899
  148    HA   ILE  19           HA       ILE  19  -4.286  -8.051   4.918
  149    HB   ILE  19           HB       ILE  19  -1.472  -7.324   5.180
  150   1HG1  ILE  19          HG12      ILE  19  -3.598  -6.025   3.484
  151   2HG1  ILE  19          HG11      ILE  19  -3.470  -5.788   5.226
  152   1HG2  ILE  19          HG21      ILE  19  -1.049  -8.674   3.227
  153   2HG2  ILE  19          HG22      ILE  19  -1.036  -6.983   2.743
  154   3HG2  ILE  19          HG23      ILE  19  -2.444  -7.984   2.399
  155   1HD1  ILE  19          HD11      ILE  19  -2.070  -4.084   4.714
  156   2HD1  ILE  19          HD12      ILE  19  -1.844  -4.649   3.064
  157   3HD1  ILE  19          HD13      ILE  19  -0.862  -5.326   4.366
  158    H    ASP  20           HN       ASP  20  -2.106 -10.649   5.571
  159    HA   ASP  20           HA       ASP  20  -1.678 -11.926   3.164
  160   1HB   ASP  20          HB2       ASP  20  -2.617 -13.086   5.807
  161   2HB   ASP  20          HB1       ASP  20  -2.192 -14.109   4.434
  162    H    ASN  21           HN       ASN  21  -4.701 -12.044   5.084
  163    HA   ASN  21           HA       ASN  21  -6.365 -11.909   2.756
  164   1HB   ASN  21          HB2       ASN  21  -5.949 -14.608   4.039
  165   2HB   ASN  21          HB1       ASN  21  -7.482 -14.216   3.255
  166   1HD2  ASN  21          HD21      ASN  21  -7.115 -13.200   0.918
  167   2HD2  ASN  21          HD22      ASN  21  -5.949 -13.984  -0.035
  168    H    ASN  22           HN       ASN  22  -5.854 -11.728   6.064
  169    HA   ASN  22           HA       ASN  22  -8.387 -12.183   7.195
  170   1HB   ASN  22          HB2       ASN  22  -7.761 -10.702   8.958
  171   2HB   ASN  22          HB1       ASN  22  -6.262 -11.434   8.396
  172   1HD2  ASN  22          HD21      ASN  22  -6.005  -9.801   5.951
  173   2HD2  ASN  22          HD22      ASN  22  -5.613  -8.227   6.487
  174    H    LYS  23           HN       LYS  23  -7.261  -9.525   5.199
  175    HA   LYS  23           HA       LYS  23  -9.998  -8.301   5.264
  176   1HB   LYS  23          HB2       LYS  23  -8.975  -6.232   4.614
  177   2HB   LYS  23          HB1       LYS  23  -7.997  -6.884   5.923
  178   1HG   LYS  23          HG2       LYS  23  -6.272  -6.426   4.461
  179   2HG   LYS  23          HG1       LYS  23  -6.689  -8.022   3.848
  180   1HD   LYS  23          HD2       LYS  23  -8.428  -6.541   2.378
  181   2HD   LYS  23          HD1       LYS  23  -7.194  -5.321   2.648
  182   1HE   LYS  23          HE2       LYS  23  -6.573  -8.084   1.560
  183   2HE   LYS  23          HE1       LYS  23  -6.897  -6.688   0.540
  184   1HZ   LYS  23          HZ1       LYS  23  -4.515  -7.378   1.899
  185   2HZ   LYS  23          HZ2       LYS  23  -5.057  -5.854   2.422
  186   3HZ   LYS  23          HZ3       LYS  23  -4.779  -6.139   0.770
  187    H    THR  24           HN       THR  24 -11.156  -8.236   3.349
  188    HA   THR  24           HA       THR  24  -9.926  -9.631   1.011
  189    HB   THR  24           HB       THR  24 -12.388  -9.637   0.232
  190    HG1  THR  24           HG1      THR  24 -12.659  -8.929   2.966
  191   1HG2  THR  24          HG21      THR  24 -11.450 -11.115   2.707
  192   2HG2  THR  24          HG22      THR  24 -11.342 -11.659   1.033
  193   3HG2  THR  24          HG23      THR  24 -12.916 -11.535   1.819
  194    H    GLU  25           HN       GLU  25 -11.384  -8.654  -1.086
  195    HA   GLU  25           HA       GLU  25 -10.306  -5.894  -1.298
  196   1HB   GLU  25          HB2       GLU  25 -10.855  -6.203  -3.741
  197   2HB   GLU  25          HB1       GLU  25  -9.665  -7.335  -3.101
  198   1HG   GLU  25          HG2       GLU  25 -12.597  -8.053  -3.128
  199   2HG   GLU  25          HG1       GLU  25 -11.608  -8.271  -4.571
  200    H    LYS  26           HN       LYS  26 -13.241  -7.186  -0.423
  201    HA   LYS  26           HA       LYS  26 -14.911  -5.323  -1.965
  202   1HB   LYS  26          HB2       LYS  26 -16.758  -6.178  -0.515
  203   2HB   LYS  26          HB1       LYS  26 -15.893  -7.462  -1.354
  204   1HG   LYS  26          HG2       LYS  26 -14.444  -7.552   0.844
  205   2HG   LYS  26          HG1       LYS  26 -15.817  -6.718   1.564
  206   1HD   LYS  26          HD2       LYS  26 -16.149  -9.084   1.888
  207   2HD   LYS  26          HD1       LYS  26 -17.301  -8.544   0.672
  208   1HE   LYS  26          HE2       LYS  26 -14.681  -9.481  -0.404
  209   2HE   LYS  26          HE1       LYS  26 -15.690 -10.722   0.335
  210   1HZ   LYS  26          HZ1       LYS  26 -15.965  -9.933  -2.176
  211   2HZ   LYS  26          HZ2       LYS  26 -17.050  -8.858  -1.430
  212   3HZ   LYS  26          HZ3       LYS  26 -17.251 -10.536  -1.249
  213    H    GLU  27           HN       GLU  27 -13.299  -5.475   1.125
  214    HA   GLU  27           HA       GLU  27 -14.703  -3.139   2.187
  215   1HB   GLU  27          HB2       GLU  27 -12.188  -4.516   3.178
  216   2HB   GLU  27          HB1       GLU  27 -13.155  -3.346   4.076
  217   1HG   GLU  27          HG2       GLU  27 -15.102  -4.887   3.942
  218   2HG   GLU  27          HG1       GLU  27 -14.085  -6.069   3.120
  219    H    ILE  28           HN       ILE  28 -12.038  -3.803   0.145
  220    HA   ILE  28           HA       ILE  28 -10.641  -1.275   0.657
  221    HB   ILE  28           HB       ILE  28 -10.319  -3.362  -1.518
  222   1HG1  ILE  28          HG12      ILE  28  -9.795  -4.309   0.660
  223   2HG1  ILE  28          HG11      ILE  28  -8.291  -4.018  -0.206
  224   1HG2  ILE  28          HG21      ILE  28  -8.725  -0.917  -0.768
  225   2HG2  ILE  28          HG22      ILE  28  -9.429  -1.326  -2.332
  226   3HG2  ILE  28          HG23      ILE  28  -8.048  -2.231  -1.726
  227   1HD1  ILE  28          HD11      ILE  28  -8.371  -1.694   1.059
  228   2HD1  ILE  28          HD12      ILE  28  -7.777  -3.136   1.878
  229   3HD1  ILE  28          HD13      ILE  28  -9.423  -2.577   2.164
  230    H    LEU  29           HN       LEU  29 -11.808  -2.644  -2.421
  231    HA   LEU  29           HA       LEU  29 -12.025  -0.260  -3.824
  232   1HB   LEU  29          HB2       LEU  29 -13.926  -2.618  -3.994
  233   2HB   LEU  29          HB1       LEU  29 -13.723  -1.381  -5.233
  234    HG   LEU  29           HG       LEU  29 -11.347  -2.965  -4.239
  235   1HD1  LEU  29          HD11      LEU  29 -13.393  -3.780  -6.307
  236   2HD1  LEU  29          HD12      LEU  29 -12.818  -4.706  -4.919
  237   3HD1  LEU  29          HD13      LEU  29 -11.750  -4.425  -6.296
  238   1HD2  LEU  29          HD21      LEU  29 -10.599  -2.487  -6.622
  239   2HD2  LEU  29          HD22      LEU  29 -10.772  -1.059  -5.605
  240   3HD2  LEU  29          HD23      LEU  29 -12.018  -1.454  -6.789
  241    H    ASP  30           HN       ASP  30 -14.207  -1.524  -1.360
  242    HA   ASP  30           HA       ASP  30 -16.283   0.461  -1.877
  243   1HB   ASP  30          HB2       ASP  30 -15.679  -1.314   0.509
  244   2HB   ASP  30          HB1       ASP  30 -17.063  -0.223   0.442
  245    H    ALA  31           HN       ALA  31 -13.654   0.095   0.518
  246    HA   ALA  31           HA       ALA  31 -13.960   2.434   2.001
  247   1HB   ALA  31          HB1       ALA  31 -12.153   0.821   2.420
  248   2HB   ALA  31          HB2       ALA  31 -11.530   2.464   2.281
  249   3HB   ALA  31          HB3       ALA  31 -11.352   1.335   0.934
  250    H    PHE  32           HN       PHE  32 -12.178   2.142  -1.099
  251    HA   PHE  32           HA       PHE  32 -11.583   4.880  -1.402
  252   1HB   PHE  32          HB2       PHE  32 -12.240   2.744  -3.451
  253   2HB   PHE  32          HB1       PHE  32 -11.809   4.387  -3.922
  254    HD1  PHE  32           HD1      PHE  32 -10.582   1.192  -2.695
  255    HD2  PHE  32           HD2      PHE  32  -9.572   5.332  -3.237
  256    HE1  PHE  32           HE1      PHE  32  -8.179   0.641  -2.431
  257    HE2  PHE  32           HE2      PHE  32  -7.171   4.779  -2.965
  258    HZ   PHE  32           HZ       PHE  32  -6.477   2.433  -2.564
  259    H    ASP  33           HN       ASP  33 -14.614   3.120  -2.078
  260    HA   ASP  33           HA       ASP  33 -15.964   5.365  -3.240
  261   1HB   ASP  33          HB2       ASP  33 -16.716   2.890  -3.205
  262   2HB   ASP  33          HB1       ASP  33 -17.334   3.232  -1.590
  263    H    LYS  34           HN       LYS  34 -14.649   5.031  -0.240
  264    HA   LYS  34           HA       LYS  34 -16.670   6.851   1.051
  265   1HB   LYS  34          HB2       LYS  34 -14.529   5.187   2.428
  266   2HB   LYS  34          HB1       LYS  34 -15.855   6.066   3.194
  267   1HG   LYS  34          HG2       LYS  34 -17.497   4.612   2.127
  268   2HG   LYS  34          HG1       LYS  34 -16.221   3.790   1.234
  269   1HD   LYS  34          HD2       LYS  34 -15.237   3.370   3.689
  270   2HD   LYS  34          HD1       LYS  34 -16.919   3.611   4.153
  271   1HE   LYS  34          HE2       LYS  34 -16.090   1.652   1.997
  272   2HE   LYS  34          HE1       LYS  34 -16.235   1.205   3.692
  273   1HZ   LYS  34          HZ1       LYS  34 -18.368   0.853   3.226
  274   2HZ   LYS  34          HZ2       LYS  34 -18.289   1.688   1.749
  275   3HZ   LYS  34          HZ3       LYS  34 -18.541   2.540   3.197
  276    H    MET  35           HN       MET  35 -13.120   6.276   1.359
  277    HA   MET  35           HA       MET  35 -12.657   8.994   2.209
  278   1HB   MET  35          HB2       MET  35 -10.517   7.323   0.887
  279   2HB   MET  35          HB1       MET  35 -10.345   8.512   2.168
  280   1HG   MET  35          HG2       MET  35 -10.992   7.026   3.829
  281   2HG   MET  35          HG1       MET  35 -11.999   6.073   2.748
  282   1HE   MET  35          HE1       MET  35 -10.054   3.707   0.955
  283   2HE   MET  35          HE2       MET  35  -9.687   5.255   0.191
  284   3HE   MET  35          HE3       MET  35 -11.284   4.967   0.862
  285    H    CYS  36           HN       CYS  36 -12.126   7.313  -0.878
  286    HA   CYS  36           HA       CYS  36 -11.334   9.757  -2.263
  287   1HB   CYS  36          HB2       CYS  36 -10.623   7.382  -2.849
  288   2HB   CYS  36          HB1       CYS  36 -12.253   7.123  -3.457
  289    H    SER  37           HN       SER  37 -14.161   8.971  -0.946
  290    HA   SER  37           HA       SER  37 -15.910   9.746  -3.213
  291   1HB   SER  37          HB2       SER  37 -17.326   8.339  -2.132
  292   2HB   SER  37          HB1       SER  37 -16.227   8.243  -0.765
  293    HG   SER  37           HG       SER  37 -18.516   9.685  -1.083
  294    H    LYS  38           HN       LYS  38 -14.714  10.910  -0.110
  295    HA   LYS  38           HA       LYS  38 -16.156  13.504  -0.492
  296   1HB   LYS  38          HB2       LYS  38 -15.682  13.895   1.871
  297   2HB   LYS  38          HB1       LYS  38 -16.433  12.309   1.684
  298   1HG   LYS  38          HG2       LYS  38 -14.059  11.356   1.576
  299   2HG   LYS  38          HG1       LYS  38 -13.509  12.935   2.136
  300   1HD   LYS  38          HD2       LYS  38 -15.165  12.677   4.066
  301   2HD   LYS  38          HD1       LYS  38 -15.328  10.991   3.570
  302   1HE   LYS  38          HE2       LYS  38 -12.915  10.650   3.852
  303   2HE   LYS  38          HE1       LYS  38 -12.713  12.345   4.294
  304   1HZ   LYS  38          HZ1       LYS  38 -12.839  11.202   6.309
  305   2HZ   LYS  38          HZ2       LYS  38 -14.118  10.213   5.787
  306   3HZ   LYS  38          HZ3       LYS  38 -14.390  11.858   6.111
  307    H    LEU  39           HN       LEU  39 -13.689  12.725  -2.013
  308    HA   LEU  39           HA       LEU  39 -11.804  14.790  -0.924
  309   1HB   LEU  39          HB2       LEU  39 -10.246  13.109  -1.097
  310   2HB   LEU  39          HB1       LEU  39 -11.454  12.042  -1.780
  311    HG   LEU  39           HG       LEU  39 -10.044  14.072  -3.494
  312   1HD1  LEU  39          HD11      LEU  39  -9.076  11.384  -2.574
  313   2HD1  LEU  39          HD12      LEU  39  -8.180  12.896  -2.725
  314   3HD1  LEU  39          HD13      LEU  39  -8.630  11.990  -4.171
  315   1HD2  LEU  39          HD21      LEU  39 -10.882  11.431  -4.520
  316   2HD2  LEU  39          HD22      LEU  39 -11.069  13.038  -5.222
  317   3HD2  LEU  39          HD23      LEU  39 -12.206  12.477  -4.011
  318    HA   PRO  40           HA       PRO  40 -12.860  17.590  -4.120
  319   1HB   PRO  40          HB2       PRO  40 -10.109  17.518  -5.239
  320   2HB   PRO  40          HB1       PRO  40 -11.047  18.895  -4.635
  321   1HG   PRO  40          HG2       PRO  40  -8.972  17.572  -3.228
  322   2HG   PRO  40          HG1       PRO  40 -10.138  18.703  -2.525
  323   1HD   PRO  40          HD2       PRO  40  -9.949  15.862  -2.051
  324   2HD   PRO  40          HD1       PRO  40 -11.132  16.989  -1.365
  325    H    LYS  41           HN       LYS  41 -13.684  17.487  -6.140
  326    HA   LYS  41           HA       LYS  41 -14.078  15.092  -7.499
  327   1HB   LYS  41          HB2       LYS  41 -15.243  17.354  -7.766
  328   2HB   LYS  41          HB1       LYS  41 -13.940  17.764  -8.878
  329   1HG   LYS  41          HG2       LYS  41 -14.493  15.701 -10.196
  330   2HG   LYS  41          HG1       LYS  41 -15.875  15.447  -9.131
  331   1HD   LYS  41          HD2       LYS  41 -16.967  16.680 -10.750
  332   2HD   LYS  41          HD1       LYS  41 -16.348  18.028  -9.799
  333   1HE   LYS  41          HE2       LYS  41 -14.943  16.816 -12.205
  334   2HE   LYS  41          HE1       LYS  41 -15.901  18.295 -12.237
  335   1HZ   LYS  41          HZ1       LYS  41 -13.376  17.795 -10.777
  336   2HZ   LYS  41          HZ2       LYS  41 -14.380  19.121 -10.434
  337   3HZ   LYS  41          HZ3       LYS  41 -13.679  18.960 -11.972
  338    H    SER  42           HN       SER  42 -11.868  17.668  -8.544
  339    HA   SER  42           HA       SER  42 -10.644  16.456 -10.715
  340   1HB   SER  42          HB2       SER  42 -10.138  18.743  -9.674
  341   2HB   SER  42          HB1       SER  42  -9.048  17.890  -8.583
  342    HG   SER  42           HG       SER  42  -8.427  18.767 -10.899
  343    H    LEU  43           HN       LEU  43  -9.596  16.142  -7.331
  344    HA   LEU  43           HA       LEU  43  -7.694  14.047  -7.959
  345   1HB   LEU  43          HB2       LEU  43  -8.786  15.235  -5.410
  346   2HB   LEU  43          HB1       LEU  43  -7.763  13.801  -5.360
  347    HG   LEU  43           HG       LEU  43  -6.852  16.201  -6.940
  348   1HD1  LEU  43          HD11      LEU  43  -7.337  17.268  -4.876
  349   2HD1  LEU  43          HD12      LEU  43  -5.616  16.889  -4.796
  350   3HD1  LEU  43          HD13      LEU  43  -6.783  15.882  -3.937
  351   1HD2  LEU  43          HD21      LEU  43  -5.539  14.142  -7.119
  352   2HD2  LEU  43          HD22      LEU  43  -5.442  14.018  -5.364
  353   3HD2  LEU  43          HD23      LEU  43  -4.621  15.333  -6.201
  354    H    SER  44           HN       SER  44 -10.994  13.979  -8.019
  355    HA   SER  44           HA       SER  44 -11.299  11.332  -6.718
  356   1HB   SER  44          HB2       SER  44 -13.620  11.668  -6.842
  357   2HB   SER  44          HB1       SER  44 -12.997  13.279  -6.512
  358    HG   SER  44           HG       SER  44 -14.192  12.244  -8.780
  359    H    GLU  45           HN       GLU  45 -11.017  12.845  -9.828
  360    HA   GLU  45           HA       GLU  45 -11.911  10.438 -11.232
  361   1HB   GLU  45          HB2       GLU  45 -11.042  11.729 -13.274
  362   2HB   GLU  45          HB1       GLU  45 -12.410  12.437 -12.417
  363   1HG   GLU  45          HG2       GLU  45 -11.022  14.044 -11.329
  364   2HG   GLU  45          HG1       GLU  45  -9.549  13.200 -11.810
  365    H    GLU  46           HN       GLU  46  -8.911  12.048 -10.335
  366    HA   GLU  46           HA       GLU  46  -7.262  10.093 -11.784
  367   1HB   GLU  46          HB2       GLU  46  -6.637  12.387  -9.915
  368   2HB   GLU  46          HB1       GLU  46  -5.388  11.299 -10.520
  369   1HG   GLU  46          HG2       GLU  46  -7.308  12.761 -12.346
  370   2HG   GLU  46          HG1       GLU  46  -5.739  13.420 -11.884
  371    H    CYS  47           HN       CYS  47  -8.688  10.425  -8.653
  372    HA   CYS  47           HA       CYS  47  -6.836   8.651  -7.258
  373   1HB   CYS  47          HB2       CYS  47  -7.962  10.139  -5.835
  374   2HB   CYS  47          HB1       CYS  47  -9.485   9.908  -6.683
  375    H    GLN  48           HN       GLN  48  -9.913   8.331  -8.972
  376    HA   GLN  48           HA       GLN  48 -10.227   5.523  -8.188
  377   1HB   GLN  48          HB2       GLN  48 -11.712   7.428 -10.007
  378   2HB   GLN  48          HB1       GLN  48 -12.068   5.698 -10.023
  379   1HG   GLN  48          HG2       GLN  48 -12.045   7.320  -7.470
  380   2HG   GLN  48          HG1       GLN  48 -13.498   7.124  -8.450
  381   1HE2  GLN  48          HE21      GLN  48 -12.718   6.004  -5.682
  382   2HE2  GLN  48          HE22      GLN  48 -13.000   4.336  -5.823
  383    H    GLU  49           HN       GLU  49  -8.717   7.432 -10.614
  384    HA   GLU  49           HA       GLU  49  -8.615   5.494 -12.689
  385   1HB   GLU  49          HB2       GLU  49  -8.008   8.016 -12.762
  386   2HB   GLU  49          HB1       GLU  49  -6.426   7.508 -12.176
  387   1HG   GLU  49          HG2       GLU  49  -7.770   6.420 -14.666
  388   2HG   GLU  49          HG1       GLU  49  -6.524   7.666 -14.664
  389    H    VAL  50           HN       VAL  50  -6.264   6.342 -10.126
  390    HA   VAL  50           HA       VAL  50  -4.435   4.243 -10.801
  391    HB   VAL  50           HB       VAL  50  -4.802   5.471  -8.064
  392   1HG1  VAL  50          HG11      VAL  50  -3.375   3.559  -7.998
  393   2HG1  VAL  50          HG12      VAL  50  -2.298   4.953  -8.035
  394   3HG1  VAL  50          HG13      VAL  50  -2.568   4.008  -9.502
  395   1HG2  VAL  50          HG21      VAL  50  -2.859   6.953  -8.961
  396   2HG2  VAL  50          HG22      VAL  50  -4.500   7.346  -9.469
  397   3HG2  VAL  50          HG23      VAL  50  -3.424   6.472 -10.561
  398    H    VAL  51           HN       VAL  51  -7.089   4.421  -8.409
  399    HA   VAL  51           HA       VAL  51  -6.813   2.013  -7.036
  400    HB   VAL  51           HB       VAL  51  -9.300   3.316  -8.203
  401   1HG1  VAL  51          HG11      VAL  51  -9.919   1.016  -7.898
  402   2HG1  VAL  51          HG12      VAL  51 -10.535   1.895  -6.500
  403   3HG1  VAL  51          HG13      VAL  51  -9.069   0.930  -6.356
  404   1HG2  VAL  51          HG21      VAL  51  -8.503   3.127  -5.297
  405   2HG2  VAL  51          HG22      VAL  51  -9.557   4.305  -6.082
  406   3HG2  VAL  51          HG23      VAL  51  -7.815   4.374  -6.335
  407    H    ASP  52           HN       ASP  52  -8.516   2.336 -10.189
  408    HA   ASP  52           HA       ASP  52  -8.884  -0.411 -10.693
  409   1HB   ASP  52          HB2       ASP  52  -8.189   1.807 -12.650
  410   2HB   ASP  52          HB1       ASP  52  -8.779   0.211 -13.118
  411    H    THR  53           HN       THR  53  -6.032   1.649 -11.080
  412    HA   THR  53           HA       THR  53  -4.419  -0.519 -12.168
  413    HB   THR  53           HB       THR  53  -3.606   2.205 -11.258
  414    HG1  THR  53           HG1      THR  53  -3.827   2.764 -13.319
  415   1HG2  THR  53          HG21      THR  53  -1.517   1.777 -12.436
  416   2HG2  THR  53          HG22      THR  53  -2.092   0.181 -12.912
  417   3HG2  THR  53          HG23      THR  53  -1.752   0.525 -11.219
  418    H    TYR  54           HN       TYR  54  -5.207   0.720  -9.063
  419    HA   TYR  54           HA       TYR  54  -3.337  -1.267  -7.818
  420   1HB   TYR  54          HB2       TYR  54  -3.941   1.558  -6.928
  421   2HB   TYR  54          HB1       TYR  54  -3.221   0.351  -5.867
  422    HD1  TYR  54           HD1      TYR  54  -2.794   1.752  -9.275
  423    HD2  TYR  54           HD2      TYR  54  -0.883   0.202  -5.794
  424    HE1  TYR  54           HE1      TYR  54  -0.613   2.330 -10.263
  425    HE2  TYR  54           HE2      TYR  54   1.336   0.747  -6.764
  426    HH   TYR  54           HH       TYR  54   1.610   2.137 -10.039
  427    H    GLY  55           HN       GLY  55  -5.556  -2.424  -8.126
  428   1HA   GLY  55          HA2       GLY  55  -7.188  -1.987  -5.652
  429   2HA   GLY  55          HA1       GLY  55  -7.969  -2.254  -7.213
  430    H    SER  56           HN       SER  56  -7.095  -4.340  -8.364
  431    HA   SER  56           HA       SER  56  -7.401  -6.520  -6.401
  432   1HB   SER  56          HB2       SER  56  -6.959  -6.926  -9.352
  433   2HB   SER  56          HB1       SER  56  -7.880  -7.914  -8.220
  434    HG   SER  56           HG       SER  56  -9.046  -6.412  -9.723
  435    H    SER  57           HN       SER  57  -4.802  -4.903  -7.951
  436    HA   SER  57           HA       SER  57  -2.968  -7.228  -7.731
  437   1HB   SER  57          HB2       SER  57  -2.457  -4.364  -8.601
  438   2HB   SER  57          HB1       SER  57  -1.245  -5.647  -8.588
  439    HG   SER  57           HG       SER  57  -3.721  -5.797  -9.979
  440    H    ILE  58           HN       ILE  58  -2.825  -3.827  -6.677
  441    HA   ILE  58           HA       ILE  58  -0.944  -3.732  -4.748
  442    HB   ILE  58           HB       ILE  58  -2.559  -1.948  -5.233
  443   1HG1  ILE  58          HG12      ILE  58  -2.240  -2.706  -2.317
  444   2HG1  ILE  58          HG11      ILE  58  -1.218  -1.608  -3.257
  445   1HG2  ILE  58          HG21      ILE  58  -4.486  -3.109  -3.287
  446   2HG2  ILE  58          HG22      ILE  58  -4.539  -3.653  -4.971
  447   3HG2  ILE  58          HG23      ILE  58  -4.775  -1.955  -4.574
  448   1HD1  ILE  58          HD11      ILE  58  -4.063  -1.179  -2.323
  449   2HD1  ILE  58          HD12      ILE  58  -3.363  -0.208  -3.619
  450   3HD1  ILE  58          HD13      ILE  58  -2.649  -0.170  -2.005
  451    H    LEU  59           HN       LEU  59  -4.106  -5.236  -4.265
  452    HA   LEU  59           HA       LEU  59  -3.349  -6.154  -1.579
  453   1HB   LEU  59          HB2       LEU  59  -5.720  -7.303  -3.049
  454   2HB   LEU  59          HB1       LEU  59  -5.520  -6.999  -1.326
  455    HG   LEU  59           HG       LEU  59  -5.705  -4.835  -3.393
  456   1HD1  LEU  59          HD11      LEU  59  -8.031  -4.530  -2.475
  457   2HD1  LEU  59          HD12      LEU  59  -7.837  -6.100  -1.694
  458   3HD1  LEU  59          HD13      LEU  59  -7.791  -5.976  -3.456
  459   1HD2  LEU  59          HD21      LEU  59  -6.065  -4.736  -0.393
  460   2HD2  LEU  59          HD22      LEU  59  -6.069  -3.363  -1.493
  461   3HD2  LEU  59          HD23      LEU  59  -4.587  -4.263  -1.225
  462    H    SER  60           HN       SER  60  -3.854  -7.639  -4.785
  463    HA   SER  60           HA       SER  60  -3.120 -10.298  -3.830
  464   1HB   SER  60          HB2       SER  60  -3.344  -9.321  -6.680
  465   2HB   SER  60          HB1       SER  60  -3.401 -10.992  -6.127
  466    HG   SER  60           HG       SER  60  -5.408 -10.718  -5.534
  467    H    ILE  61           HN       ILE  61  -1.265  -7.641  -4.384
  468    HA   ILE  61           HA       ILE  61   1.016  -9.150  -5.575
  469    HB   ILE  61           HB       ILE  61  -0.022  -6.835  -6.326
  470   1HG1  ILE  61          HG12      ILE  61   1.969  -8.038  -7.294
  471   2HG1  ILE  61          HG11      ILE  61   1.978  -6.299  -7.485
  472   1HG2  ILE  61          HG21      ILE  61   1.204  -4.900  -5.482
  473   2HG2  ILE  61          HG22      ILE  61   1.999  -5.904  -4.275
  474   3HG2  ILE  61          HG23      ILE  61   0.250  -5.673  -4.231
  475   1HD1  ILE  61          HD11      ILE  61   4.181  -7.272  -6.764
  476   2HD1  ILE  61          HD12      ILE  61   3.417  -7.742  -5.248
  477   3HD1  ILE  61          HD13      ILE  61   3.544  -6.037  -5.680
  478    H    LEU  62           HN       LEU  62   0.474  -6.813  -2.923
  479    HA   LEU  62           HA       LEU  62   2.943  -7.139  -1.619
  480   1HB   LEU  62          HB2       LEU  62   0.258  -6.661  -0.327
  481   2HB   LEU  62          HB1       LEU  62   1.830  -6.341   0.408
  482    HG   LEU  62           HG       LEU  62   0.822  -5.080  -2.145
  483   1HD1  LEU  62          HD11      LEU  62  -0.412  -4.279  -0.177
  484   2HD1  LEU  62          HD12      LEU  62   0.648  -3.013  -0.800
  485   3HD1  LEU  62          HD13      LEU  62   1.111  -3.925   0.638
  486   1HD2  LEU  62          HD21      LEU  62   2.855  -3.499  -1.443
  487   2HD2  LEU  62          HD22      LEU  62   3.093  -4.942  -2.425
  488   3HD2  LEU  62          HD23      LEU  62   3.428  -4.991  -0.692
  489    H    LEU  63           HN       LEU  63   0.920  -9.609  -2.289
  490    HA   LEU  63           HA       LEU  63   1.229 -11.056   0.258
  491   1HB   LEU  63          HB2       LEU  63   0.162 -12.250  -2.288
  492   2HB   LEU  63          HB1       LEU  63  -0.296 -12.599  -0.620
  493    HG   LEU  63           HG       LEU  63  -1.010 -10.183  -2.292
  494   1HD1  LEU  63          HD11      LEU  63  -2.458 -12.110  -2.558
  495   2HD1  LEU  63          HD12      LEU  63  -3.314 -10.890  -1.612
  496   3HD1  LEU  63          HD13      LEU  63  -2.605 -12.289  -0.810
  497   1HD2  LEU  63          HD21      LEU  63  -0.631  -9.072  -0.276
  498   2HD2  LEU  63          HD22      LEU  63  -0.971 -10.500   0.701
  499   3HD2  LEU  63          HD23      LEU  63  -2.292  -9.595  -0.029
  500    H    GLU  64           HN       GLU  64   2.080 -11.696  -3.180
  501    HA   GLU  64           HA       GLU  64   4.418 -13.320  -2.188
  502   1HB   GLU  64          HB2       GLU  64   2.501 -13.929  -4.445
  503   2HB   GLU  64          HB1       GLU  64   3.950 -14.866  -4.070
  504   1HG   GLU  64          HG2       GLU  64   3.076 -15.417  -1.860
  505   2HG   GLU  64          HG1       GLU  64   1.668 -14.388  -2.131
  506    H    GLU  65           HN       GLU  65   3.088 -11.996  -5.245
  507    HA   GLU  65           HA       GLU  65   5.355 -11.997  -6.785
  508   1HB   GLU  65          HB2       GLU  65   3.570  -9.577  -6.682
  509   2HB   GLU  65          HB1       GLU  65   4.428 -10.222  -8.079
  510   1HG   GLU  65          HG2       GLU  65   3.039 -12.342  -7.791
  511   2HG   GLU  65          HG1       GLU  65   2.054 -11.432  -6.645
  512    H    VAL  66           HN       VAL  66   4.929 -10.230  -3.942
  513    HA   VAL  66           HA       VAL  66   7.645  -9.080  -4.233
  514    HB   VAL  66           HB       VAL  66   5.835  -7.475  -5.088
  515   1HG1  VAL  66          HG11      VAL  66   4.340  -8.086  -3.105
  516   2HG1  VAL  66          HG12      VAL  66   4.415  -6.394  -3.565
  517   3HG1  VAL  66          HG13      VAL  66   5.323  -6.969  -2.170
  518   1HG2  VAL  66          HG21      VAL  66   7.907  -6.846  -2.994
  519   2HG2  VAL  66          HG22      VAL  66   6.872  -5.552  -3.591
  520   3HG2  VAL  66          HG23      VAL  66   7.900  -6.440  -4.710
  521    H    SER  67           HN       SER  67   8.704  -9.481  -2.340
  522    HA   SER  67           HA       SER  67   7.274 -10.454  -0.021
  523   1HB   SER  67          HB2       SER  67  10.151  -9.792  -0.618
  524   2HB   SER  67          HB1       SER  67   9.655 -10.172   1.028
  525    HG   SER  67           HG       SER  67   9.209 -12.187   0.443
  526    HA   PRO  68           HA       PRO  68   6.364  -6.605   1.970
  527   1HB   PRO  68          HB2       PRO  68   7.266  -7.341   4.604
  528   2HB   PRO  68          HB1       PRO  68   5.604  -7.358   3.980
  529   1HG   PRO  68          HG2       PRO  68   7.407  -9.628   4.467
  530   2HG   PRO  68          HG1       PRO  68   5.674  -9.649   4.109
  531   1HD   PRO  68          HD2       PRO  68   7.739 -10.418   2.336
  532   2HD   PRO  68          HD1       PRO  68   6.046 -10.108   1.900
  533    H    GLU  69           HN       GLU  69   9.548  -8.021   2.130
  534    HA   GLU  69           HA       GLU  69  10.770  -5.594   3.234
  535   1HB   GLU  69          HB2       GLU  69  11.770  -7.841   3.630
  536   2HB   GLU  69          HB1       GLU  69  12.096  -7.983   1.904
  537   1HG   GLU  69          HG2       GLU  69  13.107  -5.616   3.488
  538   2HG   GLU  69          HG1       GLU  69  14.011  -7.129   3.438
  539    H    LEU  70           HN       LEU  70  10.697  -7.182   0.020
  540    HA   LEU  70           HA       LEU  70  12.179  -5.144  -1.321
  541   1HB   LEU  70          HB2       LEU  70  11.834  -7.175  -2.520
  542   2HB   LEU  70          HB1       LEU  70  10.101  -7.152  -2.224
  543    HG   LEU  70           HG       LEU  70   9.877  -5.170  -3.709
  544   1HD1  LEU  70          HD11      LEU  70  12.861  -5.611  -4.098
  545   2HD1  LEU  70          HD12      LEU  70  12.093  -4.173  -3.432
  546   3HD1  LEU  70          HD13      LEU  70  11.871  -4.580  -5.130
  547   1HD2  LEU  70          HD21      LEU  70   9.874  -7.648  -4.509
  548   2HD2  LEU  70          HD22      LEU  70  11.453  -7.276  -5.198
  549   3HD2  LEU  70          HD23      LEU  70  10.028  -6.382  -5.727
  550    H    VAL  71           HN       VAL  71   9.004  -5.249  -0.016
  551    HA   VAL  71           HA       VAL  71   7.805  -3.234  -1.683
  552    HB   VAL  71           HB       VAL  71   7.178  -4.270   1.084
  553   1HG1  VAL  71          HG11      VAL  71   4.913  -3.145   0.593
  554   2HG1  VAL  71          HG12      VAL  71   5.790  -2.187  -0.599
  555   3HG1  VAL  71          HG13      VAL  71   6.238  -2.102   1.105
  556   1HG2  VAL  71          HG21      VAL  71   6.963  -5.668  -1.105
  557   2HG2  VAL  71          HG22      VAL  71   5.595  -4.615  -1.459
  558   3HG2  VAL  71          HG23      VAL  71   5.582  -5.617  -0.006
  559    H    CYS  72           HN       CYS  72   8.904  -2.975   1.729
  560    HA   CYS  72           HA       CYS  72   8.794  -0.178   1.936
  561   1HB   CYS  72          HB2       CYS  72   9.420  -1.592   3.852
  562   2HB   CYS  72          HB1       CYS  72  10.971  -1.954   3.088
  563    H    SER  73           HN       SER  73  10.920  -2.133   0.051
  564    HA   SER  73           HA       SER  73  12.840   0.039  -0.466
  565   1HB   SER  73          HB2       SER  73  12.471  -2.755  -1.570
  566   2HB   SER  73          HB1       SER  73  13.635  -1.629  -2.259
  567    HG   SER  73           HG       SER  73  13.503  -2.583   0.414
  568    H    MET  74           HN       MET  74  10.463  -1.837  -2.387
  569    HA   MET  74           HA       MET  74  10.499  -0.263  -4.730
  570   1HB   MET  74          HB2       MET  74   9.098  -2.420  -4.150
  571   2HB   MET  74          HB1       MET  74   7.881  -1.267  -3.610
  572   1HG   MET  74          HG2       MET  74   8.306  -0.146  -5.953
  573   2HG   MET  74          HG1       MET  74   8.959  -1.728  -6.378
  574   1HE   MET  74          HE1       MET  74   7.758  -3.865  -5.389
  575   2HE   MET  74          HE2       MET  74   6.009  -4.087  -5.362
  576   3HE   MET  74          HE3       MET  74   6.806  -3.264  -4.023
  577    H    LEU  75           HN       LEU  75   8.567   0.159  -1.769
  578    HA   LEU  75           HA       LEU  75   7.192   2.523  -2.583
  579   1HB   LEU  75          HB2       LEU  75   8.069   1.743   0.220
  580   2HB   LEU  75          HB1       LEU  75   6.812   2.910  -0.180
  581    HG   LEU  75           HG       LEU  75   6.731  -0.026  -0.948
  582   1HD1  LEU  75          HD11      LEU  75   5.377   1.486   1.300
  583   2HD1  LEU  75          HD12      LEU  75   6.559   0.187   1.466
  584   3HD1  LEU  75          HD13      LEU  75   4.958  -0.155   0.810
  585   1HD2  LEU  75          HD21      LEU  75   4.224   0.671  -1.218
  586   2HD2  LEU  75          HD22      LEU  75   5.360   1.097  -2.494
  587   3HD2  LEU  75          HD23      LEU  75   4.861   2.313  -1.317
  588    H    HIS  76           HN       HIS  76  10.434   1.970  -1.380
  589    HA   HIS  76           HA       HIS  76  12.183   3.467  -0.897
  590   1HB   HIS  76          HB2       HIS  76  10.867   4.297  -3.462
  591   2HB   HIS  76          HB1       HIS  76  12.134   5.343  -2.818
  592    HD1  HIS  76           HD1      HIS  76  14.352   3.733  -1.980
  593    HD2  HIS  76           HD2      HIS  76  11.958   2.403  -5.124
  594    HE1  HIS  76           HE1      HIS  76  15.730   2.040  -3.264
  595    H    LEU  77           HN       LEU  77   9.925   4.000   0.744
  596    HA   LEU  77           HA       LEU  77   9.311   6.838   0.644
  597   1HB   LEU  77          HB2       LEU  77   8.070   6.500   2.667
  598   2HB   LEU  77          HB1       LEU  77   7.806   5.075   1.672
  599    HG   LEU  77           HG       LEU  77   9.815   5.249   3.951
  600   1HD1  LEU  77          HD11      LEU  77   7.025   4.114   3.745
  601   2HD1  LEU  77          HD12      LEU  77   7.643   5.276   4.918
  602   3HD1  LEU  77          HD13      LEU  77   8.166   3.593   4.984
  603   1HD2  LEU  77          HD21      LEU  77   9.676   2.683   3.606
  604   2HD2  LEU  77          HD22      LEU  77  10.616   3.603   2.436
  605   3HD2  LEU  77          HD23      LEU  77   8.987   3.065   2.029
  606    H    CYS  78           HN       CYS  78  11.812   4.892   2.076
  607    HA   CYS  78           HA       CYS  78  12.710   6.544   4.171
  608   1HB   CYS  78          HB2       CYS  78  14.293   4.881   2.190
  609   2HB   CYS  78          HB1       CYS  78  15.021   5.674   3.585
  610    H    SER  79           HN       SER  79  13.963   6.600   0.812
  611    HA   SER  79           HA       SER  79  15.236   9.176   1.221
  612   1HB   SER  79          HB2       SER  79  14.634   7.659  -1.335
  613   2HB   SER  79          HB1       SER  79  15.680   9.070  -1.214
  614    HG   SER  79           HG       SER  79  16.613   7.558   0.598
  615    H    GLY  80           HN       GLY  80  13.691  10.723   1.773
  616   1HA   GLY  80          HA2       GLY  80  11.241  11.026   0.173
  617   2HA   GLY  80          HA1       GLY  80  11.734  12.048   1.525
  618    H    LEU  81           HN       LEU  81  14.450  12.169   0.208
  619    HA   LEU  81           HA       LEU  81  13.860  14.134  -1.951
  620   1HB   LEU  81          HB2       LEU  81  16.029  15.269  -1.074
  621   2HB   LEU  81          HB1       LEU  81  14.537  15.546  -0.187
  622    HG   LEU  81           HG       LEU  81  16.526  15.022   1.262
  623   1HD1  LEU  81          HD11      LEU  81  15.161  14.144   2.833
  624   2HD1  LEU  81          HD12      LEU  81  14.777  12.721   1.871
  625   3HD1  LEU  81          HD13      LEU  81  13.902  14.227   1.606
  626   1HD2  LEU  81          HD21      LEU  81  16.262  12.170   0.274
  627   2HD2  LEU  81          HD22      LEU  81  17.511  12.854   1.308
  628   3HD2  LEU  81          HD23      LEU  81  17.449  13.289  -0.395
  629    H    VAL  82           HN       VAL  82  16.293  14.593  -2.927
  630    HA   VAL  82           HA       VAL  82  17.035  11.970  -3.954
  631    HB   VAL  82           HB       VAL  82  18.877  13.400  -5.141
  632   1HG1  VAL  82          HG11      VAL  82  16.863  12.468  -6.235
  633   2HG1  VAL  82          HG12      VAL  82  17.260  14.070  -6.859
  634   3HG1  VAL  82          HG13      VAL  82  15.936  13.875  -5.710
  635   1HG2  VAL  82          HG21      VAL  82  18.411  15.770  -5.248
  636   2HG2  VAL  82          HG22      VAL  82  18.493  15.332  -3.542
  637   3HG2  VAL  82          HG23      VAL  82  16.927  15.573  -4.316
  638    HA   PRO  83           HA       PRO  83  19.864  11.118  -0.652
  639   1HB   PRO  83          HB2       PRO  83  21.700   9.937  -2.665
  640   2HB   PRO  83          HB1       PRO  83  20.968   9.196  -1.231
  641   1HG   PRO  83          HG2       PRO  83  20.123   8.746  -3.865
  642   2HG   PRO  83          HG1       PRO  83  19.166   8.424  -2.412
  643   1HD   PRO  83          HD2       PRO  83  18.755  10.520  -4.425
  644   2HD   PRO  83          HD1       PRO  83  17.692  10.024  -3.082
  645    H    ARG  84           HN       ARG  84  21.185  12.699   0.183
  646    HA   ARG  84           HA       ARG  84  22.524  14.608  -1.565
  647   1HB   ARG  84          HB2       ARG  84  22.784  14.256   1.436
  648   2HB   ARG  84          HB1       ARG  84  23.240  15.682   0.504
  649   1HG   ARG  84          HG2       ARG  84  20.425  14.564   0.657
  650   2HG   ARG  84          HG1       ARG  84  21.011  15.916   1.625
  651   1HD   ARG  84          HD2       ARG  84  21.691  16.941  -0.700
  652   2HD   ARG  84          HD1       ARG  84  20.522  15.787  -1.342
  653    HE   ARG  84           HE       ARG  84  19.149  17.051   0.706
  654   1HH1  ARG  84          HH21      ARG  84  20.942  18.009  -2.080
  655   2HH1  ARG  84          HH22      ARG  84  20.015  19.449  -2.345
  656   1HH2  ARG  84          HH11      ARG  84  17.930  18.925   0.376
  657   2HH2  ARG  84          HH12      ARG  84  18.310  19.967  -0.954
  Start of MODEL    4
    1   1H    SER   1           HT1      SER   1  21.511   3.552  11.694
    2   2H    SER   1           HT2      SER   1  23.019   4.305  11.478
    3   3H    SER   1           HT3      SER   1  22.938   2.648  11.847
    4    HA   SER   1           HA       SER   1  22.004   3.938   9.342
    5   1HB   SER   1          HB2       SER   1  24.292   2.038   9.933
    6   2HB   SER   1          HB1       SER   1  23.807   2.564   8.324
    7    HG   SER   1           HG       SER   1  24.516   4.560   8.751
    8    H    ASP   2           HN       ASP   2  23.057   0.649  10.173
    9    HA   ASP   2           HA       ASP   2  20.812  -0.500   8.743
   10   1HB   ASP   2          HB2       ASP   2  22.727  -1.855  10.668
   11   2HB   ASP   2          HB1       ASP   2  21.717  -2.648   9.459
   12    H    VAL   3           HN       VAL   3  19.859   1.242  10.736
   13    HA   VAL   3           HA       VAL   3  18.921  -0.437  12.975
   14    HB   VAL   3           HB       VAL   3  18.343   2.443  12.348
   15   1HG1  VAL   3          HG11      VAL   3  17.974   0.788  14.855
   16   2HG1  VAL   3          HG12      VAL   3  16.689   1.450  13.846
   17   3HG1  VAL   3          HG13      VAL   3  17.736   2.533  14.762
   18   1HG2  VAL   3          HG21      VAL   3  20.738   2.107  12.692
   19   2HG2  VAL   3          HG22      VAL   3  20.416   1.181  14.159
   20   3HG2  VAL   3          HG23      VAL   3  20.049   2.905  14.106
   21    H    TYR   4           HN       TYR   4  17.426   1.652  10.491
   22    HA   TYR   4           HA       TYR   4  14.786   0.553  10.957
   23   1HB   TYR   4          HB2       TYR   4  16.026   2.425   8.963
   24   2HB   TYR   4          HB1       TYR   4  14.453   1.731   8.581
   25    HD1  TYR   4           HD1      TYR   4  13.174   3.758   8.742
   26    HD2  TYR   4           HD2      TYR   4  15.603   2.475  12.050
   27    HE1  TYR   4           HE1      TYR   4  12.067   5.421  10.208
   28    HE2  TYR   4           HE2      TYR   4  14.501   4.133  13.507
   29    HH   TYR   4           HH       TYR   4  13.186   6.001  13.502
   30    H    CYS   5           HN       CYS   5  17.444  -0.228   8.782
   31    HA   CYS   5           HA       CYS   5  16.073  -1.792   6.876
   32   1HB   CYS   5          HB2       CYS   5  18.728  -2.642   8.044
   33   2HB   CYS   5          HB1       CYS   5  18.158  -2.800   6.382
   34    H    GLU   6           HN       GLU   6  17.271  -2.703  10.103
   35    HA   GLU   6           HA       GLU   6  16.251  -5.428   9.869
   36   1HB   GLU   6          HB2       GLU   6  17.311  -3.855  12.230
   37   2HB   GLU   6          HB1       GLU   6  16.883  -5.565  12.287
   38   1HG   GLU   6          HG2       GLU   6  18.522  -6.017  10.476
   39   2HG   GLU   6          HG1       GLU   6  18.980  -4.314  10.489
   40    H    VAL   7           HN       VAL   7  15.344  -2.574  11.825
   41    HA   VAL   7           HA       VAL   7  13.042  -3.743  13.023
   42    HB   VAL   7           HB       VAL   7  13.469  -0.825  12.322
   43   1HG1  VAL   7          HG11      VAL   7  11.726  -2.241  14.357
   44   2HG1  VAL   7          HG12      VAL   7  11.186  -1.262  12.992
   45   3HG1  VAL   7          HG13      VAL   7  12.015  -0.501  14.349
   46   1HG2  VAL   7          HG21      VAL   7  15.322  -2.022  13.661
   47   2HG2  VAL   7          HG22      VAL   7  14.126  -2.182  14.946
   48   3HG2  VAL   7          HG23      VAL   7  14.618  -0.581  14.390
   49    H    CYS   8           HN       CYS   8  13.491  -2.251   9.860
   50    HA   CYS   8           HA       CYS   8  10.664  -1.943   9.340
   51   1HB   CYS   8          HB2       CYS   8  11.307  -1.439   7.063
   52   2HB   CYS   8          HB1       CYS   8  12.455  -0.663   8.149
   53    H    GLU   9           HN       GLU   9  13.011  -4.309   7.985
   54    HA   GLU   9           HA       GLU   9  11.138  -5.886   6.611
   55   1HB   GLU   9          HB2       GLU   9  12.646  -7.828   6.868
   56   2HB   GLU   9          HB1       GLU   9  13.516  -6.389   6.359
   57   1HG   GLU   9          HG2       GLU   9  14.671  -6.216   8.367
   58   2HG   GLU   9          HG1       GLU   9  13.344  -6.875   9.319
   59    H    PHE  10           HN       PHE  10  11.679  -5.716  10.054
   60    HA   PHE  10           HA       PHE  10  10.293  -8.190  10.669
   61   1HB   PHE  10          HB2       PHE  10  11.943  -7.172  12.200
   62   2HB   PHE  10          HB1       PHE  10  10.864  -5.797  12.438
   63    HD1  PHE  10           HD1      PHE  10  11.048  -9.516  12.766
   64    HD2  PHE  10           HD2      PHE  10   9.143  -5.889  14.056
   65    HE1  PHE  10           HE1      PHE  10   9.839 -10.777  14.526
   66    HE2  PHE  10           HE2      PHE  10   7.933  -7.150  15.815
   67    HZ   PHE  10           HZ       PHE  10   8.281  -9.592  16.051
   68    H    LEU  11           HN       LEU  11   9.286  -4.768  10.546
   69    HA   LEU  11           HA       LEU  11   6.630  -5.387  11.582
   70   1HB   LEU  11          HB2       LEU  11   7.571  -2.901  10.127
   71   2HB   LEU  11          HB1       LEU  11   6.111  -3.051  11.100
   72    HG   LEU  11           HG       LEU  11   8.879  -3.566  12.200
   73   1HD1  LEU  11          HD11      LEU  11   7.268  -1.008  12.104
   74   2HD1  LEU  11          HD12      LEU  11   8.905  -1.274  11.501
   75   3HD1  LEU  11          HD13      LEU  11   8.595  -1.264  13.238
   76   1HD2  LEU  11          HD21      LEU  11   7.575  -2.954  14.358
   77   2HD2  LEU  11          HD22      LEU  11   7.255  -4.529  13.639
   78   3HD2  LEU  11          HD23      LEU  11   6.121  -3.203  13.393
   79    H    VAL  12           HN       VAL  12   7.763  -4.318   8.347
   80    HA   VAL  12           HA       VAL  12   5.271  -4.608   7.053
   81    HB   VAL  12           HB       VAL  12   7.213  -3.499   6.061
   82   1HG1  VAL  12          HG11      VAL  12   8.784  -5.378   6.901
   83   2HG1  VAL  12          HG12      VAL  12   9.140  -4.628   5.344
   84   3HG1  VAL  12          HG13      VAL  12   8.347  -6.200   5.404
   85   1HG2  VAL  12          HG21      VAL  12   5.292  -4.566   4.695
   86   2HG2  VAL  12          HG22      VAL  12   6.480  -5.790   4.254
   87   3HG2  VAL  12          HG23      VAL  12   6.755  -4.106   3.828
   88    H    LYS  13           HN       LYS  13   7.650  -7.027   7.944
   89    HA   LYS  13           HA       LYS  13   6.420  -9.148   6.312
   90   1HB   LYS  13          HB2       LYS  13   8.820  -9.160   6.826
   91   2HB   LYS  13          HB1       LYS  13   8.458  -9.264   8.545
   92   1HG   LYS  13          HG2       LYS  13   7.008 -11.392   7.240
   93   2HG   LYS  13          HG1       LYS  13   8.652 -11.424   6.615
   94   1HD   LYS  13          HD2       LYS  13   8.703 -12.815   8.532
   95   2HD   LYS  13          HD1       LYS  13   9.416 -11.294   9.071
   96   1HE   LYS  13          HE2       LYS  13   7.301 -10.608  10.071
   97   2HE   LYS  13          HE1       LYS  13   6.498 -12.041   9.430
   98   1HZ   LYS  13          HZ1       LYS  13   7.029 -12.535  11.646
   99   2HZ   LYS  13          HZ2       LYS  13   8.601 -11.903  11.509
  100   3HZ   LYS  13          HZ3       LYS  13   8.192 -13.354  10.723
  101    H    GLU  14           HN       GLU  14   6.241  -8.025   9.678
  102    HA   GLU  14           HA       GLU  14   4.680 -10.337  10.551
  103   1HB   GLU  14          HB2       GLU  14   6.081  -8.887  12.089
  104   2HB   GLU  14          HB1       GLU  14   4.876  -7.617  11.880
  105   1HG   GLU  14          HG2       GLU  14   4.275  -8.789  13.882
  106   2HG   GLU  14          HG1       GLU  14   3.134  -9.309  12.641
  107    H    VAL  15           HN       VAL  15   3.858  -6.880  10.201
  108    HA   VAL  15           HA       VAL  15   1.089  -7.024  10.369
  109    HB   VAL  15           HB       VAL  15   2.505  -4.940  10.000
  110   1HG1  VAL  15          HG11      VAL  15   3.600  -5.974   7.922
  111   2HG1  VAL  15          HG12      VAL  15   3.082  -4.292   7.784
  112   3HG1  VAL  15          HG13      VAL  15   2.109  -5.577   7.073
  113   1HG2  VAL  15          HG21      VAL  15  -0.019  -5.428   8.400
  114   2HG2  VAL  15          HG22      VAL  15   0.685  -3.826   8.627
  115   3HG2  VAL  15          HG23      VAL  15   0.109  -4.742  10.019
  116    H    THR  16           HN       THR  16   3.167  -7.874   7.638
  117    HA   THR  16           HA       THR  16   1.142  -8.351   5.717
  118    HB   THR  16           HB       THR  16   3.038 -10.380   5.281
  119    HG1  THR  16           HG1      THR  16   4.605  -9.927   6.517
  120   1HG2  THR  16          HG21      THR  16   2.229  -8.666   3.663
  121   2HG2  THR  16          HG22      THR  16   3.992  -8.842   3.653
  122   3HG2  THR  16          HG23      THR  16   3.250  -7.466   4.475
  123    H    LYS  17           HN       LYS  17   2.497 -10.451   8.274
  124    HA   LYS  17           HA       LYS  17   1.159 -12.843   7.823
  125   1HB   LYS  17          HB2       LYS  17   1.489 -11.441  10.502
  126   2HB   LYS  17          HB1       LYS  17   1.058 -13.135  10.305
  127   1HG   LYS  17          HG2       LYS  17   3.539 -12.070   8.960
  128   2HG   LYS  17          HG1       LYS  17   3.582 -12.476  10.675
  129   1HD   LYS  17          HD2       LYS  17   2.722 -14.759  10.116
  130   2HD   LYS  17          HD1       LYS  17   2.828 -14.345   8.406
  131   1HE   LYS  17          HE2       LYS  17   5.189 -14.160  10.288
  132   2HE   LYS  17          HE1       LYS  17   4.828 -15.602   9.338
  133   1HZ   LYS  17          HZ1       LYS  17   6.377 -14.236   8.150
  134   2HZ   LYS  17          HZ2       LYS  17   5.366 -12.878   8.287
  135   3HZ   LYS  17          HZ3       LYS  17   4.891 -14.203   7.334
  136    H    LEU  18           HN       LEU  18  -0.181  -9.832   9.099
  137    HA   LEU  18           HA       LEU  18  -2.892 -11.098   9.236
  138   1HB   LEU  18          HB2       LEU  18  -2.895  -8.218   9.818
  139   2HB   LEU  18          HB1       LEU  18  -3.399  -9.558  10.835
  140    HG   LEU  18           HG       LEU  18  -0.501  -8.768  10.452
  141   1HD1  LEU  18          HD11      LEU  18  -2.484  -8.036  12.619
  142   2HD1  LEU  18          HD12      LEU  18  -1.706  -6.929  11.485
  143   3HD1  LEU  18          HD13      LEU  18  -0.744  -7.757  12.713
  144   1HD2  LEU  18          HD21      LEU  18  -1.281 -11.154  11.220
  145   2HD2  LEU  18          HD22      LEU  18  -1.752 -10.344  12.712
  146   3HD2  LEU  18          HD23      LEU  18  -0.067 -10.319  12.191
  147    H    ILE  19           HN       ILE  19  -1.438  -8.132   7.810
  148    HA   ILE  19           HA       ILE  19  -3.500  -7.421   6.090
  149    HB   ILE  19           HB       ILE  19  -0.603  -7.067   6.278
  150   1HG1  ILE  19          HG12      ILE  19  -2.591  -5.168   5.052
  151   2HG1  ILE  19          HG11      ILE  19  -2.457  -5.395   6.795
  152   1HG2  ILE  19          HG21      ILE  19  -0.310  -6.198   3.943
  153   2HG2  ILE  19          HG22      ILE  19  -1.824  -6.998   3.519
  154   3HG2  ILE  19          HG23      ILE  19  -0.441  -7.951   4.056
  155   1HD1  ILE  19          HD11      ILE  19  -0.767  -3.906   6.798
  156   2HD1  ILE  19          HD12      ILE  19  -0.781  -3.822   5.042
  157   3HD1  ILE  19          HD13      ILE  19   0.209  -5.035   5.855
  158    H    ASP  20           HN       ASP  20  -1.206 -10.062   5.846
  159    HA   ASP  20           HA       ASP  20  -1.397 -10.852   3.197
  160   1HB   ASP  20          HB2       ASP  20  -1.210 -12.418   5.767
  161   2HB   ASP  20          HB1       ASP  20  -1.391 -13.283   4.243
  162    H    ASN  21           HN       ASN  21  -3.826 -11.261   5.777
  163    HA   ASN  21           HA       ASN  21  -5.854 -11.797   3.705
  164   1HB   ASN  21          HB2       ASN  21  -5.490 -13.632   6.073
  165   2HB   ASN  21          HB1       ASN  21  -6.753 -13.750   4.847
  166   1HD2  ASN  21          HD21      ASN  21  -3.188 -13.906   5.246
  167   2HD2  ASN  21          HD22      ASN  21  -2.925 -14.889   3.888
  168    H    ASN  22           HN       ASN  22  -5.088  -9.813   5.995
  169    HA   ASN  22           HA       ASN  22  -7.740  -9.793   7.380
  170   1HB   ASN  22          HB2       ASN  22  -5.195  -8.230   7.912
  171   2HB   ASN  22          HB1       ASN  22  -6.677  -8.118   8.863
  172   1HD2  ASN  22          HD21      ASN  22  -5.275 -11.135   7.483
  173   2HD2  ASN  22          HD22      ASN  22  -4.958 -11.850   8.999
  174    H    LYS  23           HN       LYS  23  -5.480  -7.494   5.868
  175    HA   LYS  23           HA       LYS  23  -7.592  -5.576   5.344
  176   1HB   LYS  23          HB2       LYS  23  -4.831  -5.482   5.638
  177   2HB   LYS  23          HB1       LYS  23  -5.010  -5.289   3.901
  178   1HG   LYS  23          HG2       LYS  23  -6.450  -3.640   5.999
  179   2HG   LYS  23          HG1       LYS  23  -5.005  -3.115   5.144
  180   1HD   LYS  23          HD2       LYS  23  -7.237  -4.034   3.396
  181   2HD   LYS  23          HD1       LYS  23  -7.566  -2.569   4.303
  182   1HE   LYS  23          HE2       LYS  23  -4.946  -2.764   2.844
  183   2HE   LYS  23          HE1       LYS  23  -6.409  -2.448   1.916
  184   1HZ   LYS  23          HZ1       LYS  23  -5.152  -0.822   4.018
  185   2HZ   LYS  23          HZ2       LYS  23  -6.827  -0.700   3.757
  186   3HZ   LYS  23          HZ3       LYS  23  -5.740  -0.348   2.499
  187    H    THR  24           HN       THR  24  -9.079  -6.487   3.888
  188    HA   THR  24           HA       THR  24  -8.045  -7.743   1.396
  189    HB   THR  24           HB       THR  24 -10.484  -8.278   1.032
  190    HG1  THR  24           HG1      THR  24 -10.717  -7.346   3.696
  191   1HG2  THR  24          HG21      THR  24  -9.039  -9.155   3.539
  192   2HG2  THR  24          HG22      THR  24  -9.118  -9.984   1.985
  193   3HG2  THR  24          HG23      THR  24 -10.549  -9.899   3.011
  194    H    GLU  25           HN       GLU  25  -9.733  -7.137  -0.536
  195    HA   GLU  25           HA       GLU  25  -9.447  -4.178  -0.852
  196   1HB   GLU  25          HB2       GLU  25 -10.086  -6.208  -3.002
  197   2HB   GLU  25          HB1       GLU  25  -9.472  -4.568  -3.210
  198   1HG   GLU  25          HG2       GLU  25  -7.558  -5.932  -3.485
  199   2HG   GLU  25          HG1       GLU  25  -7.436  -5.360  -1.823
  200    H    LYS  26           HN       LYS  26 -11.810  -5.990   0.342
  201    HA   LYS  26           HA       LYS  26 -14.020  -5.111  -1.399
  202   1HB   LYS  26          HB2       LYS  26 -13.975  -6.554   1.271
  203   2HB   LYS  26          HB1       LYS  26 -15.438  -6.202   0.355
  204   1HG   LYS  26          HG2       LYS  26 -14.830  -7.644  -1.411
  205   2HG   LYS  26          HG1       LYS  26 -13.139  -7.691  -0.919
  206   1HD   LYS  26          HD2       LYS  26 -15.244  -8.726   0.976
  207   2HD   LYS  26          HD1       LYS  26 -14.737  -9.733  -0.377
  208   1HE   LYS  26          HE2       LYS  26 -12.372  -9.498   0.361
  209   2HE   LYS  26          HE1       LYS  26 -12.917  -8.566   1.754
  210   1HZ   LYS  26          HZ1       LYS  26 -14.337 -10.509   2.336
  211   2HZ   LYS  26          HZ2       LYS  26 -12.668 -10.802   2.444
  212   3HZ   LYS  26          HZ3       LYS  26 -13.552 -11.390   1.118
  213    H    GLU  27           HN       GLU  27 -12.771  -4.467   1.861
  214    HA   GLU  27           HA       GLU  27 -14.711  -2.412   2.418
  215   1HB   GLU  27          HB2       GLU  27 -12.015  -2.992   3.679
  216   2HB   GLU  27          HB1       GLU  27 -13.206  -1.864   4.330
  217   1HG   GLU  27          HG2       GLU  27 -13.761  -4.798   3.815
  218   2HG   GLU  27          HG1       GLU  27 -13.297  -4.143   5.386
  219    H    ILE  28           HN       ILE  28 -11.781  -2.520   0.612
  220    HA   ILE  28           HA       ILE  28 -11.201   0.324   0.843
  221    HB   ILE  28           HB       ILE  28 -10.141  -1.727  -1.112
  222   1HG1  ILE  28          HG12      ILE  28  -9.839  -2.248   1.400
  223   2HG1  ILE  28          HG11      ILE  28  -8.390  -2.231   0.404
  224   1HG2  ILE  28          HG21      ILE  28  -9.577   0.387  -1.936
  225   2HG2  ILE  28          HG22      ILE  28  -8.155  -0.078  -1.008
  226   3HG2  ILE  28          HG23      ILE  28  -9.314   1.059  -0.327
  227   1HD1  ILE  28          HD11      ILE  28  -9.317   0.188   1.961
  228   2HD1  ILE  28          HD12      ILE  28  -7.753  -0.071   1.202
  229   3HD1  ILE  28          HD13      ILE  28  -8.214  -1.007   2.622
  230    H    LEU  29           HN       LEU  29 -11.716  -1.609  -2.108
  231    HA   LEU  29           HA       LEU  29 -12.349   0.486  -3.793
  232   1HB   LEU  29          HB2       LEU  29 -13.699  -2.230  -3.788
  233   2HB   LEU  29          HB1       LEU  29 -13.628  -1.123  -5.158
  234    HG   LEU  29           HG       LEU  29 -11.125  -2.118  -3.778
  235   1HD1  LEU  29          HD11      LEU  29 -12.729  -3.402  -5.992
  236   2HD1  LEU  29          HD12      LEU  29 -12.170  -4.130  -4.487
  237   3HD1  LEU  29          HD13      LEU  29 -11.013  -3.734  -5.757
  238   1HD2  LEU  29          HD21      LEU  29 -10.230  -1.658  -6.152
  239   2HD2  LEU  29          HD22      LEU  29 -10.653  -0.249  -5.185
  240   3HD2  LEU  29          HD23      LEU  29 -11.749  -0.814  -6.446
  241    H    ASP  30           HN       ASP  30 -14.413  -0.948  -1.336
  242    HA   ASP  30           HA       ASP  30 -16.840   0.383  -2.213
  243   1HB   ASP  30          HB2       ASP  30 -16.826  -1.587  -0.663
  244   2HB   ASP  30          HB1       ASP  30 -16.087  -0.568   0.572
  245    H    ALA  31           HN       ALA  31 -14.443   1.025   0.347
  246    HA   ALA  31           HA       ALA  31 -15.370   3.441   1.361
  247   1HB   ALA  31          HB1       ALA  31 -13.275   2.198   2.040
  248   2HB   ALA  31          HB2       ALA  31 -13.114   3.953   1.960
  249   3HB   ALA  31          HB3       ALA  31 -12.476   2.946   0.658
  250    H    PHE  32           HN       PHE  32 -13.285   3.062  -1.536
  251    HA   PHE  32           HA       PHE  32 -13.194   5.792  -2.253
  252   1HB   PHE  32          HB2       PHE  32 -13.170   3.251  -3.896
  253   2HB   PHE  32          HB1       PHE  32 -13.130   4.827  -4.682
  254    HD1  PHE  32           HD1      PHE  32 -11.252   6.412  -4.227
  255    HD2  PHE  32           HD2      PHE  32 -11.252   2.388  -2.719
  256    HE1  PHE  32           HE1      PHE  32  -8.817   6.574  -3.794
  257    HE2  PHE  32           HE2      PHE  32  -8.815   2.555  -2.289
  258    HZ   PHE  32           HZ       PHE  32  -7.600   4.643  -2.825
  259    H    ASP  33           HN       ASP  33 -15.760   3.397  -2.671
  260    HA   ASP  33           HA       ASP  33 -17.404   5.106  -4.342
  261   1HB   ASP  33          HB2       ASP  33 -17.602   2.548  -4.042
  262   2HB   ASP  33          HB1       ASP  33 -18.440   2.912  -2.533
  263    H    LYS  34           HN       LYS  34 -16.413   5.330  -1.187
  264    HA   LYS  34           HA       LYS  34 -18.885   6.785  -0.294
  265   1HB   LYS  34          HB2       LYS  34 -16.552   5.819   1.394
  266   2HB   LYS  34          HB1       LYS  34 -18.092   6.458   1.976
  267   1HG   LYS  34          HG2       LYS  34 -19.287   4.557   1.000
  268   2HG   LYS  34          HG1       LYS  34 -17.781   3.940   0.323
  269   1HD   LYS  34          HD2       LYS  34 -16.993   4.091   2.895
  270   2HD   LYS  34          HD1       LYS  34 -18.725   3.945   3.175
  271   1HE   LYS  34          HE2       LYS  34 -17.154   2.029   1.428
  272   2HE   LYS  34          HE1       LYS  34 -17.473   1.753   3.136
  273   1HZ   LYS  34          HZ1       LYS  34 -19.259   1.561   0.876
  274   2HZ   LYS  34          HZ2       LYS  34 -19.913   2.375   2.217
  275   3HZ   LYS  34          HZ3       LYS  34 -19.330   0.787   2.384
  276    H    MET  35           HN       MET  35 -15.362   7.051   0.372
  277    HA   MET  35           HA       MET  35 -15.527   9.878   0.887
  278   1HB   MET  35          HB2       MET  35 -12.964   8.602  -0.070
  279   2HB   MET  35          HB1       MET  35 -13.186   9.887   1.106
  280   1HG   MET  35          HG2       MET  35 -13.689   8.412   2.833
  281   2HG   MET  35          HG1       MET  35 -14.306   7.172   1.749
  282   1HE   MET  35          HE1       MET  35 -11.454   6.664  -0.434
  283   2HE   MET  35          HE2       MET  35 -13.117   6.280  -0.028
  284   3HE   MET  35          HE3       MET  35 -11.836   5.177   0.443
  285    H    CYS  36           HN       CYS  36 -14.373   8.029  -1.932
  286    HA   CYS  36           HA       CYS  36 -13.990  10.437  -3.511
  287   1HB   CYS  36          HB2       CYS  36 -13.434   7.597  -3.741
  288   2HB   CYS  36          HB1       CYS  36 -14.191   8.165  -5.234
  289    H    SER  37           HN       SER  37 -16.670   9.563  -2.248
  290    HA   SER  37           HA       SER  37 -18.418   9.410  -4.628
  291   1HB   SER  37          HB2       SER  37 -18.711   8.199  -2.299
  292   2HB   SER  37          HB1       SER  37 -19.441   9.722  -1.814
  293    HG   SER  37           HG       SER  37 -20.665   7.839  -3.004
  294    H    LYS  38           HN       LYS  38 -17.971  11.525  -1.785
  295    HA   LYS  38           HA       LYS  38 -19.696  13.614  -2.757
  296   1HB   LYS  38          HB2       LYS  38 -18.609  14.994  -0.992
  297   2HB   LYS  38          HB1       LYS  38 -19.136  13.426  -0.378
  298   1HG   LYS  38          HG2       LYS  38 -16.745  12.614  -0.921
  299   2HG   LYS  38          HG1       LYS  38 -16.330  14.322  -1.059
  300   1HD   LYS  38          HD2       LYS  38 -17.326  14.636   1.254
  301   2HD   LYS  38          HD1       LYS  38 -17.416  12.878   1.369
  302   1HE   LYS  38          HE2       LYS  38 -15.339  13.656   2.399
  303   2HE   LYS  38          HE1       LYS  38 -14.970  12.750   0.932
  304   1HZ   LYS  38          HZ1       LYS  38 -15.138  15.708   1.144
  305   2HZ   LYS  38          HZ2       LYS  38 -14.779  14.835  -0.269
  306   3HZ   LYS  38          HZ3       LYS  38 -13.705  14.806   1.048
  307    H    LEU  39           HN       LEU  39 -16.370  12.770  -3.342
  308    HA   LEU  39           HA       LEU  39 -15.146  15.109  -4.089
  309   1HB   LEU  39          HB2       LEU  39 -14.795  12.332  -4.723
  310   2HB   LEU  39          HB1       LEU  39 -14.713  13.182  -6.248
  311    HG   LEU  39           HG       LEU  39 -13.073  14.729  -4.527
  312   1HD1  LEU  39          HD11      LEU  39 -11.645  13.273  -3.357
  313   2HD1  LEU  39          HD12      LEU  39 -12.254  11.848  -4.201
  314   3HD1  LEU  39          HD13      LEU  39 -13.259  12.657  -2.995
  315   1HD2  LEU  39          HD21      LEU  39 -12.694  14.188  -6.913
  316   2HD2  LEU  39          HD22      LEU  39 -12.253  12.542  -6.458
  317   3HD2  LEU  39          HD23      LEU  39 -11.255  13.900  -5.938
  318    HA   PRO  40           HA       PRO  40 -17.719  16.983  -7.231
  319   1HB   PRO  40          HB2       PRO  40 -15.370  17.740  -8.831
  320   2HB   PRO  40          HB1       PRO  40 -16.495  18.788  -7.957
  321   1HG   PRO  40          HG2       PRO  40 -13.815  18.148  -7.194
  322   2HG   PRO  40          HG1       PRO  40 -15.004  19.042  -6.234
  323   1HD   PRO  40          HD2       PRO  40 -14.013  16.362  -5.771
  324   2HD   PRO  40          HD1       PRO  40 -15.182  17.273  -4.797
  325    H    LYS  41           HN       LYS  41 -18.687  15.945  -8.939
  326    HA   LYS  41           HA       LYS  41 -18.159  13.453  -9.886
  327   1HB   LYS  41          HB2       LYS  41 -20.107  14.886 -10.512
  328   2HB   LYS  41          HB1       LYS  41 -19.066  15.704 -11.675
  329   1HG   LYS  41          HG2       LYS  41 -18.683  13.647 -12.877
  330   2HG   LYS  41          HG1       LYS  41 -19.564  12.721 -11.660
  331   1HD   LYS  41          HD2       LYS  41 -21.640  13.452 -12.390
  332   2HD   LYS  41          HD1       LYS  41 -21.024  15.015 -12.928
  333   1HE   LYS  41          HE2       LYS  41 -19.980  13.974 -14.870
  334   2HE   LYS  41          HE1       LYS  41 -20.498  12.378 -14.328
  335   1HZ   LYS  41          HZ1       LYS  41 -22.135  12.965 -15.823
  336   2HZ   LYS  41          HZ2       LYS  41 -22.126  14.602 -15.370
  337   3HZ   LYS  41          HZ3       LYS  41 -22.829  13.441 -14.349
  338    H    SER  42           HN       SER  42 -16.749  16.394 -11.236
  339    HA   SER  42           HA       SER  42 -15.349  15.257 -13.412
  340   1HB   SER  42          HB2       SER  42 -14.427  17.510 -11.609
  341   2HB   SER  42          HB1       SER  42 -13.867  17.201 -13.251
  342    HG   SER  42           HG       SER  42 -16.548  17.760 -12.479
  343    H    LEU  43           HN       LEU  43 -13.948  16.088 -10.239
  344    HA   LEU  43           HA       LEU  43 -11.625  14.414 -10.746
  345   1HB   LEU  43          HB2       LEU  43 -12.591  15.990  -8.358
  346   2HB   LEU  43          HB1       LEU  43 -11.095  15.052  -8.331
  347    HG   LEU  43           HG       LEU  43 -11.578  17.035 -10.553
  348   1HD1  LEU  43          HD11      LEU  43 -10.640  17.648  -7.742
  349   2HD1  LEU  43          HD12      LEU  43 -11.970  18.399  -8.623
  350   3HD1  LEU  43          HD13      LEU  43 -10.304  18.700  -9.116
  351   1HD2  LEU  43          HD21      LEU  43  -9.116  15.946  -9.144
  352   2HD2  LEU  43          HD22      LEU  43  -9.070  17.202 -10.378
  353   3HD2  LEU  43          HD23      LEU  43  -9.637  15.587 -10.790
  354    H    SER  44           HN       SER  44 -14.739  13.621  -9.851
  355    HA   SER  44           HA       SER  44 -13.982  11.526  -7.908
  356   1HB   SER  44          HB2       SER  44 -16.268  11.226  -7.550
  357   2HB   SER  44          HB1       SER  44 -16.266  12.909  -8.061
  358    HG   SER  44           HG       SER  44 -16.572  12.038 -10.240
  359    H    GLU  45           HN       GLU  45 -14.641  12.068 -11.253
  360    HA   GLU  45           HA       GLU  45 -14.834   9.244 -11.927
  361   1HB   GLU  45          HB2       GLU  45 -14.593  11.767 -13.578
  362   2HB   GLU  45          HB1       GLU  45 -14.624  10.159 -14.303
  363   1HG   GLU  45          HG2       GLU  45 -16.811   9.711 -13.337
  364   2HG   GLU  45          HG1       GLU  45 -16.773  11.240 -12.457
  365    H    GLU  46           HN       GLU  46 -12.416  11.729 -11.662
  366    HA   GLU  46           HA       GLU  46 -10.354  10.182 -13.064
  367   1HB   GLU  46          HB2       GLU  46 -10.160  12.703 -11.391
  368   2HB   GLU  46          HB1       GLU  46  -8.855  12.022 -12.362
  369   1HG   GLU  46          HG2       GLU  46 -10.282  12.243 -14.389
  370   2HG   GLU  46          HG1       GLU  46 -11.526  13.011 -13.402
  371    H    CYS  47           HN       CYS  47 -11.386  10.740  -9.727
  372    HA   CYS  47           HA       CYS  47  -8.980   9.531  -8.597
  373   1HB   CYS  47          HB2       CYS  47  -9.897   9.980  -6.503
  374   2HB   CYS  47          HB1       CYS  47 -10.669  11.212  -7.490
  375    H    GLN  48           HN       GLN  48 -12.023   8.390  -9.804
  376    HA   GLN  48           HA       GLN  48 -11.695   5.728  -8.548
  377   1HB   GLN  48          HB2       GLN  48 -13.818   7.064 -10.234
  378   2HB   GLN  48          HB1       GLN  48 -13.790   5.306 -10.084
  379   1HG   GLN  48          HG2       GLN  48 -13.709   7.111  -7.660
  380   2HG   GLN  48          HG1       GLN  48 -15.232   6.589  -8.381
  381   1HE2  GLN  48          HE21      GLN  48 -15.373   5.506  -6.095
  382   2HE2  GLN  48          HE22      GLN  48 -14.716   3.949  -5.955
  383    H    GLU  49           HN       GLU  49 -10.902   7.520 -11.342
  384    HA   GLU  49           HA       GLU  49 -10.675   5.296 -13.167
  385   1HB   GLU  49          HB2       GLU  49 -10.903   7.569 -14.042
  386   2HB   GLU  49          HB1       GLU  49  -9.424   8.055 -13.215
  387   1HG   GLU  49          HG2       GLU  49  -8.079   6.630 -14.588
  388   2HG   GLU  49          HG1       GLU  49  -9.502   5.832 -15.260
  389    H    VAL  50           HN       VAL  50  -8.425   7.106 -11.074
  390    HA   VAL  50           HA       VAL  50  -6.144   5.538 -11.873
  391    HB   VAL  50           HB       VAL  50  -6.031   7.822 -10.748
  392   1HG1  VAL  50          HG11      VAL  50  -7.691   7.092  -8.942
  393   2HG1  VAL  50          HG12      VAL  50  -6.276   7.986  -8.389
  394   3HG1  VAL  50          HG13      VAL  50  -6.344   6.233  -8.198
  395   1HG2  VAL  50          HG21      VAL  50  -4.146   5.969 -10.942
  396   2HG2  VAL  50          HG22      VAL  50  -4.412   5.788  -9.207
  397   3HG2  VAL  50          HG23      VAL  50  -3.897   7.342  -9.857
  398    H    VAL  51           HN       VAL  51  -8.444   5.344  -9.153
  399    HA   VAL  51           HA       VAL  51  -7.316   3.280  -7.610
  400    HB   VAL  51           HB       VAL  51 -10.199   3.771  -8.460
  401   1HG1  VAL  51          HG11      VAL  51 -10.114   1.453  -7.824
  402   2HG1  VAL  51          HG12      VAL  51 -10.778   2.343  -6.456
  403   3HG1  VAL  51          HG13      VAL  51  -9.097   1.818  -6.429
  404   1HG2  VAL  51          HG21      VAL  51 -10.413   5.009  -6.486
  405   2HG2  VAL  51          HG22      VAL  51  -8.763   5.399  -6.962
  406   3HG2  VAL  51          HG23      VAL  51  -9.054   4.200  -5.706
  407    H    ASP  52           HN       ASP  52  -9.355   2.890 -10.541
  408    HA   ASP  52           HA       ASP  52  -9.131   0.073 -10.755
  409   1HB   ASP  52          HB2       ASP  52 -10.567   1.547 -12.221
  410   2HB   ASP  52          HB1       ASP  52  -9.101   2.046 -13.066
  411    H    THR  53           HN       THR  53  -6.935   2.695 -11.638
  412    HA   THR  53           HA       THR  53  -4.955   0.882 -12.768
  413    HB   THR  53           HB       THR  53  -4.737   3.797 -12.152
  414    HG1  THR  53           HG1      THR  53  -5.202   2.389 -14.549
  415   1HG2  THR  53          HG21      THR  53  -2.978   2.056 -13.884
  416   2HG2  THR  53          HG22      THR  53  -2.548   2.553 -12.250
  417   3HG2  THR  53          HG23      THR  53  -2.735   3.762 -13.516
  418    H    TYR  54           HN       TYR  54  -5.748   2.172  -9.706
  419    HA   TYR  54           HA       TYR  54  -3.372   0.786  -8.524
  420   1HB   TYR  54          HB2       TYR  54  -4.518   3.474  -7.746
  421   2HB   TYR  54          HB1       TYR  54  -3.402   2.551  -6.735
  422    HD1  TYR  54           HD1      TYR  54  -3.802   3.812 -10.185
  423    HD2  TYR  54           HD2      TYR  54  -1.085   2.803  -7.061
  424    HE1  TYR  54           HE1      TYR  54  -1.960   4.757 -11.533
  425    HE2  TYR  54           HE2      TYR  54   0.800   3.730  -8.389
  426    HH   TYR  54           HH       TYR  54   0.309   5.664 -11.162
  427    H    GLY  55           HN       GLY  55  -5.085  -0.906  -8.402
  428   1HA   GLY  55          HA2       GLY  55  -6.534  -0.677  -5.832
  429   2HA   GLY  55          HA1       GLY  55  -7.486  -1.074  -7.267
  430    H    SER  56           HN       SER  56  -7.230  -3.164  -8.213
  431    HA   SER  56           HA       SER  56  -6.732  -5.267  -6.465
  432   1HB   SER  56          HB2       SER  56  -7.799  -5.869  -8.475
  433   2HB   SER  56          HB1       SER  56  -6.573  -5.091  -9.472
  434    HG   SER  56           HG       SER  56  -5.184  -6.786  -8.247
  435    H    SER  57           HN       SER  57  -4.341  -3.237  -7.976
  436    HA   SER  57           HA       SER  57  -2.182  -5.223  -7.444
  437   1HB   SER  57          HB2       SER  57  -2.098  -2.447  -8.671
  438   2HB   SER  57          HB1       SER  57  -0.661  -3.422  -8.333
  439    HG   SER  57           HG       SER  57  -2.779  -4.592  -9.743
  440    H    ILE  58           HN       ILE  58  -2.112  -1.722  -6.866
  441    HA   ILE  58           HA       ILE  58  -0.505  -1.394  -4.751
  442    HB   ILE  58           HB       ILE  58  -2.003   0.340  -5.705
  443   1HG1  ILE  58          HG12      ILE  58  -1.913   0.067  -2.691
  444   2HG1  ILE  58          HG11      ILE  58  -0.823   1.011  -3.716
  445   1HG2  ILE  58          HG21      ILE  58  -4.057  -1.177  -5.405
  446   2HG2  ILE  58          HG22      ILE  58  -4.251   0.546  -5.108
  447   3HG2  ILE  58          HG23      ILE  58  -4.079  -0.549  -3.754
  448   1HD1  ILE  58          HD11      ILE  58  -3.719   1.566  -3.029
  449   2HD1  ILE  58          HD12      ILE  58  -2.957   2.312  -4.438
  450   3HD1  ILE  58          HD13      ILE  58  -2.321   2.629  -2.820
  451    H    LEU  59           HN       LEU  59  -3.822  -2.607  -4.369
  452    HA   LEU  59           HA       LEU  59  -3.453  -3.062  -1.523
  453   1HB   LEU  59          HB2       LEU  59  -5.579  -4.514  -3.100
  454   2HB   LEU  59          HB1       LEU  59  -5.636  -3.923  -1.442
  455    HG   LEU  59           HG       LEU  59  -5.500  -2.105  -3.826
  456   1HD1  LEU  59          HD11      LEU  59  -7.519  -3.440  -4.003
  457   2HD1  LEU  59          HD12      LEU  59  -7.927  -1.789  -3.517
  458   3HD1  LEU  59          HD13      LEU  59  -7.911  -3.080  -2.316
  459   1HD2  LEU  59          HD21      LEU  59  -6.385  -1.606  -0.983
  460   2HD2  LEU  59          HD22      LEU  59  -6.230  -0.399  -2.260
  461   3HD2  LEU  59          HD23      LEU  59  -4.793  -1.182  -1.614
  462    H    SER  60           HN       SER  60  -3.551  -5.227  -4.383
  463    HA   SER  60           HA       SER  60  -2.840  -7.541  -2.713
  464   1HB   SER  60          HB2       SER  60  -4.369  -7.463  -4.844
  465   2HB   SER  60          HB1       SER  60  -2.845  -7.608  -5.714
  466    HG   SER  60           HG       SER  60  -2.574  -9.574  -4.932
  467    H    ILE  61           HN       ILE  61  -1.028  -5.064  -3.933
  468    HA   ILE  61           HA       ILE  61   1.177  -6.638  -4.994
  469    HB   ILE  61           HB       ILE  61   0.403  -4.082  -5.385
  470   1HG1  ILE  61          HG12      ILE  61   2.035  -5.380  -6.707
  471   2HG1  ILE  61          HG11      ILE  61   2.491  -3.695  -6.529
  472   1HG2  ILE  61          HG21      ILE  61   2.031  -2.527  -4.429
  473   2HG2  ILE  61          HG22      ILE  61   2.672  -3.801  -3.404
  474   3HG2  ILE  61          HG23      ILE  61   1.001  -3.245  -3.204
  475   1HD1  ILE  61          HD11      ILE  61   4.086  -4.252  -4.805
  476   2HD1  ILE  61          HD12      ILE  61   4.376  -5.309  -6.188
  477   3HD1  ILE  61          HD13      ILE  61   3.529  -5.924  -4.772
  478    H    LEU  62           HN       LEU  62   1.143  -4.493  -2.102
  479    HA   LEU  62           HA       LEU  62   3.471  -5.551  -0.941
  480   1HB   LEU  62          HB2       LEU  62   1.036  -4.541   0.518
  481   2HB   LEU  62          HB1       LEU  62   2.661  -4.690   1.193
  482    HG   LEU  62           HG       LEU  62   1.928  -2.993  -1.194
  483   1HD1  LEU  62          HD11      LEU  62   2.317  -1.077   0.317
  484   2HD1  LEU  62          HD12      LEU  62   2.586  -2.198   1.651
  485   3HD1  LEU  62          HD13      LEU  62   0.997  -2.092   0.896
  486   1HD2  LEU  62          HD21      LEU  62   4.154  -3.412  -1.578
  487   2HD2  LEU  62          HD22      LEU  62   4.514  -3.667   0.132
  488   3HD2  LEU  62          HD23      LEU  62   4.308  -2.031  -0.492
  489    H    LEU  63           HN       LEU  63   0.683  -7.236  -1.595
  490    HA   LEU  63           HA       LEU  63   0.794  -9.016   0.725
  491   1HB   LEU  63          HB2       LEU  63  -0.805  -8.900  -1.824
  492   2HB   LEU  63          HB1       LEU  63  -1.000 -10.187  -0.642
  493    HG   LEU  63           HG       LEU  63  -2.581  -8.131  -0.522
  494   1HD1  LEU  63          HD11      LEU  63  -2.820  -8.360   1.849
  495   2HD1  LEU  63          HD12      LEU  63  -1.145  -8.873   2.021
  496   3HD1  LEU  63          HD13      LEU  63  -2.316  -9.929   1.228
  497   1HD2  LEU  63          HD21      LEU  63  -0.243  -6.945   0.978
  498   2HD2  LEU  63          HD22      LEU  63  -1.840  -6.239   0.775
  499   3HD2  LEU  63          HD23      LEU  63  -0.778  -6.406  -0.616
  500    H    GLU  64           HN       GLU  64   1.148  -9.477  -2.837
  501    HA   GLU  64           HA       GLU  64   2.960 -11.810  -2.247
  502   1HB   GLU  64          HB2       GLU  64   0.781 -11.598  -4.330
  503   2HB   GLU  64          HB1       GLU  64   1.907 -12.948  -4.175
  504   1HG   GLU  64          HG2       GLU  64   0.075 -12.029  -1.942
  505   2HG   GLU  64          HG1       GLU  64  -0.324 -13.337  -3.056
  506    H    GLU  65           HN       GLU  65   1.867  -9.810  -5.020
  507    HA   GLU  65           HA       GLU  65   3.889 -10.328  -6.797
  508   1HB   GLU  65          HB2       GLU  65   2.979  -7.494  -6.334
  509   2HB   GLU  65          HB1       GLU  65   3.459  -8.240  -7.854
  510   1HG   GLU  65          HG2       GLU  65   0.983  -8.862  -6.226
  511   2HG   GLU  65          HG1       GLU  65   1.041  -8.092  -7.810
  512    H    VAL  66           HN       VAL  66   4.279  -8.869  -3.791
  513    HA   VAL  66           HA       VAL  66   7.186  -8.488  -4.337
  514    HB   VAL  66           HB       VAL  66   5.816  -6.331  -4.587
  515   1HG1  VAL  66          HG11      VAL  66   4.892  -5.274  -2.732
  516   2HG1  VAL  66          HG12      VAL  66   5.859  -6.212  -1.589
  517   3HG1  VAL  66          HG13      VAL  66   4.510  -6.962  -2.420
  518   1HG2  VAL  66          HG21      VAL  66   7.531  -5.098  -2.998
  519   2HG2  VAL  66          HG22      VAL  66   8.107  -5.963  -4.415
  520   3HG2  VAL  66          HG23      VAL  66   8.215  -6.709  -2.821
  521    H    SER  67           HN       SER  67   8.370  -9.405  -2.689
  522    HA   SER  67           HA       SER  67   7.003 -10.581  -0.429
  523   1HB   SER  67          HB2       SER  67   9.889 -10.305  -1.245
  524   2HB   SER  67          HB1       SER  67   9.486 -10.900   0.363
  525    HG   SER  67           HG       SER  67   9.378 -12.162  -2.017
  526    HA   PRO  68           HA       PRO  68   6.915  -7.125   2.314
  527   1HB   PRO  68          HB2       PRO  68   7.904  -8.474   4.660
  528   2HB   PRO  68          HB1       PRO  68   6.214  -8.138   4.235
  529   1HG   PRO  68          HG2       PRO  68   7.667 -10.689   4.090
  530   2HG   PRO  68          HG1       PRO  68   5.927 -10.394   3.937
  531   1HD   PRO  68          HD2       PRO  68   7.673 -11.087   1.826
  532   2HD   PRO  68          HD1       PRO  68   6.028 -10.447   1.653
  533    H    GLU  69           HN       GLU  69   9.854  -9.146   2.639
  534    HA   GLU  69           HA       GLU  69  11.517  -7.145   3.773
  535   1HB   GLU  69          HB2       GLU  69  12.159  -9.518   3.686
  536   2HB   GLU  69          HB1       GLU  69  12.304  -9.424   1.931
  537   1HG   GLU  69          HG2       GLU  69  14.115  -7.827   2.104
  538   2HG   GLU  69          HG1       GLU  69  13.892  -7.697   3.849
  539    H    LEU  70           HN       LEU  70  11.071  -7.989   0.310
  540    HA   LEU  70           HA       LEU  70  12.894  -6.152  -0.774
  541   1HB   LEU  70          HB2       LEU  70  11.836  -7.692  -2.253
  542   2HB   LEU  70          HB1       LEU  70  10.228  -7.178  -1.760
  543    HG   LEU  70           HG       LEU  70  10.529  -5.020  -2.849
  544   1HD1  LEU  70          HD11      LEU  70  12.860  -4.570  -2.514
  545   2HD1  LEU  70          HD12      LEU  70  12.657  -4.722  -4.252
  546   3HD1  LEU  70          HD13      LEU  70  13.339  -6.057  -3.323
  547   1HD2  LEU  70          HD21      LEU  70  10.002  -7.252  -4.178
  548   2HD2  LEU  70          HD22      LEU  70  11.590  -6.976  -4.887
  549   3HD2  LEU  70          HD23      LEU  70  10.326  -5.758  -5.060
  550    H    VAL  71           HN       VAL  71   9.497  -5.612   0.187
  551    HA   VAL  71           HA       VAL  71   9.112  -2.986  -0.620
  552    HB   VAL  71           HB       VAL  71   8.386  -3.904   2.164
  553   1HG1  VAL  71          HG11      VAL  71   6.343  -2.547   1.646
  554   2HG1  VAL  71          HG12      VAL  71   7.093  -2.070   0.124
  555   3HG1  VAL  71          HG13      VAL  71   7.824  -1.594   1.655
  556   1HG2  VAL  71          HG21      VAL  71   7.807  -5.716   0.724
  557   2HG2  VAL  71          HG22      VAL  71   7.193  -4.633  -0.515
  558   3HG2  VAL  71          HG23      VAL  71   6.322  -4.822   1.010
  559    H    CYS  72           HN       CYS  72  10.495  -3.871   2.581
  560    HA   CYS  72           HA       CYS  72  11.250  -1.284   3.377
  561   1HB   CYS  72          HB2       CYS  72  11.603  -3.280   4.816
  562   2HB   CYS  72          HB1       CYS  72  12.958  -3.759   3.788
  563    H    SER  73           HN       SER  73  12.700  -3.319   0.921
  564    HA   SER  73           HA       SER  73  15.060  -1.627   0.617
  565   1HB   SER  73          HB2       SER  73  14.179  -4.148  -0.413
  566   2HB   SER  73          HB1       SER  73  14.523  -3.111  -1.794
  567    HG   SER  73           HG       SER  73  16.511  -2.588  -0.487
  568    H    MET  74           HN       MET  74  12.105  -2.147  -1.396
  569    HA   MET  74           HA       MET  74  12.552  -0.020  -3.206
  570   1HB   MET  74          HB2       MET  74   9.986  -1.157  -2.062
  571   2HB   MET  74          HB1       MET  74   9.979   0.125  -3.269
  572   1HG   MET  74          HG2       MET  74  11.526  -1.464  -4.640
  573   2HG   MET  74          HG1       MET  74  10.934  -2.718  -3.552
  574   1HE   MET  74          HE1       MET  74   7.290  -3.042  -4.065
  575   2HE   MET  74          HE2       MET  74   7.712  -1.637  -3.082
  576   3HE   MET  74          HE3       MET  74   8.685  -3.103  -2.972
  577    H    LEU  75           HN       LEU  75  10.979   0.028  -0.006
  578    HA   LEU  75           HA       LEU  75  10.326   2.804  -0.001
  579   1HB   LEU  75          HB2       LEU  75  11.109   1.038   2.343
  580   2HB   LEU  75          HB1       LEU  75  10.297   2.597   2.468
  581    HG   LEU  75           HG       LEU  75   9.179   0.195   0.991
  582   1HD1  LEU  75          HD11      LEU  75   9.095  -0.427   3.264
  583   2HD1  LEU  75          HD12      LEU  75   7.515   0.305   2.984
  584   3HD1  LEU  75          HD13      LEU  75   8.780   1.225   3.798
  585   1HD2  LEU  75          HD21      LEU  75   8.134   2.047   0.020
  586   2HD2  LEU  75          HD22      LEU  75   8.210   3.002   1.502
  587   3HD2  LEU  75          HD23      LEU  75   7.038   1.693   1.352
  588    H    HIS  76           HN       HIS  76  13.345   1.144   0.269
  589    HA   HIS  76           HA       HIS  76  15.518   1.910   0.713
  590   1HB   HIS  76          HB2       HIS  76  14.117   4.114  -0.786
  591   2HB   HIS  76          HB1       HIS  76  15.775   4.367  -0.233
  592    HD1  HIS  76           HD1      HIS  76  17.382   2.118  -0.893
  593    HD2  HIS  76           HD2      HIS  76  14.076   2.975  -3.283
  594    HE1  HIS  76           HE1      HIS  76  17.772   0.944  -3.104
  595    H    LEU  77           HN       LEU  77  14.528   1.848   3.088
  596    HA   LEU  77           HA       LEU  77  14.344   4.527   4.323
  597   1HB   LEU  77          HB2       LEU  77  14.279   1.748   5.542
  598   2HB   LEU  77          HB1       LEU  77  13.987   3.244   6.424
  599    HG   LEU  77           HG       LEU  77  12.356   2.553   3.975
  600   1HD1  LEU  77          HD11      LEU  77  10.642   1.673   5.648
  601   2HD1  LEU  77          HD12      LEU  77  11.958   1.607   6.822
  602   3HD1  LEU  77          HD13      LEU  77  12.033   0.627   5.357
  603   1HD2  LEU  77          HD21      LEU  77  12.092   4.827   4.759
  604   2HD2  LEU  77          HD22      LEU  77  11.929   4.290   6.431
  605   3HD2  LEU  77          HD23      LEU  77  10.661   3.933   5.262
  606    H    CYS  78           HN       CYS  78  16.645   1.936   3.894
  607    HA   CYS  78           HA       CYS  78  18.471   2.740   5.981
  608   1HB   CYS  78          HB2       CYS  78  19.123   1.264   3.416
  609   2HB   CYS  78          HB1       CYS  78  20.046   1.241   4.918
  610    H    SER  79           HN       SER  79  17.725   4.021   2.878
  611    HA   SER  79           HA       SER  79  20.241   5.154   2.160
  612   1HB   SER  79          HB2       SER  79  19.006   6.577   0.681
  613   2HB   SER  79          HB1       SER  79  18.128   5.051   0.738
  614    HG   SER  79           HG       SER  79  17.161   7.397   1.235
  615    H    GLY  80           HN       GLY  80  21.254   6.043   4.004
  616   1HA   GLY  80          HA2       GLY  80  19.872   8.072   5.617
  617   2HA   GLY  80          HA1       GLY  80  21.549   7.556   5.808
  618    H    LEU  81           HN       LEU  81  22.215   7.924   3.018
  619    HA   LEU  81           HA       LEU  81  22.149  10.897   2.772
  620   1HB   LEU  81          HB2       LEU  81  24.432  10.451   1.572
  621   2HB   LEU  81          HB1       LEU  81  24.391  10.452   3.332
  622    HG   LEU  81           HG       LEU  81  24.260   8.034   3.387
  623   1HD1  LEU  81          HD11      LEU  81  24.640   6.829   1.115
  624   2HD1  LEU  81          HD12      LEU  81  24.049   8.320   0.382
  625   3HD1  LEU  81          HD13      LEU  81  23.012   7.400   1.473
  626   1HD2  LEU  81          HD21      LEU  81  26.472   7.538   2.202
  627   2HD2  LEU  81          HD22      LEU  81  26.492   8.868   3.361
  628   3HD2  LEU  81          HD23      LEU  81  26.422   9.207   1.633
  629    H    VAL  82           HN       VAL  82  23.143  11.179   0.286
  630    HA   VAL  82           HA       VAL  82  21.029   9.955  -1.303
  631    HB   VAL  82           HB       VAL  82  22.245  11.201  -3.229
  632   1HG1  VAL  82          HG11      VAL  82  21.051  12.742  -0.906
  633   2HG1  VAL  82          HG12      VAL  82  20.138  11.934  -2.183
  634   3HG1  VAL  82          HG13      VAL  82  21.172  13.312  -2.572
  635   1HG2  VAL  82          HG21      VAL  82  24.366  11.482  -1.909
  636   2HG2  VAL  82          HG22      VAL  82  23.497  12.559  -0.816
  637   3HG2  VAL  82          HG23      VAL  82  23.716  13.009  -2.506
  638    HA   PRO  83           HA       PRO  83  23.486   6.367  -2.229
  639   1HB   PRO  83          HB2       PRO  83  22.190   6.243  -4.883
  640   2HB   PRO  83          HB1       PRO  83  22.158   5.064  -3.562
  641   1HG   PRO  83          HG2       PRO  83  20.036   6.774  -4.264
  642   2HG   PRO  83          HG1       PRO  83  20.197   5.891  -2.741
  643   1HD   PRO  83          HD2       PRO  83  20.458   8.781  -3.194
  644   2HD   PRO  83          HD1       PRO  83  20.385   7.880  -1.657
  645    H    ARG  84           HN       ARG  84  25.536   6.193  -3.251
  646    HA   ARG  84           HA       ARG  84  26.431   8.471  -4.855
  647   1HB   ARG  84          HB2       ARG  84  27.759   5.949  -3.848
  648   2HB   ARG  84          HB1       ARG  84  28.580   7.034  -4.969
  649   1HG   ARG  84          HG2       ARG  84  29.198   7.652  -2.705
  650   2HG   ARG  84          HG1       ARG  84  28.179   8.916  -3.374
  651   1HD   ARG  84          HD2       ARG  84  26.307   8.246  -2.124
  652   2HD   ARG  84          HD1       ARG  84  26.975   6.659  -1.768
  653    HE   ARG  84           HE       ARG  84  27.300   9.082  -0.224
  654   1HH1  ARG  84          HH21      ARG  84  29.073   6.324  -1.319
  655   2HH1  ARG  84          HH22      ARG  84  30.332   6.521  -0.144
  656   1HH2  ARG  84          HH11      ARG  84  28.921   9.335   1.297
  657   2HH2  ARG  84          HH12      ARG  84  30.245   8.221   1.331
  Start of MODEL    5
    1   1H    SER   1           HT1      SER   1  21.677   8.370   8.309
    2   2H    SER   1           HT2      SER   1  21.099   9.044   9.757
    3   3H    SER   1           HT3      SER   1  20.007   8.503   8.573
    4    HA   SER   1           HA       SER   1  21.934   6.654   9.833
    5   1HB   SER   1          HB2       SER   1  20.125   6.048  11.419
    6   2HB   SER   1          HB1       SER   1  20.662   7.708  11.652
    7    HG   SER   1           HG       SER   1  18.288   6.709  10.544
    8    H    ASP   2           HN       ASP   2  20.674   4.446   9.894
    9    HA   ASP   2           HA       ASP   2  18.676   4.106   7.775
   10   1HB   ASP   2          HB2       ASP   2  21.458   2.938   7.496
   11   2HB   ASP   2          HB1       ASP   2  20.081   2.521   6.477
   12    H    VAL   3           HN       VAL   3  18.713   3.576  10.570
   13    HA   VAL   3           HA       VAL   3  19.167   0.698  10.918
   14    HB   VAL   3           HB       VAL   3  19.481   2.499  12.689
   15   1HG1  VAL   3          HG11      VAL   3  17.610   3.288  13.919
   16   2HG1  VAL   3          HG12      VAL   3  16.510   2.236  13.033
   17   3HG1  VAL   3          HG13      VAL   3  17.283   3.600  12.217
   18   1HG2  VAL   3          HG21      VAL   3  19.437   0.062  13.161
   19   2HG2  VAL   3          HG22      VAL   3  17.691   0.166  13.382
   20   3HG2  VAL   3          HG23      VAL   3  18.770   1.007  14.493
   21    H    TYR   4           HN       TYR   4  16.637   2.765   9.913
   22    HA   TYR   4           HA       TYR   4  14.364   1.291  10.761
   23   1HB   TYR   4          HB2       TYR   4  14.393   2.536   8.024
   24   2HB   TYR   4          HB1       TYR   4  13.132   2.570   9.253
   25    HD1  TYR   4           HD1      TYR   4  14.420   4.895   7.628
   26    HD2  TYR   4           HD2      TYR   4  15.090   3.365  11.598
   27    HE1  TYR   4           HE1      TYR   4  15.217   7.121   8.353
   28    HE2  TYR   4           HE2      TYR   4  15.890   5.595  12.312
   29    HH   TYR   4           HH       TYR   4  16.043   8.326  10.020
   30    H    CYS   5           HN       CYS   5  16.515   0.876   7.975
   31    HA   CYS   5           HA       CYS   5  15.215  -1.017   6.443
   32   1HB   CYS   5          HB2       CYS   5  18.097  -1.356   7.305
   33   2HB   CYS   5          HB1       CYS   5  17.365  -1.848   5.778
   34    H    GLU   6           HN       GLU   6  16.838  -1.581   9.561
   35    HA   GLU   6           HA       GLU   6  16.245  -4.443   9.520
   36   1HB   GLU   6          HB2       GLU   6  17.227  -2.570  11.691
   37   2HB   GLU   6          HB1       GLU   6  16.995  -4.302  11.936
   38   1HG   GLU   6          HG2       GLU   6  18.621  -4.832  10.230
   39   2HG   GLU   6          HG1       GLU   6  18.744  -3.138   9.753
   40    H    VAL   7           HN       VAL   7  14.959  -1.610  11.281
   41    HA   VAL   7           HA       VAL   7  12.905  -3.113  12.643
   42    HB   VAL   7           HB       VAL   7  12.759  -0.163  11.998
   43   1HG1  VAL   7          HG11      VAL   7  11.944  -1.802  14.416
   44   2HG1  VAL   7          HG12      VAL   7  10.846  -1.230  13.161
   45   3HG1  VAL   7          HG13      VAL   7  11.676  -0.073  14.201
   46   1HG2  VAL   7          HG21      VAL   7  14.086   0.097  14.166
   47   2HG2  VAL   7          HG22      VAL   7  15.009  -0.442  12.765
   48   3HG2  VAL   7          HG23      VAL   7  14.516  -1.604  13.997
   49    H    CYS   8           HN       CYS   8  12.518  -0.641  10.088
   50    HA   CYS   8           HA       CYS   8   9.883  -1.090   9.395
   51   1HB   CYS   8          HB2       CYS   8  10.900   0.675   8.245
   52   2HB   CYS   8          HB1       CYS   8  12.289  -0.292   7.776
   53    H    GLU   9           HN       GLU   9  12.671  -3.084   8.417
   54    HA   GLU   9           HA       GLU   9  11.179  -4.707   6.548
   55   1HB   GLU   9          HB2       GLU   9  13.679  -4.836   6.635
   56   2HB   GLU   9          HB1       GLU   9  13.568  -5.640   8.208
   57   1HG   GLU   9          HG2       GLU   9  12.091  -6.737   5.814
   58   2HG   GLU   9          HG1       GLU   9  13.797  -7.104   6.064
   59    H    PHE  10           HN       PHE  10  11.678  -4.975  10.043
   60    HA   PHE  10           HA       PHE  10  10.303  -7.504  10.289
   61   1HB   PHE  10          HB2       PHE  10  11.855  -6.809  12.015
   62   2HB   PHE  10          HB1       PHE  10  10.932  -5.337  12.310
   63    HD1  PHE  10           HD1      PHE  10  10.823  -9.049  12.541
   64    HD2  PHE  10           HD2      PHE  10   9.002  -5.341  13.714
   65    HE1  PHE  10           HE1      PHE  10   9.408 -10.262  14.177
   66    HE2  PHE  10           HE2      PHE  10   7.587  -6.552  15.350
   67    HZ   PHE  10           HZ       PHE  10   7.790  -9.013  15.582
   68    H    LEU  11           HN       LEU  11   9.220  -4.189  10.110
   69    HA   LEU  11           HA       LEU  11   6.600  -4.764  11.276
   70   1HB   LEU  11          HB2       LEU  11   7.662  -2.381   9.738
   71   2HB   LEU  11          HB1       LEU  11   6.047  -2.457  10.440
   72    HG   LEU  11           HG       LEU  11   8.622  -2.794  12.008
   73   1HD1  LEU  11          HD11      LEU  11   8.174  -0.528  12.849
   74   2HD1  LEU  11          HD12      LEU  11   6.748  -0.416  11.818
   75   3HD1  LEU  11          HD13      LEU  11   8.354  -0.508  11.095
   76   1HD2  LEU  11          HD21      LEU  11   7.035  -3.844  13.347
   77   2HD2  LEU  11          HD22      LEU  11   5.694  -2.897  12.700
   78   3HD2  LEU  11          HD23      LEU  11   6.797  -2.182  13.876
   79    H    VAL  12           HN       VAL  12   7.789  -4.144   7.951
   80    HA   VAL  12           HA       VAL  12   5.209  -4.427   6.761
   81    HB   VAL  12           HB       VAL  12   7.821  -5.115   5.402
   82   1HG1  VAL  12          HG11      VAL  12   6.560  -4.232   3.422
   83   2HG1  VAL  12          HG12      VAL  12   5.131  -4.103   4.443
   84   3HG1  VAL  12          HG13      VAL  12   5.842  -5.682   4.119
   85   1HG2  VAL  12          HG21      VAL  12   7.780  -2.840   6.627
   86   2HG2  VAL  12          HG22      VAL  12   6.515  -2.381   5.494
   87   3HG2  VAL  12          HG23      VAL  12   8.123  -2.795   4.901
   88    H    LYS  13           HN       LYS  13   7.539  -6.848   7.840
   89    HA   LYS  13           HA       LYS  13   6.218  -8.982   6.322
   90   1HB   LYS  13          HB2       LYS  13   7.823 -10.446   7.170
   91   2HB   LYS  13          HB1       LYS  13   8.680  -8.925   7.020
   92   1HG   LYS  13          HG2       LYS  13   9.283  -9.092   9.171
   93   2HG   LYS  13          HG1       LYS  13   7.619  -8.911   9.650
   94   1HD   LYS  13          HD2       LYS  13   8.750 -11.608   8.874
   95   2HD   LYS  13          HD1       LYS  13   8.928 -10.974  10.504
   96   1HE   LYS  13          HE2       LYS  13   6.463 -10.684  10.628
   97   2HE   LYS  13          HE1       LYS  13   6.323 -11.458   9.050
   98   1HZ   LYS  13          HZ1       LYS  13   7.052 -13.472   9.877
   99   2HZ   LYS  13          HZ2       LYS  13   6.086 -12.889  11.147
  100   3HZ   LYS  13          HZ3       LYS  13   7.779 -12.778  11.244
  101    H    GLU  14           HN       GLU  14   5.999  -7.632   9.560
  102    HA   GLU  14           HA       GLU  14   4.335  -9.765  10.631
  103   1HB   GLU  14          HB2       GLU  14   5.687  -8.105  12.008
  104   2HB   GLU  14          HB1       GLU  14   4.471  -6.897  11.596
  105   1HG   GLU  14          HG2       GLU  14   3.815  -7.816  13.710
  106   2HG   GLU  14          HG1       GLU  14   2.729  -8.514  12.508
  107    H    VAL  15           HN       VAL  15   3.549  -6.385   9.773
  108    HA   VAL  15           HA       VAL  15   0.774  -6.496   9.854
  109    HB   VAL  15           HB       VAL  15   2.237  -4.502   9.219
  110   1HG1  VAL  15          HG11      VAL  15   2.805  -4.176   6.911
  111   2HG1  VAL  15          HG12      VAL  15   1.908  -5.612   6.420
  112   3HG1  VAL  15          HG13      VAL  15   3.389  -5.777   7.360
  113   1HG2  VAL  15          HG21      VAL  15   0.428  -3.670   7.528
  114   2HG2  VAL  15          HG22      VAL  15  -0.080  -4.103   9.159
  115   3HG2  VAL  15          HG23      VAL  15  -0.341  -5.229   7.829
  116    H    THR  16           HN       THR  16   2.930  -7.769   7.368
  117    HA   THR  16           HA       THR  16   0.973  -8.558   5.487
  118    HB   THR  16           HB       THR  16   3.033 -10.567   5.621
  119    HG1  THR  16           HG1      THR  16   3.755  -8.697   7.063
  120   1HG2  THR  16          HG21      THR  16   3.833  -9.335   3.588
  121   2HG2  THR  16          HG22      THR  16   2.678  -8.052   3.962
  122   3HG2  THR  16          HG23      THR  16   2.094  -9.669   3.545
  123    H    LYS  17           HN       LYS  17   2.231 -10.227   8.372
  124    HA   LYS  17           HA       LYS  17   0.903 -12.676   8.147
  125   1HB   LYS  17          HB2       LYS  17   1.388 -10.987  10.623
  126   2HB   LYS  17          HB1       LYS  17   0.807 -12.648  10.679
  127   1HG   LYS  17          HG2       LYS  17   3.306 -12.000   9.119
  128   2HG   LYS  17          HG1       LYS  17   3.392 -12.166  10.870
  129   1HD   LYS  17          HD2       LYS  17   2.304 -14.423  10.651
  130   2HD   LYS  17          HD1       LYS  17   2.419 -14.259   8.900
  131   1HE   LYS  17          HE2       LYS  17   4.352 -15.490   9.542
  132   2HE   LYS  17          HE1       LYS  17   4.922 -13.846   9.254
  133   1HZ   LYS  17          HZ1       LYS  17   4.934 -13.405  11.565
  134   2HZ   LYS  17          HZ2       LYS  17   5.725 -14.893  11.355
  135   3HZ   LYS  17          HZ3       LYS  17   4.126 -14.851  11.928
  136    H    LEU  18           HN       LEU  18  -0.409  -9.575   9.318
  137    HA   LEU  18           HA       LEU  18  -3.075 -10.801   9.677
  138   1HB   LEU  18          HB2       LEU  18  -3.444  -9.053  11.091
  139   2HB   LEU  18          HB1       LEU  18  -1.735  -8.694  10.899
  140    HG   LEU  18           HG       LEU  18  -2.384  -7.252   8.897
  141   1HD1  LEU  18          HD11      LEU  18  -4.941  -8.432   9.394
  142   2HD1  LEU  18          HD12      LEU  18  -4.539  -7.194   8.207
  143   3HD1  LEU  18          HD13      LEU  18  -5.094  -6.721   9.810
  144   1HD2  LEU  18          HD21      LEU  18  -1.798  -6.360  11.125
  145   2HD2  LEU  18          HD22      LEU  18  -3.485  -6.500  11.621
  146   3HD2  LEU  18          HD23      LEU  18  -3.033  -5.373  10.343
  147    H    ILE  19           HN       ILE  19  -1.498  -8.530   7.470
  148    HA   ILE  19           HA       ILE  19  -3.853  -8.007   5.885
  149    HB   ILE  19           HB       ILE  19  -0.930  -7.535   5.775
  150   1HG1  ILE  19          HG12      ILE  19  -3.171  -5.704   4.949
  151   2HG1  ILE  19          HG11      ILE  19  -2.649  -5.891   6.623
  152   1HG2  ILE  19          HG21      ILE  19  -1.082  -6.661   3.418
  153   2HG2  ILE  19          HG22      ILE  19  -2.587  -7.567   3.274
  154   3HG2  ILE  19          HG23      ILE  19  -1.070  -8.413   3.586
  155   1HD1  ILE  19          HD11      ILE  19  -1.299  -4.113   6.012
  156   2HD1  ILE  19          HD12      ILE  19  -1.237  -4.606   4.323
  157   3HD1  ILE  19          HD13      ILE  19  -0.231  -5.432   5.515
  158    H    ASP  20           HN       ASP  20  -1.799 -10.690   6.257
  159    HA   ASP  20           HA       ASP  20  -1.407 -11.880   3.828
  160   1HB   ASP  20          HB2       ASP  20  -0.916 -12.922   6.050
  161   2HB   ASP  20          HB1       ASP  20  -2.626 -13.330   6.200
  162    H    ASN  21           HN       ASN  21  -4.544 -11.966   5.592
  163    HA   ASN  21           HA       ASN  21  -5.952 -12.074   3.025
  164   1HB   ASN  21          HB2       ASN  21  -6.098 -14.370   4.990
  165   2HB   ASN  21          HB1       ASN  21  -7.214 -14.143   3.642
  166   1HD2  ASN  21          HD21      ASN  21  -3.788 -14.788   4.427
  167   2HD2  ASN  21          HD22      ASN  21  -3.386 -15.407   2.899
  168    H    ASN  22           HN       ASN  22  -5.769 -10.447   5.562
  169    HA   ASN  22           HA       ASN  22  -8.596 -10.623   6.507
  170   1HB   ASN  22          HB2       ASN  22  -6.327  -8.910   7.561
  171   2HB   ASN  22          HB1       ASN  22  -7.877  -9.220   8.344
  172   1HD2  ASN  22          HD21      ASN  22  -5.663 -11.570   6.706
  173   2HD2  ASN  22          HD22      ASN  22  -5.456 -12.541   8.081
  174    H    LYS  23           HN       LYS  23  -6.205  -8.234   5.408
  175    HA   LYS  23           HA       LYS  23  -8.160  -6.187   4.910
  176   1HB   LYS  23          HB2       LYS  23  -5.416  -6.300   5.180
  177   2HB   LYS  23          HB1       LYS  23  -5.568  -6.098   3.445
  178   1HG   LYS  23          HG2       LYS  23  -6.873  -4.327   5.529
  179   2HG   LYS  23          HG1       LYS  23  -5.392  -3.925   4.668
  180   1HD   LYS  23          HD2       LYS  23  -7.846  -4.629   3.079
  181   2HD   LYS  23          HD1       LYS  23  -7.743  -3.038   3.808
  182   1HE   LYS  23          HE2       LYS  23  -6.792  -3.513   1.350
  183   2HE   LYS  23          HE1       LYS  23  -6.012  -2.358   2.429
  184   1HZ   LYS  23          HZ1       LYS  23  -4.361  -3.779   1.527
  185   2HZ   LYS  23          HZ2       LYS  23  -5.231  -5.176   1.947
  186   3HZ   LYS  23          HZ3       LYS  23  -4.548  -4.201   3.158
  187    H    THR  24           HN       THR  24  -9.740  -7.150   3.527
  188    HA   THR  24           HA       THR  24  -8.858  -8.329   0.964
  189    HB   THR  24           HB       THR  24 -11.317  -8.691   0.631
  190    HG1  THR  24           HG1      THR  24 -11.521  -6.836   2.399
  191   1HG2  THR  24          HG21      THR  24 -11.504 -10.300   2.593
  192   2HG2  THR  24          HG22      THR  24  -9.973  -9.637   3.167
  193   3HG2  THR  24          HG23      THR  24 -10.047 -10.466   1.612
  194    H    GLU  25           HN       GLU  25 -10.538  -7.559  -0.910
  195    HA   GLU  25           HA       GLU  25 -10.027  -4.630  -1.186
  196   1HB   GLU  25          HB2       GLU  25 -10.887  -6.489  -3.401
  197   2HB   GLU  25          HB1       GLU  25 -10.015  -4.960  -3.520
  198   1HG   GLU  25          HG2       GLU  25  -8.082  -6.010  -2.346
  199   2HG   GLU  25          HG1       GLU  25  -8.950  -7.545  -2.345
  200    H    LYS  26           HN       LYS  26 -12.480  -6.234   0.058
  201    HA   LYS  26           HA       LYS  26 -14.660  -5.182  -1.627
  202   1HB   LYS  26          HB2       LYS  26 -15.064  -6.350   1.125
  203   2HB   LYS  26          HB1       LYS  26 -16.101  -6.465  -0.297
  204   1HG   LYS  26          HG2       LYS  26 -13.436  -7.845   0.096
  205   2HG   LYS  26          HG1       LYS  26 -15.026  -8.607   0.090
  206   1HD   LYS  26          HD2       LYS  26 -15.340  -7.702  -2.259
  207   2HD   LYS  26          HD1       LYS  26 -13.634  -7.251  -2.230
  208   1HE   LYS  26          HE2       LYS  26 -12.980  -9.553  -1.844
  209   2HE   LYS  26          HE1       LYS  26 -14.670 -10.043  -1.716
  210   1HZ   LYS  26          HZ1       LYS  26 -15.035  -9.523  -3.982
  211   2HZ   LYS  26          HZ2       LYS  26 -13.616 -10.455  -3.924
  212   3HZ   LYS  26          HZ3       LYS  26 -13.522  -8.771  -4.135
  213    H    GLU  27           HN       GLU  27 -13.329  -4.697   1.633
  214    HA   GLU  27           HA       GLU  27 -15.035  -2.439   2.199
  215   1HB   GLU  27          HB2       GLU  27 -12.432  -3.332   3.474
  216   2HB   GLU  27          HB1       GLU  27 -13.492  -2.080   4.124
  217   1HG   GLU  27          HG2       GLU  27 -14.389  -4.923   3.580
  218   2HG   GLU  27          HG1       GLU  27 -13.842  -4.352   5.157
  219    H    ILE  28           HN       ILE  28 -12.332  -2.869   0.216
  220    HA   ILE  28           HA       ILE  28 -11.295  -0.131   0.519
  221    HB   ILE  28           HB       ILE  28 -10.602  -2.372  -1.397
  222   1HG1  ILE  28          HG12      ILE  28 -10.029  -2.943   0.908
  223   2HG1  ILE  28          HG11      ILE  28  -8.559  -2.577   0.015
  224   1HG2  ILE  28          HG21      ILE  28  -9.975  -0.363  -2.455
  225   2HG2  ILE  28          HG22      ILE  28  -8.505  -0.935  -1.674
  226   3HG2  ILE  28          HG23      ILE  28  -9.437   0.364  -0.941
  227   1HD1  ILE  28          HD11      ILE  28  -9.902  -1.009   2.180
  228   2HD1  ILE  28          HD12      ILE  28  -8.989  -0.126   0.959
  229   3HD1  ILE  28          HD13      ILE  28  -8.192  -1.346   1.942
  230    H    LEU  29           HN       LEU  29 -12.150  -1.936  -2.440
  231    HA   LEU  29           HA       LEU  29 -12.619   0.234  -4.093
  232   1HB   LEU  29          HB2       LEU  29 -14.193  -2.357  -4.010
  233   2HB   LEU  29          HB1       LEU  29 -14.194  -1.227  -5.362
  234    HG   LEU  29           HG       LEU  29 -11.598  -2.347  -4.290
  235   1HD1  LEU  29          HD11      LEU  29 -12.841  -4.328  -4.781
  236   2HD1  LEU  29          HD12      LEU  29 -11.796  -4.043  -6.172
  237   3HD1  LEU  29          HD13      LEU  29 -13.508  -3.625  -6.255
  238   1HD2  LEU  29          HD21      LEU  29 -10.975  -1.994  -6.742
  239   2HD2  LEU  29          HD22      LEU  29 -11.294  -0.524  -5.829
  240   3HD2  LEU  29          HD23      LEU  29 -12.514  -1.160  -6.931
  241    H    ASP  30           HN       ASP  30 -14.668  -0.959  -1.517
  242    HA   ASP  30           HA       ASP  30 -16.985   0.645  -2.279
  243   1HB   ASP  30          HB2       ASP  30 -16.158  -0.747   0.283
  244   2HB   ASP  30          HB1       ASP  30 -17.632   0.215   0.170
  245    H    ALA  31           HN       ALA  31 -14.327   0.939   0.060
  246    HA   ALA  31           HA       ALA  31 -15.003   3.364   1.260
  247   1HB   ALA  31          HB1       ALA  31 -13.069   1.952   1.877
  248   2HB   ALA  31          HB2       ALA  31 -12.666   3.662   1.733
  249   3HB   ALA  31          HB3       ALA  31 -12.225   2.540   0.443
  250    H    PHE  32           HN       PHE  32 -13.001   2.975  -1.696
  251    HA   PHE  32           HA       PHE  32 -12.805   5.761  -2.216
  252   1HB   PHE  32          HB2       PHE  32 -13.054   3.670  -4.393
  253   2HB   PHE  32          HB1       PHE  32 -12.169   5.188  -4.455
  254    HD1  PHE  32           HD1      PHE  32 -10.859   4.911  -1.635
  255    HD2  PHE  32           HD2      PHE  32 -11.251   2.212  -4.953
  256    HE1  PHE  32           HE1      PHE  32  -8.803   3.744  -0.927
  257    HE2  PHE  32           HE2      PHE  32  -9.191   1.043  -4.238
  258    HZ   PHE  32           HZ       PHE  32  -7.966   1.810  -2.227
  259    H    ASP  33           HN       ASP  33 -15.394   3.464  -2.813
  260    HA   ASP  33           HA       ASP  33 -16.924   5.335  -4.458
  261   1HB   ASP  33          HB2       ASP  33 -17.211   2.863  -4.647
  262   2HB   ASP  33          HB1       ASP  33 -17.845   2.834  -3.001
  263    H    LYS  34           HN       LYS  34 -16.055   5.355  -1.307
  264    HA   LYS  34           HA       LYS  34 -18.610   6.636  -0.383
  265   1HB   LYS  34          HB2       LYS  34 -16.449   5.133   1.114
  266   2HB   LYS  34          HB1       LYS  34 -17.652   6.124   1.934
  267   1HG   LYS  34          HG2       LYS  34 -19.406   4.686   1.414
  268   2HG   LYS  34          HG1       LYS  34 -18.632   4.090  -0.053
  269   1HD   LYS  34          HD2       LYS  34 -18.762   2.440   1.888
  270   2HD   LYS  34          HD1       LYS  34 -17.163   2.665   1.189
  271   1HE   LYS  34          HE2       LYS  34 -16.370   3.826   3.042
  272   2HE   LYS  34          HE1       LYS  34 -17.972   4.408   3.493
  273   1HZ   LYS  34          HZ1       LYS  34 -18.005   2.760   4.956
  274   2HZ   LYS  34          HZ2       LYS  34 -16.617   2.036   4.300
  275   3HZ   LYS  34          HZ3       LYS  34 -18.148   1.684   3.653
  276    H    MET  35           HN       MET  35 -15.075   6.782   0.288
  277    HA   MET  35           HA       MET  35 -15.285   9.545   1.181
  278   1HB   MET  35          HB2       MET  35 -12.670   8.351   0.284
  279   2HB   MET  35          HB1       MET  35 -12.980   9.482   1.591
  280   1HG   MET  35          HG2       MET  35 -13.740   7.804   3.045
  281   2HG   MET  35          HG1       MET  35 -14.067   6.669   1.739
  282   1HE   MET  35          HE1       MET  35 -12.534   6.047   0.096
  283   2HE   MET  35          HE2       MET  35 -11.160   5.084   0.634
  284   3HE   MET  35          HE3       MET  35 -10.897   6.711   0.013
  285    H    CYS  36           HN       CYS  36 -13.961   7.945  -1.706
  286    HA   CYS  36           HA       CYS  36 -13.430  10.465  -3.042
  287   1HB   CYS  36          HB2       CYS  36 -12.921   7.659  -3.481
  288   2HB   CYS  36          HB1       CYS  36 -13.650   8.318  -4.947
  289    H    SER  37           HN       SER  37 -16.217   9.406  -2.026
  290    HA   SER  37           HA       SER  37 -17.837   9.564  -4.469
  291   1HB   SER  37          HB2       SER  37 -18.364   8.141  -2.391
  292   2HB   SER  37          HB1       SER  37 -18.852   9.647  -1.624
  293    HG   SER  37           HG       SER  37 -20.644   9.500  -2.693
  294    H    LYS  38           HN       LYS  38 -17.441  11.491  -1.481
  295    HA   LYS  38           HA       LYS  38 -19.090  13.672  -2.386
  296   1HB   LYS  38          HB2       LYS  38 -18.039  14.931  -0.513
  297   2HB   LYS  38          HB1       LYS  38 -18.613  13.343  -0.003
  298   1HG   LYS  38          HG2       LYS  38 -16.226  12.517  -0.510
  299   2HG   LYS  38          HG1       LYS  38 -15.772  14.216  -0.542
  300   1HD   LYS  38          HD2       LYS  38 -16.867  14.412   1.755
  301   2HD   LYS  38          HD1       LYS  38 -16.935  12.648   1.767
  302   1HE   LYS  38          HE2       LYS  38 -14.900  13.428   2.904
  303   2HE   LYS  38          HE1       LYS  38 -14.484  12.558   1.426
  304   1HZ   LYS  38          HZ1       LYS  38 -13.356  14.793   1.874
  305   2HZ   LYS  38          HZ2       LYS  38 -14.837  15.488   1.414
  306   3HZ   LYS  38          HZ3       LYS  38 -13.977  14.515   0.320
  307    H    LEU  39           HN       LEU  39 -15.761  12.791  -2.906
  308    HA   LEU  39           HA       LEU  39 -14.471  15.144  -3.500
  309   1HB   LEU  39          HB2       LEU  39 -14.141  12.393  -4.246
  310   2HB   LEU  39          HB1       LEU  39 -14.007  13.305  -5.732
  311    HG   LEU  39           HG       LEU  39 -12.388  14.761  -3.931
  312   1HD1  LEU  39          HD11      LEU  39 -11.621  11.870  -3.627
  313   2HD1  LEU  39          HD12      LEU  39 -12.673  12.658  -2.451
  314   3HD1  LEU  39          HD13      LEU  39 -11.042  13.272  -2.726
  315   1HD2  LEU  39          HD21      LEU  39 -11.556  12.596  -5.885
  316   2HD2  LEU  39          HD22      LEU  39 -10.538  13.911  -5.294
  317   3HD2  LEU  39          HD23      LEU  39 -11.935  14.264  -6.309
  318    HA   PRO  40           HA       PRO  40 -16.924  17.190  -6.631
  319   1HB   PRO  40          HB2       PRO  40 -14.526  17.988  -8.135
  320   2HB   PRO  40          HB1       PRO  40 -15.662  19.009  -7.242
  321   1HG   PRO  40          HG2       PRO  40 -13.009  18.306  -6.443
  322   2HG   PRO  40          HG1       PRO  40 -14.215  19.166  -5.471
  323   1HD   PRO  40          HD2       PRO  40 -13.263  16.454  -5.117
  324   2HD   PRO  40          HD1       PRO  40 -14.438  17.333  -4.122
  325    H    LYS  41           HN       LYS  41 -17.855  16.246  -8.409
  326    HA   LYS  41           HA       LYS  41 -17.354  13.789  -9.447
  327   1HB   LYS  41          HB2       LYS  41 -19.236  15.329 -10.071
  328   2HB   LYS  41          HB1       LYS  41 -18.131  16.118 -11.197
  329   1HG   LYS  41          HG2       LYS  41 -17.824  14.085 -12.438
  330   2HG   LYS  41          HG1       LYS  41 -18.728  13.155 -11.242
  331   1HD   LYS  41          HD2       LYS  41 -20.786  13.955 -11.957
  332   2HD   LYS  41          HD1       LYS  41 -20.129  15.507 -12.472
  333   1HE   LYS  41          HE2       LYS  41 -19.124  14.481 -14.433
  334   2HE   LYS  41          HE1       LYS  41 -19.651  12.883 -13.909
  335   1HZ   LYS  41          HZ1       LYS  41 -21.887  14.533 -13.892
  336   2HZ   LYS  41          HZ2       LYS  41 -21.558  13.243 -14.948
  337   3HZ   LYS  41          HZ3       LYS  41 -21.090  14.823 -15.360
  338    H    SER  42           HN       SER  42 -15.852  16.745 -10.665
  339    HA   SER  42           HA       SER  42 -14.404  15.664 -12.827
  340   1HB   SER  42          HB2       SER  42 -13.457  17.807 -10.910
  341   2HB   SER  42          HB1       SER  42 -12.903  17.568 -12.565
  342    HG   SER  42           HG       SER  42 -15.644  17.811 -12.186
  343    H    LEU  43           HN       LEU  43 -13.074  16.332  -9.587
  344    HA   LEU  43           HA       LEU  43 -10.778  14.621 -10.101
  345   1HB   LEU  43          HB2       LEU  43 -11.764  16.122  -7.672
  346   2HB   LEU  43          HB1       LEU  43 -10.289  15.154  -7.656
  347    HG   LEU  43           HG       LEU  43 -10.692  17.242  -9.796
  348   1HD1  LEU  43          HD11      LEU  43 -11.086  18.518  -7.803
  349   2HD1  LEU  43          HD12      LEU  43  -9.412  18.817  -8.273
  350   3HD1  LEU  43          HD13      LEU  43  -9.771  17.707  -6.951
  351   1HD2  LEU  43          HD21      LEU  43  -8.778  15.771 -10.079
  352   2HD2  LEU  43          HD22      LEU  43  -8.278  16.026  -8.407
  353   3HD2  LEU  43          HD23      LEU  43  -8.181  17.348  -9.568
  354    H    SER  44           HN       SER  44 -13.930  13.865  -9.333
  355    HA   SER  44           HA       SER  44 -13.272  11.684  -7.447
  356   1HB   SER  44          HB2       SER  44 -15.571  11.431  -7.152
  357   2HB   SER  44          HB1       SER  44 -15.515  13.131  -7.601
  358    HG   SER  44           HG       SER  44 -16.045  10.895  -9.270
  359    H    GLU  45           HN       GLU  45 -13.770  12.366 -10.787
  360    HA   GLU  45           HA       GLU  45 -14.059   9.577 -11.571
  361   1HB   GLU  45          HB2       GLU  45 -13.665  12.146 -13.115
  362   2HB   GLU  45          HB1       GLU  45 -13.722  10.569 -13.902
  363   1HG   GLU  45          HG2       GLU  45 -15.958  10.162 -13.051
  364   2HG   GLU  45          HG1       GLU  45 -15.903  11.642 -12.092
  365    H    GLU  46           HN       GLU  46 -11.558  12.001 -11.259
  366    HA   GLU  46           HA       GLU  46  -9.518  10.396 -12.598
  367   1HB   GLU  46          HB2       GLU  46  -9.232  12.834 -10.816
  368   2HB   GLU  46          HB1       GLU  46  -7.973  12.154 -11.847
  369   1HG   GLU  46          HG2       GLU  46 -10.646  13.106 -12.906
  370   2HG   GLU  46          HG1       GLU  46  -9.209  14.128 -12.847
  371    H    CYS  47           HN       CYS  47 -10.552  10.987  -9.251
  372    HA   CYS  47           HA       CYS  47  -8.271   9.637  -8.091
  373   1HB   CYS  47          HB2       CYS  47  -9.263  10.002  -6.023
  374   2HB   CYS  47          HB1       CYS  47  -9.987  11.284  -6.981
  375    H    GLN  48           HN       GLN  48 -11.347   8.623  -9.383
  376    HA   GLN  48           HA       GLN  48 -11.097   5.902  -8.285
  377   1HB   GLN  48          HB2       GLN  48 -13.142   7.443  -9.838
  378   2HB   GLN  48          HB1       GLN  48 -13.131   5.695 -10.064
  379   1HG   GLN  48          HG2       GLN  48 -13.071   6.856  -7.278
  380   2HG   GLN  48          HG1       GLN  48 -14.600   6.721  -8.147
  381   1HE2  GLN  48          HE21      GLN  48 -14.170   4.268  -9.532
  382   2HE2  GLN  48          HE22      GLN  48 -14.037   3.015  -8.394
  383    H    GLU  49           HN       GLU  49 -10.033   7.755 -10.912
  384    HA   GLU  49           HA       GLU  49  -9.876   5.648 -12.858
  385   1HB   GLU  49          HB2       GLU  49  -9.822   8.094 -13.412
  386   2HB   GLU  49          HB1       GLU  49  -8.230   8.186 -12.660
  387   1HG   GLU  49          HG2       GLU  49  -7.921   7.920 -15.040
  388   2HG   GLU  49          HG1       GLU  49  -7.451   6.414 -14.257
  389    H    VAL  50           HN       VAL  50  -7.785   6.919 -10.306
  390    HA   VAL  50           HA       VAL  50  -5.541   5.241 -11.121
  391    HB   VAL  50           HB       VAL  50  -5.885   6.722  -8.512
  392   1HG1  VAL  50          HG11      VAL  50  -3.539   5.509 -10.013
  393   2HG1  VAL  50          HG12      VAL  50  -4.157   5.024  -8.432
  394   3HG1  VAL  50          HG13      VAL  50  -3.359   6.586  -8.623
  395   1HG2  VAL  50          HG21      VAL  50  -4.373   8.389  -9.731
  396   2HG2  VAL  50          HG22      VAL  50  -6.049   8.344 -10.280
  397   3HG2  VAL  50          HG23      VAL  50  -4.789   7.538 -11.218
  398    H    VAL  51           HN       VAL  51  -7.924   5.090  -8.369
  399    HA   VAL  51           HA       VAL  51  -6.793   2.820  -7.107
  400    HB   VAL  51           HB       VAL  51  -8.950   2.275  -6.216
  401   1HG1  VAL  51          HG11      VAL  51  -8.565   5.231  -6.683
  402   2HG1  VAL  51          HG12      VAL  51  -8.200   4.293  -5.239
  403   3HG1  VAL  51          HG13      VAL  51  -9.876   4.614  -5.680
  404   1HG2  VAL  51          HG21      VAL  51 -11.008   3.471  -7.236
  405   2HG2  VAL  51          HG22      VAL  51 -10.350   2.086  -8.106
  406   3HG2  VAL  51          HG23      VAL  51  -9.984   3.718  -8.647
  407    H    ASP  52           HN       ASP  52  -8.836   3.007  -9.999
  408    HA   ASP  52           HA       ASP  52  -9.041   0.204 -10.493
  409   1HB   ASP  52          HB2       ASP  52 -10.267   1.953 -11.804
  410   2HB   ASP  52          HB1       ASP  52  -8.736   2.436 -12.536
  411    H    THR  53           HN       THR  53  -6.539   2.625 -11.222
  412    HA   THR  53           HA       THR  53  -4.779   0.655 -12.438
  413    HB   THR  53           HB       THR  53  -4.219   3.483 -11.656
  414    HG1  THR  53           HG1      THR  53  -5.397   3.794 -13.344
  415   1HG2  THR  53          HG21      THR  53  -2.657   1.605 -13.433
  416   2HG2  THR  53          HG22      THR  53  -2.180   2.048 -11.797
  417   3HG2  THR  53          HG23      THR  53  -2.236   3.274 -13.060
  418    H    TYR  54           HN       TYR  54  -5.427   1.800  -9.291
  419    HA   TYR  54           HA       TYR  54  -3.195   0.114  -8.215
  420   1HB   TYR  54          HB2       TYR  54  -4.096   2.830  -7.241
  421   2HB   TYR  54          HB1       TYR  54  -3.070   1.744  -6.305
  422    HD1  TYR  54           HD1      TYR  54  -3.340   3.262  -9.667
  423    HD2  TYR  54           HD2      TYR  54  -0.740   1.853  -6.599
  424    HE1  TYR  54           HE1      TYR  54  -1.419   4.146 -10.942
  425    HE2  TYR  54           HE2      TYR  54   1.223   2.715  -7.855
  426    HH   TYR  54           HH       TYR  54   0.815   4.675 -10.763
  427    H    GLY  55           HN       GLY  55  -4.978  -1.481  -8.093
  428   1HA   GLY  55          HA2       GLY  55  -6.456  -1.181  -5.541
  429   2HA   GLY  55          HA1       GLY  55  -7.410  -1.511  -6.993
  430    H    SER  56           HN       SER  56  -7.310  -3.631  -7.908
  431    HA   SER  56           HA       SER  56  -6.923  -5.769  -6.174
  432   1HB   SER  56          HB2       SER  56  -8.040  -6.165  -8.263
  433   2HB   SER  56          HB1       SER  56  -6.625  -5.671  -9.187
  434    HG   SER  56           HG       SER  56  -7.083  -8.038  -8.792
  435    H    SER  57           HN       SER  57  -4.443  -3.873  -7.675
  436    HA   SER  57           HA       SER  57  -2.385  -5.969  -7.198
  437   1HB   SER  57          HB2       SER  57  -2.239  -3.204  -8.433
  438   2HB   SER  57          HB1       SER  57  -0.806  -4.169  -8.067
  439    HG   SER  57           HG       SER  57  -2.587  -5.704  -9.321
  440    H    ILE  58           HN       ILE  58  -2.084  -2.488  -6.596
  441    HA   ILE  58           HA       ILE  58  -0.439  -2.271  -4.504
  442    HB   ILE  58           HB       ILE  58  -1.850  -0.436  -5.395
  443   1HG1  ILE  58          HG12      ILE  58  -1.667  -0.795  -2.398
  444   2HG1  ILE  58          HG11      ILE  58  -0.608   0.163  -3.440
  445   1HG2  ILE  58          HG21      ILE  58  -3.984  -1.846  -5.087
  446   2HG2  ILE  58          HG22      ILE  58  -4.077  -0.117  -4.771
  447   3HG2  ILE  58          HG23      ILE  58  -3.949  -1.237  -3.428
  448   1HD1  ILE  58          HD11      ILE  58  -2.728   1.542  -3.992
  449   2HD1  ILE  58          HD12      ILE  58  -2.018   1.765  -2.392
  450   3HD1  ILE  58          HD13      ILE  58  -3.453   0.748  -2.589
  451    H    LEU  59           HN       LEU  59  -3.802  -3.313  -4.082
  452    HA   LEU  59           HA       LEU  59  -3.444  -3.786  -1.247
  453   1HB   LEU  59          HB2       LEU  59  -5.575  -5.181  -2.876
  454   2HB   LEU  59          HB1       LEU  59  -5.643  -4.665  -1.195
  455    HG   LEU  59           HG       LEU  59  -5.460  -2.744  -3.502
  456   1HD1  LEU  59          HD11      LEU  59  -7.514  -4.131  -3.630
  457   2HD1  LEU  59          HD12      LEU  59  -7.846  -2.427  -3.329
  458   3HD1  LEU  59          HD13      LEU  59  -7.930  -3.587  -2.004
  459   1HD2  LEU  59          HD21      LEU  59  -4.744  -1.888  -1.280
  460   2HD2  LEU  59          HD22      LEU  59  -6.315  -2.352  -0.626
  461   3HD2  LEU  59          HD23      LEU  59  -6.204  -1.095  -1.857
  462    H    SER  60           HN       SER  60  -3.715  -6.033  -4.053
  463    HA   SER  60           HA       SER  60  -2.907  -8.294  -2.357
  464   1HB   SER  60          HB2       SER  60  -4.533  -8.399  -4.326
  465   2HB   SER  60          HB1       SER  60  -3.119  -8.278  -5.370
  466    HG   SER  60           HG       SER  60  -3.925 -10.329  -3.640
  467    H    ILE  61           HN       ILE  61  -1.131  -5.852  -3.673
  468    HA   ILE  61           HA       ILE  61   1.018  -7.393  -4.852
  469    HB   ILE  61           HB       ILE  61   0.254  -4.832  -5.097
  470   1HG1  ILE  61          HG12      ILE  61   1.894  -6.085  -6.491
  471   2HG1  ILE  61          HG11      ILE  61   2.244  -4.378  -6.316
  472   1HG2  ILE  61          HG21      ILE  61   0.883  -4.096  -2.899
  473   2HG2  ILE  61          HG22      ILE  61   1.883  -3.308  -4.103
  474   3HG2  ILE  61          HG23      ILE  61   2.549  -4.621  -3.146
  475   1HD1  ILE  61          HD11      ILE  61   3.492  -6.518  -4.585
  476   2HD1  ILE  61          HD12      ILE  61   3.948  -4.817  -4.685
  477   3HD1  ILE  61          HD13      ILE  61   4.235  -5.894  -6.056
  478    H    LEU  62           HN       LEU  62   1.086  -5.425  -1.847
  479    HA   LEU  62           HA       LEU  62   3.483  -6.369  -0.809
  480   1HB   LEU  62          HB2       LEU  62   1.004  -5.811   0.803
  481   2HB   LEU  62          HB1       LEU  62   2.667  -5.784   1.395
  482    HG   LEU  62           HG       LEU  62   1.603  -4.036  -0.822
  483   1HD1  LEU  62          HD11      LEU  62   2.246  -3.356   2.054
  484   2HD1  LEU  62          HD12      LEU  62   0.629  -3.433   1.353
  485   3HD1  LEU  62          HD13      LEU  62   1.766  -2.198   0.813
  486   1HD2  LEU  62          HD21      LEU  62   3.831  -2.790  -0.154
  487   2HD2  LEU  62          HD22      LEU  62   3.867  -4.147  -1.279
  488   3HD2  LEU  62          HD23      LEU  62   4.296  -4.390   0.420
  489    H    LEU  63           HN       LEU  63   0.680  -8.245  -1.297
  490    HA   LEU  63           HA       LEU  63   1.212 -10.198   0.761
  491   1HB   LEU  63          HB2       LEU  63  -0.554 -10.104  -1.678
  492   2HB   LEU  63          HB1       LEU  63  -0.508 -11.494  -0.591
  493    HG   LEU  63           HG       LEU  63  -1.008  -9.939   1.303
  494   1HD1  LEU  63          HD11      LEU  63  -2.146  -7.737   0.463
  495   2HD1  LEU  63          HD12      LEU  63  -1.086  -7.953  -0.929
  496   3HD1  LEU  63          HD13      LEU  63  -0.403  -7.800   0.692
  497   1HD2  LEU  63          HD21      LEU  63  -2.951 -10.203  -0.990
  498   2HD2  LEU  63          HD22      LEU  63  -3.431  -9.545   0.573
  499   3HD2  LEU  63          HD23      LEU  63  -2.844 -11.204   0.458
  500    H    GLU  64           HN       GLU  64   1.485 -10.393  -2.843
  501    HA   GLU  64           HA       GLU  64   3.536 -12.566  -2.418
  502   1HB   GLU  64          HB2       GLU  64   1.347 -12.444  -4.498
  503   2HB   GLU  64          HB1       GLU  64   2.575 -13.705  -4.374
  504   1HG   GLU  64          HG2       GLU  64   0.667 -13.021  -2.123
  505   2HG   GLU  64          HG1       GLU  64   0.353 -14.292  -3.305
  506    H    GLU  65           HN       GLU  65   2.223 -10.524  -5.064
  507    HA   GLU  65           HA       GLU  65   4.298 -10.743  -6.848
  508   1HB   GLU  65          HB2       GLU  65   3.077  -8.060  -6.257
  509   2HB   GLU  65          HB1       GLU  65   3.633  -8.675  -7.811
  510   1HG   GLU  65          HG2       GLU  65   1.858 -10.493  -7.574
  511   2HG   GLU  65          HG1       GLU  65   1.209  -9.553  -6.230
  512    H    VAL  66           HN       VAL  66   4.531  -9.419  -3.760
  513    HA   VAL  66           HA       VAL  66   7.379  -8.758  -4.243
  514    HB   VAL  66           HB       VAL  66   5.868  -6.726  -4.615
  515   1HG1  VAL  66          HG11      VAL  66   4.448  -7.334  -2.611
  516   2HG1  VAL  66          HG12      VAL  66   4.893  -5.640  -2.737
  517   3HG1  VAL  66          HG13      VAL  66   5.735  -6.696  -1.607
  518   1HG2  VAL  66          HG21      VAL  66   7.415  -5.325  -2.954
  519   2HG2  VAL  66          HG22      VAL  66   8.102  -6.120  -4.364
  520   3HG2  VAL  66          HG23      VAL  66   8.238  -6.872  -2.775
  521    H    SER  67           HN       SER  67   8.598  -9.418  -2.503
  522    HA   SER  67           HA       SER  67   7.283 -10.641  -0.227
  523   1HB   SER  67          HB2       SER  67   9.338 -11.669  -0.663
  524   2HB   SER  67          HB1       SER  67  10.130 -10.145  -1.045
  525    HG   SER  67           HG       SER  67  10.689 -10.006   0.966
  526    HA   PRO  68           HA       PRO  68   6.816  -7.032   2.284
  527   1HB   PRO  68          HB2       PRO  68   7.719  -8.151   4.766
  528   2HB   PRO  68          HB1       PRO  68   6.045  -7.995   4.207
  529   1HG   PRO  68          HG2       PRO  68   7.717 -10.414   4.330
  530   2HG   PRO  68          HG1       PRO  68   5.971 -10.285   4.067
  531   1HD   PRO  68          HD2       PRO  68   7.894 -10.954   2.100
  532   2HD   PRO  68          HD1       PRO  68   6.209 -10.485   1.798
  533    H    GLU  69           HN       GLU  69   9.860  -8.763   2.219
  534    HA   GLU  69           HA       GLU  69  11.336  -6.640   3.574
  535   1HB   GLU  69          HB2       GLU  69  12.201  -8.898   3.734
  536   2HB   GLU  69          HB1       GLU  69  12.271  -9.045   1.979
  537   1HG   GLU  69          HG2       GLU  69  14.020  -7.420   1.818
  538   2HG   GLU  69          HG1       GLU  69  13.800  -6.921   3.495
  539    H    LEU  70           HN       LEU  70  11.195  -7.766   0.156
  540    HA   LEU  70           HA       LEU  70  12.858  -5.787  -0.959
  541   1HB   LEU  70          HB2       LEU  70  12.087  -7.488  -2.430
  542   2HB   LEU  70          HB1       LEU  70  10.406  -7.233  -1.980
  543    HG   LEU  70           HG       LEU  70  10.421  -5.043  -3.134
  544   1HD1  LEU  70          HD11      LEU  70  12.418  -4.517  -4.577
  545   2HD1  LEU  70          HD12      LEU  70  13.287  -5.816  -3.759
  546   3HD1  LEU  70          HD13      LEU  70  12.741  -4.412  -2.849
  547   1HD2  LEU  70          HD21      LEU  70  10.243  -5.916  -5.301
  548   2HD2  LEU  70          HD22      LEU  70  10.056  -7.365  -4.315
  549   3HD2  LEU  70          HD23      LEU  70  11.603  -7.019  -5.086
  550    H    VAL  71           HN       VAL  71   9.464  -5.676  -0.024
  551    HA   VAL  71           HA       VAL  71   8.679  -3.188  -1.010
  552    HB   VAL  71           HB       VAL  71   8.063  -4.469   1.657
  553   1HG1  VAL  71          HG11      VAL  71   7.419  -2.197   1.877
  554   2HG1  VAL  71          HG12      VAL  71   5.943  -3.043   1.414
  555   3HG1  VAL  71          HG13      VAL  71   6.842  -2.116   0.212
  556   1HG2  VAL  71          HG21      VAL  71   6.291  -5.552   0.569
  557   2HG2  VAL  71          HG22      VAL  71   7.568  -5.620  -0.641
  558   3HG2  VAL  71          HG23      VAL  71   6.292  -4.414  -0.780
  559    H    CYS  72           HN       CYS  72   9.813  -3.656   2.356
  560    HA   CYS  72           HA       CYS  72  10.216  -0.961   2.974
  561   1HB   CYS  72          HB2       CYS  72  10.593  -2.900   4.575
  562   2HB   CYS  72          HB1       CYS  72  12.196  -3.079   3.850
  563    H    SER  73           HN       SER  73  11.911  -2.851   0.676
  564    HA   SER  73           HA       SER  73  14.236  -1.045   0.566
  565   1HB   SER  73          HB2       SER  73  13.722  -3.678  -0.324
  566   2HB   SER  73          HB1       SER  73  13.925  -2.729  -1.793
  567    HG   SER  73           HG       SER  73  15.688  -3.010   0.405
  568    H    MET  74           HN       MET  74  11.493  -1.900  -1.630
  569    HA   MET  74           HA       MET  74  11.907   0.163  -3.518
  570   1HB   MET  74          HB2       MET  74   9.376  -1.137  -2.484
  571   2HB   MET  74          HB1       MET  74   9.306   0.147  -3.687
  572   1HG   MET  74          HG2       MET  74  10.981  -1.252  -5.047
  573   2HG   MET  74          HG1       MET  74  10.600  -2.572  -3.943
  574   1HE   MET  74          HE1       MET  74   8.466  -3.310  -3.341
  575   2HE   MET  74          HE2       MET  74   7.110  -3.548  -4.443
  576   3HE   MET  74          HE3       MET  74   7.206  -2.076  -3.475
  577    H    LEU  75           HN       LEU  75  10.301   0.275  -0.348
  578    HA   LEU  75           HA       LEU  75   9.371   2.971  -0.526
  579   1HB   LEU  75          HB2       LEU  75  10.367   1.522   1.953
  580   2HB   LEU  75          HB1       LEU  75   9.325   2.941   1.929
  581    HG   LEU  75           HG       LEU  75   8.635   0.190   0.853
  582   1HD1  LEU  75          HD11      LEU  75   8.629   0.670   3.395
  583   2HD1  LEU  75          HD12      LEU  75   7.163  -0.011   2.689
  584   3HD1  LEU  75          HD13      LEU  75   7.246   1.713   3.055
  585   1HD2  LEU  75          HD21      LEU  75   7.477   1.625  -0.596
  586   2HD2  LEU  75          HD22      LEU  75   7.259   2.863   0.644
  587   3HD2  LEU  75          HD23      LEU  75   6.301   1.383   0.694
  588    H    HIS  76           HN       HIS  76  12.497   1.710  -0.548
  589    HA   HIS  76           HA       HIS  76  14.616   2.671  -0.295
  590   1HB   HIS  76          HB2       HIS  76  12.808   4.779  -1.428
  591   2HB   HIS  76          HB1       HIS  76  14.437   5.266  -0.958
  592    HD1  HIS  76           HD1      HIS  76  16.307   3.302  -1.911
  593    HD2  HIS  76           HD2      HIS  76  12.793   3.973  -4.051
  594    HE1  HIS  76           HE1      HIS  76  16.720   2.439  -4.256
  595    H    LEU  77           HN       LEU  77  13.996   2.261   2.148
  596    HA   LEU  77           HA       LEU  77  13.819   4.817   3.672
  597   1HB   LEU  77          HB2       LEU  77  13.457   1.907   4.361
  598   2HB   LEU  77          HB1       LEU  77  13.955   3.000   5.647
  599    HG   LEU  77           HG       LEU  77  11.633   3.779   3.887
  600   1HD1  LEU  77          HD11      LEU  77  10.090   2.619   5.409
  601   2HD1  LEU  77          HD12      LEU  77  11.456   1.931   6.287
  602   3HD1  LEU  77          HD13      LEU  77  11.159   1.463   4.613
  603   1HD2  LEU  77          HD21      LEU  77  11.997   4.168   6.866
  604   2HD2  LEU  77          HD22      LEU  77  11.014   5.115   5.749
  605   3HD2  LEU  77          HD23      LEU  77  12.771   5.246   5.706
  606    H    CYS  78           HN       CYS  78  16.086   2.301   2.786
  607    HA   CYS  78           HA       CYS  78  18.091   3.006   4.761
  608   1HB   CYS  78          HB2       CYS  78  18.469   1.625   2.087
  609   2HB   CYS  78          HB1       CYS  78  19.586   1.596   3.452
  610    H    SER  79           HN       SER  79  17.119   4.252   1.672
  611    HA   SER  79           HA       SER  79  19.423   5.474   0.688
  612   1HB   SER  79          HB2       SER  79  17.948   7.188  -0.275
  613   2HB   SER  79          HB1       SER  79  17.210   5.595  -0.418
  614    HG   SER  79           HG       SER  79  16.202   6.193   1.699
  615    H    GLY  80           HN       GLY  80  20.891   6.448   2.029
  616   1HA   GLY  80          HA2       GLY  80  20.046   8.090   4.300
  617   2HA   GLY  80          HA1       GLY  80  21.709   7.844   3.758
  618    H    LEU  81           HN       LEU  81  20.958   8.532   0.995
  619    HA   LEU  81           HA       LEU  81  20.586  11.481   1.236
  620   1HB   LEU  81          HB2       LEU  81  22.121  11.465  -0.885
  621   2HB   LEU  81          HB1       LEU  81  22.870  11.291   0.699
  622    HG   LEU  81           HG       LEU  81  22.975   8.886   0.453
  623   1HD1  LEU  81          HD11      LEU  81  21.415   9.412  -2.086
  624   2HD1  LEU  81          HD12      LEU  81  21.053   8.266  -0.796
  625   3HD1  LEU  81          HD13      LEU  81  22.387   7.953  -1.901
  626   1HD2  LEU  81          HD21      LEU  81  24.808  10.240  -0.489
  627   2HD2  LEU  81          HD22      LEU  81  23.961  10.307  -2.035
  628   3HD2  LEU  81          HD23      LEU  81  24.566   8.766  -1.428
  629    H    VAL  82           HN       VAL  82  20.314  12.162  -1.333
  630    HA   VAL  82           HA       VAL  82  17.843  10.792  -2.059
  631    HB   VAL  82           HB       VAL  82  18.015  12.426  -4.098
  632   1HG1  VAL  82          HG11      VAL  82  17.079  14.238  -2.734
  633   2HG1  VAL  82          HG12      VAL  82  17.728  13.492  -1.273
  634   3HG1  VAL  82          HG13      VAL  82  16.460  12.677  -2.191
  635   1HG2  VAL  82          HG21      VAL  82  19.950  13.741  -2.167
  636   2HG2  VAL  82          HG22      VAL  82  19.476  14.320  -3.765
  637   3HG2  VAL  82          HG23      VAL  82  20.466  12.868  -3.610
  638    HA   PRO  83           HA       PRO  83  19.916   7.676  -4.428
  639   1HB   PRO  83          HB2       PRO  83  17.741   7.885  -6.437
  640   2HB   PRO  83          HB1       PRO  83  18.276   6.483  -5.495
  641   1HG   PRO  83          HG2       PRO  83  15.960   7.973  -4.969
  642   2HG   PRO  83          HG1       PRO  83  16.767   6.892  -3.824
  643   1HD   PRO  83          HD2       PRO  83  16.634   9.824  -3.761
  644   2HD   PRO  83          HD1       PRO  83  17.241   8.698  -2.519
  645    H    ARG  84           HN       ARG  84  21.727   8.426  -5.498
  646    HA   ARG  84           HA       ARG  84  21.615  10.697  -7.317
  647   1HB   ARG  84          HB2       ARG  84  23.852   8.706  -6.823
  648   2HB   ARG  84          HB1       ARG  84  24.015  10.252  -7.652
  649   1HG   ARG  84          HG2       ARG  84  22.899  10.153  -4.848
  650   2HG   ARG  84          HG1       ARG  84  24.640  10.095  -5.106
  651   1HD   ARG  84          HD2       ARG  84  22.766  12.280  -6.068
  652   2HD   ARG  84          HD1       ARG  84  23.943  12.411  -4.762
  653    HE   ARG  84           HE       ARG  84  25.472  11.654  -6.938
  654   1HH1  ARG  84          HH21      ARG  84  23.165  14.120  -6.245
  655   2HH1  ARG  84          HH22      ARG  84  23.877  15.273  -7.324
  656   1HH2  ARG  84          HH11      ARG  84  26.413  13.144  -8.351
  657   2HH2  ARG  84          HH12      ARG  84  25.716  14.720  -8.517
  Start of MODEL    6
    1   1H    SER   1           HT1      SER   1  22.787   3.270   9.886
    2   2H    SER   1           HT2      SER   1  22.651   4.355  11.186
    3   3H    SER   1           HT3      SER   1  23.231   4.894   9.683
    4    HA   SER   1           HA       SER   1  20.713   5.209  10.481
    5   1HB   SER   1          HB2       SER   1  21.702   6.261   8.513
    6   2HB   SER   1          HB1       SER   1  21.741   4.715   7.670
    7    HG   SER   1           HG       SER   1  19.878   5.546   6.991
    8    H    ASP   2           HN       ASP   2  21.866   2.178  10.268
    9    HA   ASP   2           HA       ASP   2  19.724   0.834   8.847
   10   1HB   ASP   2          HB2       ASP   2  21.961  -0.196   9.196
   11   2HB   ASP   2          HB1       ASP   2  21.638  -0.266  10.929
   12    H    VAL   3           HN       VAL   3  18.622   2.687  10.658
   13    HA   VAL   3           HA       VAL   3  17.603   1.082  12.934
   14    HB   VAL   3           HB       VAL   3  17.134   3.977  12.284
   15   1HG1  VAL   3          HG11      VAL   3  16.443   4.130  14.637
   16   2HG1  VAL   3          HG12      VAL   3  16.760   2.407  14.847
   17   3HG1  VAL   3          HG13      VAL   3  15.456   2.942  13.789
   18   1HG2  VAL   3          HG21      VAL   3  19.162   2.666  14.111
   19   2HG2  VAL   3          HG22      VAL   3  18.838   4.399  14.057
   20   3HG2  VAL   3          HG23      VAL   3  19.517   3.584  12.647
   21    H    TYR   4           HN       TYR   4  16.113   3.420  10.688
   22    HA   TYR   4           HA       TYR   4  13.492   2.321  10.988
   23   1HB   TYR   4          HB2       TYR   4  14.805   4.246   9.100
   24   2HB   TYR   4          HB1       TYR   4  13.229   3.604   8.646
   25    HD1  TYR   4           HD1      TYR   4  11.911   5.579   8.906
   26    HD2  TYR   4           HD2      TYR   4  14.383   4.209  12.144
   27    HE1  TYR   4           HE1      TYR   4  10.800   7.179  10.437
   28    HE2  TYR   4           HE2      TYR   4  13.279   5.803  13.670
   29    HH   TYR   4           HH       TYR   4  11.905   7.594  13.780
   30    H    CYS   5           HN       CYS   5  15.946   1.815   8.422
   31    HA   CYS   5           HA       CYS   5  14.445   0.189   6.706
   32   1HB   CYS   5          HB2       CYS   5  17.309  -0.398   7.501
   33   2HB   CYS   5          HB1       CYS   5  16.525  -0.782   5.970
   34    H    GLU   6           HN       GLU   6  16.036  -0.688   9.753
   35    HA   GLU   6           HA       GLU   6  15.350  -3.500   9.574
   36   1HB   GLU   6          HB2       GLU   6  16.097  -1.820  11.986
   37   2HB   GLU   6          HB1       GLU   6  16.063  -3.582  11.932
   38   1HG   GLU   6          HG2       GLU   6  17.775  -1.869  10.110
   39   2HG   GLU   6          HG1       GLU   6  18.359  -2.611  11.601
   40    H    VAL   7           HN       VAL   7  13.935  -0.679  11.210
   41    HA   VAL   7           HA       VAL   7  11.818  -2.204  12.479
   42    HB   VAL   7           HB       VAL   7  11.988   0.769  11.903
   43   1HG1  VAL   7          HG11      VAL   7  10.429   0.868  13.893
   44   2HG1  VAL   7          HG12      VAL   7  10.266  -0.884  13.766
   45   3HG1  VAL   7          HG13      VAL   7   9.725   0.149  12.444
   46   1HG2  VAL   7          HG21      VAL   7  12.620  -0.592  14.527
   47   2HG2  VAL   7          HG22      VAL   7  13.054   1.034  13.998
   48   3HG2  VAL   7          HG23      VAL   7  13.866  -0.365  13.299
   49    H    CYS   8           HN       CYS   8  12.283  -0.850   9.328
   50    HA   CYS   8           HA       CYS   8   9.438  -0.660   8.690
   51   1HB   CYS   8          HB2       CYS   8  11.073   0.797   7.576
   52   2HB   CYS   8          HB1       CYS   8  11.875  -0.612   6.888
   53    H    GLU   9           HN       GLU   9  11.946  -3.108   8.413
   54    HA   GLU   9           HA       GLU   9  10.258  -4.762   6.629
   55   1HB   GLU   9          HB2       GLU   9  12.039  -6.403   6.648
   56   2HB   GLU   9          HB1       GLU   9  12.727  -4.819   6.335
   57   1HG   GLU   9          HG2       GLU   9  13.938  -4.816   8.298
   58   2HG   GLU   9          HG1       GLU   9  12.665  -5.603   9.221
   59    H    PHE  10           HN       PHE  10  10.856  -4.418  10.026
   60    HA   PHE  10           HA       PHE  10   9.854  -7.067  10.732
   61   1HB   PHE  10          HB2       PHE  10  11.412  -5.855  12.214
   62   2HB   PHE  10          HB1       PHE  10  10.213  -4.580  12.433
   63    HD1  PHE  10           HD1      PHE  10   8.337  -4.862  13.902
   64    HD2  PHE  10           HD2      PHE  10  10.949  -8.164  13.055
   65    HE1  PHE  10           HE1      PHE  10   7.278  -6.167  15.726
   66    HE2  PHE  10           HE2      PHE  10   9.890  -9.469  14.878
   67    HZ   PHE  10           HZ       PHE  10   8.055  -8.470  16.214
   68    H    LEU  11           HN       LEU  11   8.497  -3.787  10.553
   69    HA   LEU  11           HA       LEU  11   5.905  -4.672  11.599
   70   1HB   LEU  11          HB2       LEU  11   6.740  -2.079  10.270
   71   2HB   LEU  11          HB1       LEU  11   5.187  -2.358  11.049
   72    HG   LEU  11           HG       LEU  11   7.837  -2.689  12.480
   73   1HD1  LEU  11          HD11      LEU  11   7.440  -0.462  13.439
   74   2HD1  LEU  11          HD12      LEU  11   5.982  -0.288  12.462
   75   3HD1  LEU  11          HD13      LEU  11   7.564  -0.360  11.684
   76   1HD2  LEU  11          HD21      LEU  11   4.929  -2.654  13.311
   77   2HD2  LEU  11          HD22      LEU  11   6.190  -2.222  14.463
   78   3HD2  LEU  11          HD23      LEU  11   6.183  -3.821  13.728
   79    H    VAL  12           HN       VAL  12   7.203  -3.711   8.415
   80    HA   VAL  12           HA       VAL  12   4.723  -4.041   7.027
   81    HB   VAL  12           HB       VAL  12   7.540  -4.296   5.952
   82   1HG1  VAL  12          HG11      VAL  12   4.829  -3.965   4.656
   83   2HG1  VAL  12          HG12      VAL  12   6.052  -5.190   4.324
   84   3HG1  VAL  12          HG13      VAL  12   6.322  -3.521   3.830
   85   1HG2  VAL  12          HG21      VAL  12   7.435  -1.949   5.519
   86   2HG2  VAL  12          HG22      VAL  12   6.855  -2.132   7.175
   87   3HG2  VAL  12          HG23      VAL  12   5.706  -1.889   5.860
   88    H    LYS  13           HN       LYS  13   7.120  -6.341   8.110
   89    HA   LYS  13           HA       LYS  13   6.145  -8.496   6.358
   90   1HB   LYS  13          HB2       LYS  13   8.492  -8.405   6.991
   91   2HB   LYS  13          HB1       LYS  13   8.060  -8.498   8.694
   92   1HG   LYS  13          HG2       LYS  13   6.793 -10.722   7.335
   93   2HG   LYS  13          HG1       LYS  13   8.479 -10.678   6.841
   94   1HD   LYS  13          HD2       LYS  13   8.425 -12.040   8.789
   95   2HD   LYS  13          HD1       LYS  13   9.062 -10.487   9.328
   96   1HE   LYS  13          HE2       LYS  13   6.915  -9.839  10.227
   97   2HE   LYS  13          HE1       LYS  13   6.133 -11.248   9.509
   98   1HZ   LYS  13          HZ1       LYS  13   6.677 -11.465  11.914
   99   2HZ   LYS  13          HZ2       LYS  13   8.325 -11.427  11.498
  100   3HZ   LYS  13          HZ3       LYS  13   7.331 -12.686  10.936
  101    H    GLU  14           HN       GLU  14   5.806  -7.511   9.764
  102    HA   GLU  14           HA       GLU  14   4.283  -9.866  10.525
  103   1HB   GLU  14          HB2       GLU  14   5.508  -8.388  12.151
  104   2HB   GLU  14          HB1       GLU  14   4.310  -7.131  11.842
  105   1HG   GLU  14          HG2       GLU  14   2.519  -8.597  12.634
  106   2HG   GLU  14          HG1       GLU  14   3.671  -9.913  12.868
  107    H    VAL  15           HN       VAL  15   3.366  -6.482   9.856
  108    HA   VAL  15           HA       VAL  15   0.576  -6.772  10.024
  109    HB   VAL  15           HB       VAL  15   1.889  -4.626   9.593
  110   1HG1  VAL  15          HG11      VAL  15   3.118  -5.627   7.609
  111   2HG1  VAL  15          HG12      VAL  15   2.421  -4.030   7.334
  112   3HG1  VAL  15          HG13      VAL  15   1.620  -5.462   6.696
  113   1HG2  VAL  15          HG21      VAL  15   0.039  -3.713   8.064
  114   2HG2  VAL  15          HG22      VAL  15  -0.482  -4.480   9.564
  115   3HG2  VAL  15          HG23      VAL  15  -0.598  -5.358   8.039
  116    H    THR  16           HN       THR  16   2.769  -7.499   7.334
  117    HA   THR  16           HA       THR  16   0.873  -8.226   5.386
  118    HB   THR  16           HB       THR  16   2.997 -10.102   5.155
  119    HG1  THR  16           HG1      THR  16   4.382  -9.332   6.476
  120   1HG2  THR  16          HG21      THR  16   3.880  -8.396   3.519
  121   2HG2  THR  16          HG22      THR  16   2.613  -7.299   4.077
  122   3HG2  THR  16          HG23      THR  16   2.176  -8.822   3.286
  123    H    LYS  17           HN       LYS  17   2.309 -10.258   7.972
  124    HA   LYS  17           HA       LYS  17   1.119 -12.705   7.372
  125   1HB   LYS  17          HB2       LYS  17   1.780 -11.373   9.991
  126   2HB   LYS  17          HB1       LYS  17   0.912 -12.902  10.007
  127   1HG   LYS  17          HG2       LYS  17   2.704 -13.910   8.614
  128   2HG   LYS  17          HG1       LYS  17   3.584 -12.382   8.669
  129   1HD   LYS  17          HD2       LYS  17   3.957 -12.551  11.008
  130   2HD   LYS  17          HD1       LYS  17   2.737 -13.812  11.193
  131   1HE   LYS  17          HE2       LYS  17   5.060 -14.714  11.270
  132   2HE   LYS  17          HE1       LYS  17   4.118 -15.385   9.937
  133   1HZ   LYS  17          HZ1       LYS  17   5.175 -13.945   8.410
  134   2HZ   LYS  17          HZ2       LYS  17   6.411 -14.634   9.350
  135   3HZ   LYS  17          HZ3       LYS  17   5.905 -13.039   9.643
  136    H    LEU  18           HN       LEU  18  -0.402  -9.875   8.906
  137    HA   LEU  18           HA       LEU  18  -2.991 -11.336   9.033
  138   1HB   LEU  18          HB2       LEU  18  -3.495  -9.892  10.722
  139   2HB   LEU  18          HB1       LEU  18  -1.810  -9.398  10.645
  140    HG   LEU  18           HG       LEU  18  -2.517  -7.663   8.921
  141   1HD1  LEU  18          HD11      LEU  18  -4.650  -7.630   8.169
  142   2HD1  LEU  18          HD12      LEU  18  -5.275  -7.478   9.808
  143   3HD1  LEU  18          HD13      LEU  18  -4.999  -9.076   9.113
  144   1HD2  LEU  18          HD21      LEU  18  -2.047  -7.156  11.292
  145   2HD2  LEU  18          HD22      LEU  18  -3.730  -7.494  11.694
  146   3HD2  LEU  18          HD23      LEU  18  -3.329  -6.124  10.656
  147    H    ILE  19           HN       ILE  19  -1.554  -8.558   7.337
  148    HA   ILE  19           HA       ILE  19  -3.877  -7.905   5.787
  149    HB   ILE  19           HB       ILE  19  -1.026  -7.229   5.938
  150   1HG1  ILE  19          HG12      ILE  19  -3.287  -5.528   4.906
  151   2HG1  ILE  19          HG11      ILE  19  -2.988  -5.789   6.624
  152   1HG2  ILE  19          HG21      ILE  19  -0.917  -6.224   3.636
  153   2HG2  ILE  19          HG22      ILE  19  -2.337  -7.183   3.223
  154   3HG2  ILE  19          HG23      ILE  19  -0.832  -7.982   3.680
  155   1HD1  ILE  19          HD11      ILE  19  -1.621  -3.978   6.446
  156   2HD1  ILE  19          HD12      ILE  19  -1.512  -4.114   4.696
  157   3HD1  ILE  19          HD13      ILE  19  -0.462  -5.096   5.719
  158    H    ASP  20           HN       ASP  20  -1.614 -10.475   5.689
  159    HA   ASP  20           HA       ASP  20  -1.274 -11.218   3.076
  160   1HB   ASP  20          HB2       ASP  20  -1.365 -13.572   3.817
  161   2HB   ASP  20          HB1       ASP  20  -0.510 -12.576   4.994
  162    H    ASN  21           HN       ASN  21  -4.182 -12.198   4.977
  163    HA   ASN  21           HA       ASN  21  -5.885 -11.734   2.645
  164   1HB   ASN  21          HB2       ASN  21  -5.520 -14.539   3.718
  165   2HB   ASN  21          HB1       ASN  21  -6.730 -14.049   2.527
  166   1HD2  ASN  21          HD21      ASN  21  -5.996 -13.571   0.351
  167   2HD2  ASN  21          HD22      ASN  21  -4.424 -13.940  -0.167
  168    H    ASN  22           HN       ASN  22  -6.122 -10.438   4.994
  169    HA   ASN  22           HA       ASN  22  -8.316 -11.818   6.499
  170   1HB   ASN  22          HB2       ASN  22  -6.591  -9.430   7.214
  171   2HB   ASN  22          HB1       ASN  22  -7.909 -10.050   8.211
  172   1HD2  ASN  22          HD21      ASN  22  -5.651 -12.065   6.305
  173   2HD2  ASN  22          HD22      ASN  22  -4.946 -12.828   7.650
  174    H    LYS  23           HN       LYS  23  -7.440  -8.563   5.337
  175    HA   LYS  23           HA       LYS  23 -10.335  -7.949   5.000
  176   1HB   LYS  23          HB2       LYS  23  -9.687  -5.641   4.840
  177   2HB   LYS  23          HB1       LYS  23  -8.817  -6.333   6.202
  178   1HG   LYS  23          HG2       LYS  23  -7.008  -5.323   5.203
  179   2HG   LYS  23          HG1       LYS  23  -6.987  -6.797   4.243
  180   1HD   LYS  23          HD2       LYS  23  -8.706  -5.430   2.721
  181   2HD   LYS  23          HD1       LYS  23  -7.946  -4.046   3.496
  182   1HE   LYS  23          HE2       LYS  23  -6.496  -6.227   1.968
  183   2HE   LYS  23          HE1       LYS  23  -6.791  -4.586   1.396
  184   1HZ   LYS  23          HZ1       LYS  23  -5.095  -5.443   3.668
  185   2HZ   LYS  23          HZ2       LYS  23  -5.574  -3.828   3.440
  186   3HZ   LYS  23          HZ3       LYS  23  -4.621  -4.608   2.270
  187    H    THR  24           HN       THR  24 -11.155  -8.479   3.047
  188    HA   THR  24           HA       THR  24  -9.390  -8.961   0.778
  189    HB   THR  24           HB       THR  24 -11.586  -9.381  -0.423
  190    HG1  THR  24           HG1      THR  24 -13.197  -9.671   1.529
  191   1HG2  THR  24          HG21      THR  24 -11.966 -11.482   0.728
  192   2HG2  THR  24          HG22      THR  24 -11.229 -10.854   2.203
  193   3HG2  THR  24          HG23      THR  24 -10.236 -11.139   0.774
  194    H    GLU  25           HN       GLU  25 -10.719  -7.999  -1.411
  195    HA   GLU  25           HA       GLU  25 -10.052  -5.136  -1.251
  196   1HB   GLU  25          HB2       GLU  25 -11.110  -6.463  -3.739
  197   2HB   GLU  25          HB1       GLU  25  -9.911  -5.181  -3.582
  198   1HG   GLU  25          HG2       GLU  25  -8.587  -7.045  -4.114
  199   2HG   GLU  25          HG1       GLU  25  -8.477  -6.995  -2.355
  200    H    LYS  26           HN       LYS  26 -12.726  -6.584  -0.282
  201    HA   LYS  26           HA       LYS  26 -14.719  -5.061  -1.805
  202   1HB   LYS  26          HB2       LYS  26 -14.752  -7.036   0.469
  203   2HB   LYS  26          HB1       LYS  26 -16.156  -6.003   0.242
  204   1HG   LYS  26          HG2       LYS  26 -16.639  -7.968  -0.996
  205   2HG   LYS  26          HG1       LYS  26 -16.165  -6.781  -2.198
  206   1HD   LYS  26          HD2       LYS  26 -14.918  -8.627  -2.884
  207   2HD   LYS  26          HD1       LYS  26 -13.756  -7.817  -1.848
  208   1HE   LYS  26          HE2       LYS  26 -13.690 -10.086  -1.168
  209   2HE   LYS  26          HE1       LYS  26 -14.679  -9.292   0.054
  210   1HZ   LYS  26          HZ1       LYS  26 -16.408 -10.010  -1.968
  211   2HZ   LYS  26          HZ2       LYS  26 -16.267 -10.731  -0.437
  212   3HZ   LYS  26          HZ3       LYS  26 -15.392 -11.351  -1.754
  213    H    GLU  27           HN       GLU  27 -13.306  -5.093   1.451
  214    HA   GLU  27           HA       GLU  27 -14.715  -2.732   2.311
  215   1HB   GLU  27          HB2       GLU  27 -12.154  -3.936   3.398
  216   2HB   GLU  27          HB1       GLU  27 -13.185  -2.772   4.230
  217   1HG   GLU  27          HG2       GLU  27 -13.797  -4.906   5.103
  218   2HG   GLU  27          HG1       GLU  27 -15.077  -4.472   3.968
  219    H    ILE  28           HN       ILE  28 -12.076  -3.246   0.229
  220    HA   ILE  28           HA       ILE  28 -10.793  -0.657   0.769
  221    HB   ILE  28           HB       ILE  28 -10.318  -2.752  -1.359
  222   1HG1  ILE  28          HG12      ILE  28  -9.779  -3.572   0.876
  223   2HG1  ILE  28          HG11      ILE  28  -8.296  -3.272  -0.019
  224   1HG2  ILE  28          HG21      ILE  28  -8.120  -1.475  -1.569
  225   2HG2  ILE  28          HG22      ILE  28  -8.901  -0.189  -0.657
  226   3HG2  ILE  28          HG23      ILE  28  -9.548  -0.679  -2.223
  227   1HD1  ILE  28          HD11      ILE  28  -7.770  -2.255   1.990
  228   2HD1  ILE  28          HD12      ILE  28  -9.438  -1.790   2.312
  229   3HD1  ILE  28          HD13      ILE  28  -8.480  -0.879   1.149
  230    H    LEU  29           HN       LEU  29 -11.866  -2.025  -2.394
  231    HA   LEU  29           HA       LEU  29 -12.190   0.372  -3.725
  232   1HB   LEU  29          HB2       LEU  29 -13.582  -2.283  -3.925
  233   2HB   LEU  29          HB1       LEU  29 -14.257  -0.936  -4.840
  234    HG   LEU  29           HG       LEU  29 -11.957  -0.546  -5.796
  235   1HD1  LEU  29          HD11      LEU  29 -10.526  -1.578  -4.229
  236   2HD1  LEU  29          HD12      LEU  29 -10.442  -2.594  -5.671
  237   3HD1  LEU  29          HD13      LEU  29 -11.423  -3.098  -4.295
  238   1HD2  LEU  29          HD21      LEU  29 -12.998  -3.334  -6.334
  239   2HD2  LEU  29          HD22      LEU  29 -12.154  -2.269  -7.459
  240   3HD2  LEU  29          HD23      LEU  29 -13.792  -1.878  -6.934
  241    H    ASP  30           HN       ASP  30 -14.134  -0.871  -1.137
  242    HA   ASP  30           HA       ASP  30 -16.398   0.906  -1.599
  243   1HB   ASP  30          HB2       ASP  30 -15.440  -0.607   0.854
  244   2HB   ASP  30          HB1       ASP  30 -16.916   0.358   0.824
  245    H    ALA  31           HN       ALA  31 -13.719   0.869   0.764
  246    HA   ALA  31           HA       ALA  31 -14.017   3.337   1.984
  247   1HB   ALA  31          HB1       ALA  31 -11.412   2.191   0.992
  248   2HB   ALA  31          HB2       ALA  31 -12.226   1.729   2.489
  249   3HB   ALA  31          HB3       ALA  31 -11.617   3.371   2.288
  250    H    PHE  32           HN       PHE  32 -12.887   2.695  -1.287
  251    HA   PHE  32           HA       PHE  32 -12.033   5.415  -1.782
  252   1HB   PHE  32          HB2       PHE  32 -12.694   3.050  -3.548
  253   2HB   PHE  32          HB1       PHE  32 -12.394   4.639  -4.252
  254    HD1  PHE  32           HD1      PHE  32 -10.904   1.793  -2.436
  255    HD2  PHE  32           HD2      PHE  32 -10.193   5.706  -4.070
  256    HE1  PHE  32           HE1      PHE  32  -8.456   1.438  -2.245
  257    HE2  PHE  32           HE2      PHE  32  -7.749   5.348  -3.868
  258    HZ   PHE  32           HZ       PHE  32  -6.883   3.213  -2.954
  259    H    ASP  33           HN       ASP  33 -15.080   3.625  -2.155
  260    HA   ASP  33           HA       ASP  33 -16.451   5.813  -3.462
  261   1HB   ASP  33          HB2       ASP  33 -17.281   3.465  -3.559
  262   2HB   ASP  33          HB1       ASP  33 -17.601   3.525  -1.825
  263    H    LYS  34           HN       LYS  34 -15.087   5.578  -0.510
  264    HA   LYS  34           HA       LYS  34 -17.089   7.390   0.814
  265   1HB   LYS  34          HB2       LYS  34 -15.080   5.403   1.909
  266   2HB   LYS  34          HB1       LYS  34 -15.768   6.663   2.926
  267   1HG   LYS  34          HG2       LYS  34 -17.676   5.473   3.228
  268   2HG   LYS  34          HG1       LYS  34 -17.913   5.288   1.492
  269   1HD   LYS  34          HD2       LYS  34 -17.733   3.083   2.440
  270   2HD   LYS  34          HD1       LYS  34 -16.223   3.390   1.593
  271   1HE   LYS  34          HE2       LYS  34 -15.422   2.589   3.630
  272   2HE   LYS  34          HE1       LYS  34 -15.451   4.325   3.943
  273   1HZ   LYS  34          HZ1       LYS  34 -17.175   4.135   5.352
  274   2HZ   LYS  34          HZ2       LYS  34 -16.629   2.533   5.508
  275   3HZ   LYS  34          HZ3       LYS  34 -17.923   2.897   4.468
  276    H    MET  35           HN       MET  35 -13.654   6.660   1.254
  277    HA   MET  35           HA       MET  35 -12.911   9.328   1.931
  278   1HB   MET  35          HB2       MET  35 -11.291   7.934   2.726
  279   2HB   MET  35          HB1       MET  35 -11.642   6.724   1.513
  280   1HG   MET  35          HG2       MET  35 -10.295   8.119  -0.143
  281   2HG   MET  35          HG1       MET  35  -9.843   9.149   1.216
  282   1HE   MET  35          HE1       MET  35  -8.837   4.879   0.192
  283   2HE   MET  35          HE2       MET  35 -10.295   5.806  -0.158
  284   3HE   MET  35          HE3       MET  35 -10.146   4.957   1.381
  285    H    CYS  36           HN       CYS  36 -12.487   7.509  -1.132
  286    HA   CYS  36           HA       CYS  36 -11.549   9.949  -2.478
  287   1HB   CYS  36          HB2       CYS  36 -10.592   7.844  -3.204
  288   2HB   CYS  36          HB1       CYS  36 -12.179   7.153  -3.486
  289    H    SER  37           HN       SER  37 -14.289   9.562  -1.199
  290    HA   SER  37           HA       SER  37 -16.107   9.938  -3.509
  291   1HB   SER  37          HB2       SER  37 -17.843   9.516  -2.025
  292   2HB   SER  37          HB1       SER  37 -16.543   8.649  -1.217
  293    HG   SER  37           HG       SER  37 -16.188  10.535   0.035
  294    H    LYS  38           HN       LYS  38 -15.287  11.650  -0.488
  295    HA   LYS  38           HA       LYS  38 -16.555  14.110  -1.092
  296   1HB   LYS  38          HB2       LYS  38 -14.941  15.076   0.571
  297   2HB   LYS  38          HB1       LYS  38 -15.747  13.618   1.152
  298   1HG   LYS  38          HG2       LYS  38 -13.737  12.299   0.328
  299   2HG   LYS  38          HG1       LYS  38 -12.934  13.843   0.046
  300   1HD   LYS  38          HD2       LYS  38 -13.459  14.397   2.488
  301   2HD   LYS  38          HD1       LYS  38 -13.884  12.695   2.675
  302   1HE   LYS  38          HE2       LYS  38 -11.629  12.061   1.846
  303   2HE   LYS  38          HE1       LYS  38 -11.206  13.771   1.741
  304   1HZ   LYS  38          HZ1       LYS  38 -12.156  13.564   4.250
  305   2HZ   LYS  38          HZ2       LYS  38 -10.512  13.493   3.830
  306   3HZ   LYS  38          HZ3       LYS  38 -11.396  12.060   4.054
  307    H    LEU  39           HN       LEU  39 -13.574  12.749  -2.248
  308    HA   LEU  39           HA       LEU  39 -12.013  14.878  -2.958
  309   1HB   LEU  39          HB2       LEU  39 -12.319  12.182  -3.855
  310   2HB   LEU  39          HB1       LEU  39 -12.279  13.151  -5.308
  311    HG   LEU  39           HG       LEU  39 -10.146  14.141  -3.661
  312   1HD1  LEU  39          HD11      LEU  39 -10.444  11.990  -2.398
  313   2HD1  LEU  39          HD12      LEU  39  -8.845  12.218  -3.111
  314   3HD1  LEU  39          HD13      LEU  39 -10.009  11.140  -3.881
  315   1HD2  LEU  39          HD21      LEU  39  -9.971  12.223  -5.990
  316   2HD2  LEU  39          HD22      LEU  39  -8.750  13.388  -5.478
  317   3HD2  LEU  39          HD23      LEU  39 -10.278  13.949  -6.160
  318    HA   PRO  40           HA       PRO  40 -14.411  17.558  -5.590
  319   1HB   PRO  40          HB2       PRO  40 -12.221  17.982  -7.484
  320   2HB   PRO  40          HB1       PRO  40 -12.885  19.117  -6.302
  321   1HG   PRO  40          HG2       PRO  40 -10.368  17.759  -6.156
  322   2HG   PRO  40          HG1       PRO  40 -11.099  18.784  -4.912
  323   1HD   PRO  40          HD2       PRO  40 -10.793  15.905  -4.885
  324   2HD   PRO  40          HD1       PRO  40 -11.472  16.943  -3.618
  325    H    LYS  41           HN       LYS  41 -15.797  16.976  -7.216
  326    HA   LYS  41           HA       LYS  41 -16.048  14.561  -8.417
  327   1HB   LYS  41          HB2       LYS  41 -17.584  16.536  -8.657
  328   2HB   LYS  41          HB1       LYS  41 -16.517  17.124  -9.932
  329   1HG   LYS  41          HG2       LYS  41 -16.914  15.176 -11.274
  330   2HG   LYS  41          HG1       LYS  41 -17.796  14.385  -9.967
  331   1HD   LYS  41          HD2       LYS  41 -19.709  15.650 -10.291
  332   2HD   LYS  41          HD1       LYS  41 -18.813  17.070 -10.826
  333   1HE   LYS  41          HE2       LYS  41 -18.378  16.033 -12.985
  334   2HE   LYS  41          HE1       LYS  41 -19.173  14.547 -12.465
  335   1HZ   LYS  41          HZ1       LYS  41 -20.541  17.176 -12.501
  336   2HZ   LYS  41          HZ2       LYS  41 -21.243  15.637 -12.336
  337   3HZ   LYS  41          HZ3       LYS  41 -20.567  16.111 -13.821
  338    H    SER  42           HN       SER  42 -14.127  17.188  -9.811
  339    HA   SER  42           HA       SER  42 -13.353  15.928 -12.206
  340   1HB   SER  42          HB2       SER  42 -11.637  17.731 -10.479
  341   2HB   SER  42          HB1       SER  42 -11.427  17.434 -12.203
  342    HG   SER  42           HG       SER  42 -13.575  18.297 -12.466
  343    H    LEU  43           HN       LEU  43 -11.336  16.073  -9.243
  344    HA   LEU  43           HA       LEU  43  -9.684  13.891 -10.254
  345   1HB   LEU  43          HB2       LEU  43  -9.700  15.562  -7.751
  346   2HB   LEU  43          HB1       LEU  43  -8.728  14.089  -7.813
  347    HG   LEU  43           HG       LEU  43  -7.687  14.968  -9.941
  348   1HD1  LEU  43          HD11      LEU  43  -7.884  17.465 -10.228
  349   2HD1  LEU  43          HD12      LEU  43  -9.221  17.431  -9.077
  350   3HD1  LEU  43          HD13      LEU  43  -9.354  16.570 -10.612
  351   1HD2  LEU  43          HD21      LEU  43  -6.264  16.625  -8.700
  352   2HD2  LEU  43          HD22      LEU  43  -6.495  15.100  -7.842
  353   3HD2  LEU  43          HD23      LEU  43  -7.409  16.531  -7.361
  354    H    SER  44           HN       SER  44 -12.713  13.876  -8.901
  355    HA   SER  44           HA       SER  44 -12.306  11.527  -7.171
  356   1HB   SER  44          HB2       SER  44 -14.553  11.744  -6.576
  357   2HB   SER  44          HB1       SER  44 -14.178  13.411  -6.989
  358    HG   SER  44           HG       SER  44 -14.953  12.921  -9.122
  359    H    GLU  45           HN       GLU  45 -13.002  12.416 -10.406
  360    HA   GLU  45           HA       GLU  45 -14.014   9.798 -11.193
  361   1HB   GLU  45          HB2       GLU  45 -13.246  12.269 -12.761
  362   2HB   GLU  45          HB1       GLU  45 -13.830  10.787 -13.518
  363   1HG   GLU  45          HG2       GLU  45 -15.361  12.248 -11.353
  364   2HG   GLU  45          HG1       GLU  45 -15.617  12.533 -13.075
  365    H    GLU  46           HN       GLU  46 -11.040  11.692 -11.433
  366    HA   GLU  46           HA       GLU  46  -9.634   9.601 -12.916
  367   1HB   GLU  46          HB2       GLU  46  -8.564  12.061 -11.500
  368   2HB   GLU  46          HB1       GLU  46  -7.661  11.048 -12.627
  369   1HG   GLU  46          HG2       GLU  46  -9.273  11.585 -14.412
  370   2HG   GLU  46          HG1       GLU  46 -10.188  12.591 -13.289
  371    H    CYS  47           HN       CYS  47 -10.346  10.263  -9.625
  372    HA   CYS  47           HA       CYS  47  -8.025   8.863  -8.519
  373   1HB   CYS  47          HB2       CYS  47  -8.894  10.436  -7.016
  374   2HB   CYS  47          HB1       CYS  47 -10.557  10.039  -7.422
  375    H    GLN  48           HN       GLN  48 -11.384   8.116  -9.352
  376    HA   GLN  48           HA       GLN  48 -11.231   5.414  -8.224
  377   1HB   GLN  48          HB2       GLN  48 -13.279   6.940  -9.846
  378   2HB   GLN  48          HB1       GLN  48 -13.451   5.209  -9.554
  379   1HG   GLN  48          HG2       GLN  48 -12.995   7.170  -7.300
  380   2HG   GLN  48          HG1       GLN  48 -14.612   6.778  -7.882
  381   1HE2  GLN  48          HE21      GLN  48 -12.675   4.066  -8.346
  382   2HE2  GLN  48          HE22      GLN  48 -13.053   3.228  -6.920
  383    H    GLU  49           HN       GLU  49 -10.381   7.088 -11.063
  384    HA   GLU  49           HA       GLU  49 -10.612   4.944 -12.931
  385   1HB   GLU  49          HB2       GLU  49 -10.376   7.339 -13.576
  386   2HB   GLU  49          HB1       GLU  49  -8.724   7.315 -12.959
  387   1HG   GLU  49          HG2       GLU  49  -8.676   6.983 -15.365
  388   2HG   GLU  49          HG1       GLU  49  -8.194   5.488 -14.570
  389    H    VAL  50           HN       VAL  50  -7.845   6.257 -11.086
  390    HA   VAL  50           HA       VAL  50  -5.986   4.252 -11.910
  391    HB   VAL  50           HB       VAL  50  -6.004   5.733  -9.269
  392   1HG1  VAL  50          HG11      VAL  50  -4.434   3.935  -9.233
  393   2HG1  VAL  50          HG12      VAL  50  -3.493   5.380  -9.600
  394   3HG1  VAL  50          HG13      VAL  50  -3.916   4.250 -10.892
  395   1HG2  VAL  50          HG21      VAL  50  -6.095   7.418 -10.948
  396   2HG2  VAL  50          HG22      VAL  50  -5.060   6.495 -12.041
  397   3HG2  VAL  50          HG23      VAL  50  -4.377   7.236 -10.593
  398    H    VAL  51           HN       VAL  51  -8.248   4.402  -9.152
  399    HA   VAL  51           HA       VAL  51  -7.489   2.154  -7.665
  400    HB   VAL  51           HB       VAL  51 -10.255   3.135  -8.463
  401   1HG1  VAL  51          HG11      VAL  51  -9.467   0.972  -6.500
  402   2HG1  VAL  51          HG12      VAL  51 -10.562   0.822  -7.875
  403   3HG1  VAL  51          HG13      VAL  51 -11.033   1.778  -6.472
  404   1HG2  VAL  51          HG21      VAL  51  -8.643   4.523  -7.011
  405   2HG2  VAL  51          HG22      VAL  51  -8.880   3.288  -5.777
  406   3HG2  VAL  51          HG23      VAL  51 -10.253   4.231  -6.355
  407    H    ASP  52           HN       ASP  52  -9.676   2.101 -10.522
  408    HA   ASP  52           HA       ASP  52  -9.892  -0.700 -10.767
  409   1HB   ASP  52          HB2       ASP  52  -9.672   1.387 -12.966
  410   2HB   ASP  52          HB1       ASP  52 -10.205  -0.276 -13.213
  411    H    THR  53           HN       THR  53  -7.294   1.513 -11.649
  412    HA   THR  53           HA       THR  53  -5.676  -0.612 -12.836
  413    HB   THR  53           HB       THR  53  -4.999   2.243 -12.272
  414    HG1  THR  53           HG1      THR  53  -6.451   1.058 -14.143
  415   1HG2  THR  53          HG21      THR  53  -3.060   1.886 -13.694
  416   2HG2  THR  53          HG22      THR  53  -3.549   0.217 -13.983
  417   3HG2  THR  53          HG23      THR  53  -3.012   0.712 -12.380
  418    H    TYR  54           HN       TYR  54  -6.124   0.845  -9.753
  419    HA   TYR  54           HA       TYR  54  -3.931  -0.873  -8.643
  420   1HB   TYR  54          HB2       TYR  54  -4.652   1.966  -7.887
  421   2HB   TYR  54          HB1       TYR  54  -3.671   0.915  -6.867
  422    HD1  TYR  54           HD1      TYR  54  -1.344   0.973  -7.153
  423    HD2  TYR  54           HD2      TYR  54  -3.897   2.040 -10.392
  424    HE1  TYR  54           HE1      TYR  54   0.641   1.619  -8.496
  425    HE2  TYR  54           HE2      TYR  54  -1.959   2.708 -11.755
  426    HH   TYR  54           HH       TYR  54   0.439   2.250 -11.868
  427    H    GLY  55           HN       GLY  55  -5.933  -2.297  -8.409
  428   1HA   GLY  55          HA2       GLY  55  -7.248  -1.711  -5.796
  429   2HA   GLY  55          HA1       GLY  55  -8.246  -2.154  -7.183
  430    H    SER  56           HN       SER  56  -7.448  -4.287  -8.288
  431    HA   SER  56           HA       SER  56  -7.410  -6.312  -6.187
  432   1HB   SER  56          HB2       SER  56  -7.201  -7.844  -8.293
  433   2HB   SER  56          HB1       SER  56  -8.690  -6.939  -8.050
  434    HG   SER  56           HG       SER  56  -7.577  -6.842 -10.196
  435    H    SER  57           HN       SER  57  -5.009  -4.670  -8.018
  436    HA   SER  57           HA       SER  57  -2.978  -6.794  -7.613
  437   1HB   SER  57          HB2       SER  57  -2.835  -4.074  -8.946
  438   2HB   SER  57          HB1       SER  57  -1.445  -5.143  -8.750
  439    HG   SER  57           HG       SER  57  -3.831  -5.564 -10.222
  440    H    ILE  58           HN       ILE  58  -2.846  -3.274  -7.104
  441    HA   ILE  58           HA       ILE  58  -0.912  -2.848  -5.306
  442    HB   ILE  58           HB       ILE  58  -2.612  -1.195  -5.958
  443   1HG1  ILE  58          HG12      ILE  58  -2.063  -1.484  -2.991
  444   2HG1  ILE  58          HG11      ILE  58  -1.162  -0.507  -4.161
  445   1HG2  ILE  58          HG21      ILE  58  -4.777  -1.142  -5.149
  446   2HG2  ILE  58          HG22      ILE  58  -4.371  -2.077  -3.727
  447   3HG2  ILE  58          HG23      ILE  58  -4.519  -2.879  -5.301
  448   1HD1  ILE  58          HD11      ILE  58  -2.557   1.054  -3.027
  449   2HD1  ILE  58          HD12      ILE  58  -3.946  -0.037  -3.072
  450   3HD1  ILE  58          HD13      ILE  58  -3.391   0.747  -4.554
  451    H    LEU  59           HN       LEU  59  -4.002  -4.310  -4.385
  452    HA   LEU  59           HA       LEU  59  -3.056  -4.768  -1.645
  453   1HB   LEU  59          HB2       LEU  59  -5.450  -6.224  -2.770
  454   2HB   LEU  59          HB1       LEU  59  -5.167  -5.658  -1.127
  455    HG   LEU  59           HG       LEU  59  -5.535  -3.789  -3.440
  456   1HD1  LEU  59          HD11      LEU  59  -7.537  -5.097  -3.349
  457   2HD1  LEU  59          HD12      LEU  59  -7.878  -3.533  -2.608
  458   3HD1  LEU  59          HD13      LEU  59  -7.602  -4.946  -1.590
  459   1HD2  LEU  59          HD21      LEU  59  -4.465  -2.997  -1.266
  460   2HD2  LEU  59          HD22      LEU  59  -6.015  -3.327  -0.500
  461   3HD2  LEU  59          HD23      LEU  59  -5.897  -2.113  -1.773
  462    H    SER  60           HN       SER  60  -3.805  -6.836  -4.475
  463    HA   SER  60           HA       SER  60  -2.803  -9.237  -3.147
  464   1HB   SER  60          HB2       SER  60  -3.320  -8.908  -6.097
  465   2HB   SER  60          HB1       SER  60  -3.395 -10.384  -5.141
  466    HG   SER  60           HG       SER  60  -5.425  -9.096  -5.700
  467    H    ILE  61           HN       ILE  61  -1.138  -6.685  -4.375
  468    HA   ILE  61           HA       ILE  61   1.010  -8.306  -5.641
  469    HB   ILE  61           HB       ILE  61  -0.116  -6.071  -6.475
  470   1HG1  ILE  61          HG12      ILE  61   1.762  -7.361  -7.549
  471   2HG1  ILE  61          HG11      ILE  61   1.752  -5.641  -7.885
  472   1HG2  ILE  61          HG21      ILE  61   0.386  -4.748  -4.500
  473   2HG2  ILE  61          HG22      ILE  61   1.135  -4.065  -5.933
  474   3HG2  ILE  61          HG23      ILE  61   2.115  -4.953  -4.775
  475   1HD1  ILE  61          HD11      ILE  61   3.490  -5.275  -6.215
  476   2HD1  ILE  61          HD12      ILE  61   4.015  -6.506  -7.361
  477   3HD1  ILE  61          HD13      ILE  61   3.445  -6.980  -5.765
  478    H    LEU  62           HN       LEU  62   0.818  -5.745  -3.157
  479    HA   LEU  62           HA       LEU  62   3.453  -6.094  -2.186
  480   1HB   LEU  62          HB2       LEU  62   1.002  -5.164  -0.696
  481   2HB   LEU  62          HB1       LEU  62   2.666  -4.966  -0.139
  482    HG   LEU  62           HG       LEU  62   1.608  -3.907  -2.761
  483   1HD1  LEU  62          HD11      LEU  62   1.748  -1.677  -1.664
  484   2HD1  LEU  62          HD12      LEU  62   2.128  -2.484  -0.143
  485   3HD1  LEU  62          HD13      LEU  62   0.555  -2.729  -0.900
  486   1HD2  LEU  62          HD21      LEU  62   4.287  -3.933  -1.476
  487   2HD2  LEU  62          HD22      LEU  62   3.822  -2.463  -2.332
  488   3HD2  LEU  62          HD23      LEU  62   3.841  -4.007  -3.182
  489    H    LEU  63           HN       LEU  63   1.207  -8.464  -2.266
  490    HA   LEU  63           HA       LEU  63   1.848  -9.579   0.415
  491   1HB   LEU  63          HB2       LEU  63   0.156 -11.083  -1.540
  492   2HB   LEU  63          HB1       LEU  63  -0.025 -10.915   0.204
  493    HG   LEU  63           HG       LEU  63  -0.795  -8.966  -1.967
  494   1HD1  LEU  63          HD11      LEU  63  -2.413 -10.711  -1.387
  495   2HD1  LEU  63          HD12      LEU  63  -3.001  -9.146  -0.826
  496   3HD1  LEU  63          HD13      LEU  63  -2.293 -10.283   0.319
  497   1HD2  LEU  63          HD21      LEU  63  -0.125  -7.301  -0.539
  498   2HD2  LEU  63          HD22      LEU  63  -0.047  -8.377   0.856
  499   3HD2  LEU  63          HD23      LEU  63  -1.590  -7.706   0.349
  500    H    GLU  64           HN       GLU  64   2.056 -10.618  -3.033
  501    HA   GLU  64           HA       GLU  64   4.229 -12.516  -2.173
  502   1HB   GLU  64          HB2       GLU  64   2.016 -12.950  -4.188
  503   2HB   GLU  64          HB1       GLU  64   3.366 -14.057  -3.936
  504   1HG   GLU  64          HG2       GLU  64   2.697 -14.400  -1.606
  505   2HG   GLU  64          HG1       GLU  64   1.390 -13.228  -1.790
  506    H    GLU  65           HN       GLU  65   2.857 -11.110  -5.192
  507    HA   GLU  65           HA       GLU  65   5.163 -11.472  -6.753
  508   1HB   GLU  65          HB2       GLU  65   3.392  -9.014  -6.851
  509   2HB   GLU  65          HB1       GLU  65   4.345  -9.686  -8.175
  510   1HG   GLU  65          HG2       GLU  65   2.983 -11.763  -8.065
  511   2HG   GLU  65          HG1       GLU  65   2.000 -11.027  -6.799
  512    H    VAL  66           HN       VAL  66   4.751  -9.701  -4.002
  513    HA   VAL  66           HA       VAL  66   7.399  -8.397  -4.255
  514    HB   VAL  66           HB       VAL  66   4.701  -7.195  -3.838
  515   1HG1  VAL  66          HG11      VAL  66   7.238  -6.131  -2.625
  516   2HG1  VAL  66          HG12      VAL  66   5.713  -6.490  -1.812
  517   3HG1  VAL  66          HG13      VAL  66   5.815  -5.134  -2.928
  518   1HG2  VAL  66          HG21      VAL  66   7.169  -6.256  -5.270
  519   2HG2  VAL  66          HG22      VAL  66   5.592  -5.467  -5.297
  520   3HG2  VAL  66          HG23      VAL  66   5.790  -7.077  -5.996
  521    H    SER  67           HN       SER  67   8.538  -9.050  -2.455
  522    HA   SER  67           HA       SER  67   7.183 -10.265  -0.183
  523   1HB   SER  67          HB2       SER  67  10.025  -9.684  -0.945
  524   2HB   SER  67          HB1       SER  67   9.679 -10.010   0.749
  525    HG   SER  67           HG       SER  67   8.824 -11.652  -1.403
  526    HA   PRO  68           HA       PRO  68   6.426  -6.649   2.238
  527   1HB   PRO  68          HB2       PRO  68   7.631  -7.579   4.697
  528   2HB   PRO  68          HB1       PRO  68   5.913  -7.525   4.274
  529   1HG   PRO  68          HG2       PRO  68   7.670  -9.858   4.389
  530   2HG   PRO  68          HG1       PRO  68   5.919  -9.814   4.131
  531   1HD   PRO  68          HD2       PRO  68   7.896 -10.430   2.175
  532   2HD   PRO  68          HD1       PRO  68   6.172 -10.134   1.880
  533    H    GLU  69           HN       GLU  69   9.641  -8.095   2.770
  534    HA   GLU  69           HA       GLU  69  10.970  -5.754   3.664
  535   1HB   GLU  69          HB2       GLU  69  12.610  -7.522   1.915
  536   2HB   GLU  69          HB1       GLU  69  12.898  -7.006   3.572
  537   1HG   GLU  69          HG2       GLU  69  11.201  -9.307   2.590
  538   2HG   GLU  69          HG1       GLU  69  12.562  -9.343   3.702
  539    H    LEU  70           HN       LEU  70  10.707  -7.038   0.329
  540    HA   LEU  70           HA       LEU  70  12.127  -5.100  -1.057
  541   1HB   LEU  70          HB2       LEU  70  11.181  -6.938  -2.265
  542   2HB   LEU  70          HB1       LEU  70   9.547  -6.521  -1.754
  543    HG   LEU  70           HG       LEU  70   9.605  -4.483  -3.089
  544   1HD1  LEU  70          HD11      LEU  70  11.865  -3.771  -2.962
  545   2HD1  LEU  70          HD12      LEU  70  11.643  -4.217  -4.651
  546   3HD1  LEU  70          HD13      LEU  70  12.474  -5.316  -3.550
  547   1HD2  LEU  70          HD21      LEU  70   9.118  -6.808  -4.116
  548   2HD2  LEU  70          HD22      LEU  70  10.714  -6.675  -4.851
  549   3HD2  LEU  70          HD23      LEU  70   9.466  -5.489  -5.233
  550    H    VAL  71           HN       VAL  71   8.694  -4.917  -0.082
  551    HA   VAL  71           HA       VAL  71   7.970  -2.460  -1.124
  552    HB   VAL  71           HB       VAL  71   7.323  -3.109   1.755
  553   1HG1  VAL  71          HG11      VAL  71   5.781  -1.913  -0.570
  554   2HG1  VAL  71          HG12      VAL  71   6.323  -1.074   0.880
  555   3HG1  VAL  71          HG13      VAL  71   5.067  -2.301   0.994
  556   1HG2  VAL  71          HG21      VAL  71   6.411  -4.496  -0.761
  557   2HG2  VAL  71          HG22      VAL  71   5.499  -4.571   0.745
  558   3HG2  VAL  71          HG23      VAL  71   7.134  -5.214   0.664
  559    H    CYS  72           HN       CYS  72   9.355  -2.803   2.181
  560    HA   CYS  72           HA       CYS  72   9.819  -0.149   2.794
  561   1HB   CYS  72          HB2       CYS  72  11.671  -2.491   3.227
  562   2HB   CYS  72          HB1       CYS  72  11.941  -0.896   3.923
  563    H    SER  73           HN       SER  73  11.502  -2.077   0.398
  564    HA   SER  73           HA       SER  73  13.538  -0.051  -0.109
  565   1HB   SER  73          HB2       SER  73  13.169  -2.730  -0.867
  566   2HB   SER  73          HB1       SER  73  13.003  -1.836  -2.374
  567    HG   SER  73           HG       SER  73  15.095  -1.387  -0.515
  568    H    MET  74           HN       MET  74  10.584  -1.162  -1.859
  569    HA   MET  74           HA       MET  74  10.566   0.883  -3.823
  570   1HB   MET  74          HB2       MET  74   8.199  -0.403  -2.420
  571   2HB   MET  74          HB1       MET  74   8.105   0.531  -3.911
  572   1HG   MET  74          HG2       MET  74   9.913  -1.177  -4.774
  573   2HG   MET  74          HG1       MET  74   9.313  -2.185  -3.457
  574   1HE   MET  74          HE1       MET  74   6.314  -2.007  -3.150
  575   2HE   MET  74          HE2       MET  74   7.340  -3.424  -3.364
  576   3HE   MET  74          HE3       MET  74   5.873  -3.256  -4.330
  577    H    LEU  75           HN       LEU  75   9.387   0.914  -0.470
  578    HA   LEU  75           HA       LEU  75   8.148   3.505  -0.579
  579   1HB   LEU  75          HB2       LEU  75   9.466   2.219   1.833
  580   2HB   LEU  75          HB1       LEU  75   8.241   3.484   1.852
  581    HG   LEU  75           HG       LEU  75   7.855   0.660   0.838
  582   1HD1  LEU  75          HD11      LEU  75   8.024   1.138   3.379
  583   2HD1  LEU  75          HD12      LEU  75   6.626   0.235   2.797
  584   3HD1  LEU  75          HD13      LEU  75   6.470   1.950   3.176
  585   1HD2  LEU  75          HD21      LEU  75   6.406   1.953  -0.482
  586   2HD2  LEU  75          HD22      LEU  75   6.099   3.105   0.820
  587   3HD2  LEU  75          HD23      LEU  75   5.387   1.492   0.881
  588    H    HIS  76           HN       HIS  76  11.379   2.626  -0.894
  589    HA   HIS  76           HA       HIS  76  13.410   3.766  -0.575
  590   1HB   HIS  76          HB2       HIS  76  13.411   5.982  -1.608
  591   2HB   HIS  76          HB1       HIS  76  12.397   4.885  -2.545
  592    HD1  HIS  76           HD1      HIS  76  12.224   7.868  -0.274
  593    HD2  HIS  76           HD2      HIS  76   9.615   5.444  -2.437
  594    HE1  HIS  76           HE1      HIS  76   9.981   9.048  -0.270
  595    H    LEU  77           HN       LEU  77  12.234   3.431   1.870
  596    HA   LEU  77           HA       LEU  77  12.014   5.981   3.263
  597   1HB   LEU  77          HB2       LEU  77  10.966   3.487   3.758
  598   2HB   LEU  77          HB1       LEU  77  12.357   3.458   4.839
  599    HG   LEU  77           HG       LEU  77  11.504   5.837   5.541
  600   1HD1  LEU  77          HD11      LEU  77   8.855   4.638   4.735
  601   2HD1  LEU  77          HD12      LEU  77   9.736   5.712   3.651
  602   3HD1  LEU  77          HD13      LEU  77   9.205   6.295   5.229
  603   1HD2  LEU  77          HD21      LEU  77  11.544   3.815   7.001
  604   2HD2  LEU  77          HD22      LEU  77   9.973   3.344   6.356
  605   3HD2  LEU  77          HD23      LEU  77  10.129   4.822   7.307
  606    H    CYS  78           HN       CYS  78  14.480   3.578   2.650
  607    HA   CYS  78           HA       CYS  78  16.292   4.638   4.708
  608   1HB   CYS  78          HB2       CYS  78  16.852   2.721   2.424
  609   2HB   CYS  78          HB1       CYS  78  17.900   3.027   3.808
  610    H    SER  79           HN       SER  79  15.340   5.575   1.617
  611    HA   SER  79           HA       SER  79  17.689   6.419   0.337
  612   1HB   SER  79          HB2       SER  79  16.273   8.227  -0.660
  613   2HB   SER  79          HB1       SER  79  15.518   6.638  -0.737
  614    HG   SER  79           HG       SER  79  14.805   8.891   0.681
  615    H    GLY  80           HN       GLY  80  19.314   7.376   1.506
  616   1HA   GLY  80          HA2       GLY  80  18.730   9.401   3.551
  617   2HA   GLY  80          HA1       GLY  80  20.333   8.851   3.060
  618    H    LEU  81           HN       LEU  81  19.703   9.249   0.221
  619    HA   LEU  81           HA       LEU  81  19.715  12.228   0.052
  620   1HB   LEU  81          HB2       LEU  81  21.246  11.726  -2.008
  621   2HB   LEU  81          HB1       LEU  81  21.956  11.670  -0.399
  622    HG   LEU  81           HG       LEU  81  21.741   9.260  -0.323
  623   1HD1  LEU  81          HD11      LEU  81  19.763   8.736  -1.525
  624   2HD1  LEU  81          HD12      LEU  81  21.049   8.108  -2.548
  625   3HD1  LEU  81          HD13      LEU  81  20.283   9.642  -2.946
  626   1HD2  LEU  81          HD21      LEU  81  22.923  10.193  -2.953
  627   2HD2  LEU  81          HD22      LEU  81  23.317   8.684  -2.130
  628   3HD2  LEU  81          HD23      LEU  81  23.744  10.228  -1.392
  629    H    VAL  82           HN       VAL  82  19.552  12.583  -2.591
  630    HA   VAL  82           HA       VAL  82  16.924  11.469  -3.182
  631    HB   VAL  82           HB       VAL  82  17.320  12.765  -5.420
  632   1HG1  VAL  82          HG11      VAL  82  15.809  13.486  -3.601
  633   2HG1  VAL  82          HG12      VAL  82  16.638  14.860  -4.336
  634   3HG1  VAL  82          HG13      VAL  82  17.173  14.240  -2.773
  635   1HG2  VAL  82          HG21      VAL  82  19.418  14.056  -3.647
  636   2HG2  VAL  82          HG22      VAL  82  19.023  14.479  -5.314
  637   3HG2  VAL  82          HG23      VAL  82  19.806  12.940  -4.957
  638    HA   PRO  83           HA       PRO  83  18.570   7.811  -5.068
  639   1HB   PRO  83          HB2       PRO  83  16.428   8.012  -7.111
  640   2HB   PRO  83          HB1       PRO  83  16.781   6.701  -5.974
  641   1HG   PRO  83          HG2       PRO  83  14.681   8.537  -5.697
  642   2HG   PRO  83          HG1       PRO  83  15.345   7.535  -4.400
  643   1HD   PRO  83          HD2       PRO  83  15.596  10.437  -4.753
  644   2HD   PRO  83          HD1       PRO  83  16.052   9.430  -3.355
  645    H    ARG  84           HN       ARG  84  20.438   8.100  -6.259
  646    HA   ARG  84           HA       ARG  84  20.569  10.099  -8.398
  647   1HB   ARG  84          HB2       ARG  84  22.616   8.020  -7.567
  648   2HB   ARG  84          HB1       ARG  84  22.914   9.418  -8.591
  649   1HG   ARG  84          HG2       ARG  84  21.847   9.673  -5.770
  650   2HG   ARG  84          HG1       ARG  84  23.569   9.644  -6.112
  651   1HD   ARG  84          HD2       ARG  84  21.537  11.686  -7.024
  652   2HD   ARG  84          HD1       ARG  84  22.930  11.958  -5.993
  653    HE   ARG  84           HE       ARG  84  22.877  12.095  -8.857
  654   1HH1  ARG  84          HH21      ARG  84  24.819  10.845  -6.286
  655   2HH1  ARG  84          HH22      ARG  84  26.225  10.664  -7.278
  656   1HH2  ARG  84          HH11      ARG  84  24.701  11.879 -10.138
  657   2HH2  ARG  84          HH12      ARG  84  26.162  11.254  -9.449
  Start of MODEL    7
    1   1H    SER   1           HT1      SER   1  20.646   7.946  10.605
    2   2H    SER   1           HT2      SER   1  19.279   7.282   9.845
    3   3H    SER   1           HT3      SER   1  20.795   7.210   9.084
    4    HA   SER   1           HA       SER   1  21.634   5.687  10.686
    5   1HB   SER   1          HB2       SER   1  18.951   6.031  12.056
    6   2HB   SER   1          HB1       SER   1  20.241   4.948  12.570
    7    HG   SER   1           HG       SER   1  20.617   7.734  12.231
    8    H    ASP   2           HN       ASP   2  21.594   3.762   9.637
    9    HA   ASP   2           HA       ASP   2  19.351   3.048   7.928
   10   1HB   ASP   2          HB2       ASP   2  21.795   1.448   8.733
   11   2HB   ASP   2          HB1       ASP   2  20.681   1.031   7.430
   12    H    VAL   3           HN       VAL   3  18.544   3.277  10.634
   13    HA   VAL   3           HA       VAL   3  18.290   0.531  11.672
   14    HB   VAL   3           HB       VAL   3  18.637   2.667  13.069
   15   1HG1  VAL   3          HG11      VAL   3  15.658   2.895  12.781
   16   2HG1  VAL   3          HG12      VAL   3  16.807   3.918  11.911
   17   3HG1  VAL   3          HG13      VAL   3  16.743   3.961  13.671
   18   1HG2  VAL   3          HG21      VAL   3  17.317   1.752  14.923
   19   2HG2  VAL   3          HG22      VAL   3  18.070   0.446  14.007
   20   3HG2  VAL   3          HG23      VAL   3  16.359   0.809  13.782
   21    H    TYR   4           HN       TYR   4  16.533   2.763   9.724
   22    HA   TYR   4           HA       TYR   4  13.868   1.873  10.191
   23   1HB   TYR   4          HB2       TYR   4  14.836   2.606   7.433
   24   2HB   TYR   4          HB1       TYR   4  13.283   2.951   8.184
   25    HD1  TYR   4           HD1      TYR   4  15.078   4.920   6.746
   26    HD2  TYR   4           HD2      TYR   4  14.768   3.887  10.912
   27    HE1  TYR   4           HE1      TYR   4  15.902   7.163   7.365
   28    HE2  TYR   4           HE2      TYR   4  15.603   6.132  11.524
   29    HH   TYR   4           HH       TYR   4  16.068   8.194  10.756
   30    H    CYS   5           HN       CYS   5  16.553   0.294   8.732
   31    HA   CYS   5           HA       CYS   5  15.132  -1.471   6.969
   32   1HB   CYS   5          HB2       CYS   5  17.662  -2.231   8.438
   33   2HB   CYS   5          HB1       CYS   5  17.154  -2.695   6.815
   34    H    GLU   6           HN       GLU   6  15.963  -1.628  10.409
   35    HA   GLU   6           HA       GLU   6  14.834  -4.322  10.700
   36   1HB   GLU   6          HB2       GLU   6  15.822  -2.282  12.713
   37   2HB   GLU   6          HB1       GLU   6  15.245  -3.891  13.146
   38   1HG   GLU   6          HG2       GLU   6  17.486  -3.400  11.168
   39   2HG   GLU   6          HG1       GLU   6  17.753  -3.721  12.882
   40    H    VAL   7           HN       VAL   7  13.764  -1.004  11.105
   41    HA   VAL   7           HA       VAL   7  11.330  -1.801  12.562
   42    HB   VAL   7           HB       VAL   7  11.960   0.895  11.338
   43   1HG1  VAL   7          HG11      VAL   7  10.205  -0.023  13.636
   44   2HG1  VAL   7          HG12      VAL   7   9.655   0.607  12.084
   45   3HG1  VAL   7          HG13      VAL   7  10.500   1.665  13.214
   46   1HG2  VAL   7          HG21      VAL   7  13.837   0.179  12.774
   47   2HG2  VAL   7          HG22      VAL   7  12.706  -0.188  14.075
   48   3HG2  VAL   7          HG23      VAL   7  12.926   1.479  13.541
   49    H    CYS   8           HN       CYS   8  12.253  -0.869   9.275
   50    HA   CYS   8           HA       CYS   8   9.480  -0.773   8.355
   51   1HB   CYS   8          HB2       CYS   8  10.361  -0.204   6.238
   52   2HB   CYS   8          HB1       CYS   8  11.484   0.528   7.382
   53    H    GLU   9           HN       GLU   9  11.905  -3.222   8.732
   54    HA   GLU   9           HA       GLU   9  10.502  -5.064   6.848
   55   1HB   GLU   9          HB2       GLU   9  12.964  -5.592   8.570
   56   2HB   GLU   9          HB1       GLU   9  12.258  -6.711   7.410
   57   1HG   GLU   9          HG2       GLU   9  12.807  -5.347   5.558
   58   2HG   GLU   9          HG1       GLU   9  13.116  -3.943   6.573
   59    H    PHE  10           HN       PHE  10  10.765  -4.406  10.266
   60    HA   PHE  10           HA       PHE  10   9.567  -6.961  11.055
   61   1HB   PHE  10          HB2       PHE  10  11.080  -5.823  12.602
   62   2HB   PHE  10          HB1       PHE  10  10.043  -4.396  12.605
   63    HD1  PHE  10           HD1      PHE  10  10.054  -8.054  13.382
   64    HD2  PHE  10           HD2      PHE  10   8.231  -4.234  14.116
   65    HE1  PHE  10           HE1      PHE  10   8.694  -9.052  15.199
   66    HE2  PHE  10           HE2      PHE  10   6.871  -5.233  15.933
   67    HZ   PHE  10           HZ       PHE  10   7.102  -7.641  16.475
   68    H    LEU  11           HN       LEU  11   8.463  -3.670  10.415
   69    HA   LEU  11           HA       LEU  11   5.743  -4.260  11.381
   70   1HB   LEU  11          HB2       LEU  11   6.844  -1.858   9.892
   71   2HB   LEU  11          HB1       LEU  11   5.240  -1.963  10.611
   72    HG   LEU  11           HG       LEU  11   7.819  -2.285  12.175
   73   1HD1  LEU  11          HD11      LEU  11   7.451   0.002  12.958
   74   2HD1  LEU  11          HD12      LEU  11   5.993   0.129  11.974
   75   3HD1  LEU  11          HD13      LEU  11   7.570  -0.007  11.198
   76   1HD2  LEU  11          HD21      LEU  11   6.089  -1.656  14.056
   77   2HD2  LEU  11          HD22      LEU  11   6.131  -3.308  13.452
   78   3HD2  LEU  11          HD23      LEU  11   4.884  -2.198  12.887
   79    H    VAL  12           HN       VAL  12   7.285  -3.562   8.227
   80    HA   VAL  12           HA       VAL  12   4.899  -3.923   6.698
   81    HB   VAL  12           HB       VAL  12   7.749  -4.419   5.795
   82   1HG1  VAL  12          HG11      VAL  12   5.137  -3.900   4.366
   83   2HG1  VAL  12          HG12      VAL  12   6.257  -5.241   4.138
   84   3HG1  VAL  12          HG13      VAL  12   6.696  -3.625   3.591
   85   1HG2  VAL  12          HG21      VAL  12   7.910  -2.100   5.291
   86   2HG2  VAL  12          HG22      VAL  12   7.189  -2.133   6.899
   87   3HG2  VAL  12          HG23      VAL  12   6.175  -1.851   5.486
   88    H    LYS  13           HN       LYS  13   7.213  -6.219   8.017
   89    HA   LYS  13           HA       LYS  13   6.216  -8.470   6.414
   90   1HB   LYS  13          HB2       LYS  13   8.540  -8.377   7.195
   91   2HB   LYS  13          HB1       LYS  13   7.980  -8.392   8.864
   92   1HG   LYS  13          HG2       LYS  13   6.724 -10.633   7.594
   93   2HG   LYS  13          HG1       LYS  13   8.399 -10.651   7.062
   94   1HD   LYS  13          HD2       LYS  13   8.412 -11.920   9.052
   95   2HD   LYS  13          HD1       LYS  13   9.006 -10.339   9.556
   96   1HE   LYS  13          HE2       LYS  13   6.782  -9.723  10.366
   97   2HE   LYS  13          HE1       LYS  13   6.120 -11.245   9.776
   98   1HZ   LYS  13          HZ1       LYS  13   7.279 -12.457  11.360
   99   2HZ   LYS  13          HZ2       LYS  13   6.759 -11.089  12.224
  100   3HZ   LYS  13          HZ3       LYS  13   8.367 -11.198  11.687
  101    H    GLU  14           HN       GLU  14   5.732  -7.173   9.688
  102    HA   GLU  14           HA       GLU  14   4.119  -9.411  10.591
  103   1HB   GLU  14          HB2       GLU  14   5.266  -7.785  12.131
  104   2HB   GLU  14          HB1       GLU  14   4.115  -6.553  11.616
  105   1HG   GLU  14          HG2       GLU  14   2.250  -7.877  12.454
  106   2HG   GLU  14          HG1       GLU  14   3.337  -9.206  12.860
  107    H    VAL  15           HN       VAL  15   3.216  -6.053   9.778
  108    HA   VAL  15           HA       VAL  15   0.454  -6.292   9.672
  109    HB   VAL  15           HB       VAL  15   1.834  -4.208   9.202
  110   1HG1  VAL  15          HG11      VAL  15   2.579  -3.779   6.968
  111   2HG1  VAL  15          HG12      VAL  15   1.784  -5.226   6.353
  112   3HG1  VAL  15          HG13      VAL  15   3.198  -5.375   7.394
  113   1HG2  VAL  15          HG21      VAL  15   0.131  -3.343   7.525
  114   2HG2  VAL  15          HG22      VAL  15  -0.551  -4.103   8.963
  115   3HG2  VAL  15          HG23      VAL  15  -0.500  -4.988   7.440
  116    H    THR  16           HN       THR  16   2.814  -7.325   7.235
  117    HA   THR  16           HA       THR  16   0.993  -8.118   5.226
  118    HB   THR  16           HB       THR  16   3.048 -10.091   5.290
  119    HG1  THR  16           HG1      THR  16   3.661  -8.268   6.955
  120   1HG2  THR  16          HG21      THR  16   4.037  -8.664   3.497
  121   2HG2  THR  16          HG22      THR  16   2.877  -7.399   3.915
  122   3HG2  THR  16          HG23      THR  16   2.300  -8.947   3.275
  123    H    LYS  17           HN       LYS  17   2.190  -9.877   8.096
  124    HA   LYS  17           HA       LYS  17   0.972 -12.356   7.761
  125   1HB   LYS  17          HB2       LYS  17   1.103 -10.727  10.325
  126   2HB   LYS  17          HB1       LYS  17   0.758 -12.450  10.246
  127   1HG   LYS  17          HG2       LYS  17   3.258 -11.382   8.942
  128   2HG   LYS  17          HG1       LYS  17   3.227 -11.640  10.685
  129   1HD   LYS  17          HD2       LYS  17   2.511 -13.998  10.297
  130   2HD   LYS  17          HD1       LYS  17   2.660 -13.730   8.560
  131   1HE   LYS  17          HE2       LYS  17   4.701 -14.778   9.399
  132   2HE   LYS  17          HE1       LYS  17   5.052 -13.128   8.885
  133   1HZ   LYS  17          HZ1       LYS  17   5.348 -14.285  11.442
  134   2HZ   LYS  17          HZ2       LYS  17   4.258 -12.986  11.535
  135   3HZ   LYS  17          HZ3       LYS  17   5.819 -12.745  10.911
  136    H    LEU  18           HN       LEU  18  -0.546  -9.303   8.677
  137    HA   LEU  18           HA       LEU  18  -3.201 -10.653   8.853
  138   1HB   LEU  18          HB2       LEU  18  -3.272  -7.708   9.064
  139   2HB   LEU  18          HB1       LEU  18  -3.859  -8.923  10.190
  140    HG   LEU  18           HG       LEU  18  -0.939  -8.159   9.923
  141   1HD1  LEU  18          HD11      LEU  18  -3.075  -7.229  11.851
  142   2HD1  LEU  18          HD12      LEU  18  -2.195  -6.238  10.685
  143   3HD1  LEU  18          HD13      LEU  18  -1.347  -6.945  12.063
  144   1HD2  LEU  18          HD21      LEU  18  -2.336  -9.529  12.231
  145   2HD2  LEU  18          HD22      LEU  18  -0.615  -9.512  11.846
  146   3HD2  LEU  18          HD23      LEU  18  -1.730 -10.467  10.865
  147    H    ILE  19           HN       ILE  19  -1.726  -7.909   7.103
  148    HA   ILE  19           HA       ILE  19  -3.776  -7.468   5.252
  149    HB   ILE  19           HB       ILE  19  -0.887  -6.972   5.494
  150   1HG1  ILE  19          HG12      ILE  19  -2.991  -5.225   4.228
  151   2HG1  ILE  19          HG11      ILE  19  -2.769  -5.349   5.972
  152   1HG2  ILE  19          HG21      ILE  19  -0.662  -7.933   3.332
  153   2HG2  ILE  19          HG22      ILE  19  -0.665  -6.187   3.105
  154   3HG2  ILE  19          HG23      ILE  19  -2.116  -7.125   2.748
  155   1HD1  ILE  19          HD11      ILE  19  -1.115  -3.961   3.963
  156   2HD1  ILE  19          HD12      ILE  19  -0.174  -4.901   5.125
  157   3HD1  ILE  19          HD13      ILE  19  -1.286  -3.649   5.687
  158    H    ASP  20           HN       ASP  20  -1.481 -10.069   5.529
  159    HA   ASP  20           HA       ASP  20  -1.299 -11.131   2.976
  160   1HB   ASP  20          HB2       ASP  20  -0.196 -12.252   4.805
  161   2HB   ASP  20          HB1       ASP  20  -1.729 -12.580   5.610
  162    H    ASN  21           HN       ASN  21  -3.923 -11.890   5.327
  163    HA   ASN  21           HA       ASN  21  -5.891 -11.856   3.173
  164   1HB   ASN  21          HB2       ASN  21  -5.433 -14.433   4.684
  165   2HB   ASN  21          HB1       ASN  21  -6.638 -14.147   3.424
  166   1HD2  ASN  21          HD21      ASN  21  -5.684 -13.496   1.213
  167   2HD2  ASN  21          HD22      ASN  21  -4.205 -14.196   0.762
  168    H    ASN  22           HN       ASN  22  -5.993 -10.135   5.136
  169    HA   ASN  22           HA       ASN  22  -7.955 -11.206   7.142
  170   1HB   ASN  22          HB2       ASN  22  -6.092  -8.820   7.235
  171   2HB   ASN  22          HB1       ASN  22  -7.373  -9.100   8.415
  172   1HD2  ASN  22          HD21      ASN  22  -5.332 -11.620   6.879
  173   2HD2  ASN  22          HD22      ASN  22  -4.582 -12.110   8.332
  174    H    LYS  23           HN       LYS  23  -7.171  -8.395   5.112
  175    HA   LYS  23           HA       LYS  23 -10.112  -7.836   4.858
  176   1HB   LYS  23          HB2       LYS  23  -9.616  -5.487   4.700
  177   2HB   LYS  23          HB1       LYS  23  -8.818  -6.103   6.142
  178   1HG   LYS  23          HG2       LYS  23  -6.997  -4.995   5.278
  179   2HG   LYS  23          HG1       LYS  23  -6.807  -6.472   4.341
  180   1HD   LYS  23          HD2       LYS  23  -8.477  -5.229   2.668
  181   2HD   LYS  23          HD1       LYS  23  -7.874  -3.793   3.488
  182   1HE   LYS  23          HE2       LYS  23  -6.136  -5.893   2.158
  183   2HE   LYS  23          HE1       LYS  23  -6.534  -4.318   1.470
  184   1HZ   LYS  23          HZ1       LYS  23  -5.582  -3.980   4.095
  185   2HZ   LYS  23          HZ2       LYS  23  -4.918  -3.403   2.643
  186   3HZ   LYS  23          HZ3       LYS  23  -4.476  -4.933   3.233
  187    H    THR  24           HN       THR  24 -10.798  -8.321   2.849
  188    HA   THR  24           HA       THR  24  -8.838  -8.641   0.676
  189    HB   THR  24           HB       THR  24 -10.874  -9.395  -0.614
  190    HG1  THR  24           HG1      THR  24 -12.156  -9.277   1.896
  191   1HG2  THR  24          HG21      THR  24 -11.037 -11.504   0.559
  192   2HG2  THR  24          HG22      THR  24 -10.523 -10.757   2.071
  193   3HG2  THR  24          HG23      THR  24  -9.382 -10.921   0.736
  194    H    GLU  25           HN       GLU  25 -10.172  -7.879  -1.572
  195    HA   GLU  25           HA       GLU  25  -9.956  -4.952  -1.422
  196   1HB   GLU  25          HB2       GLU  25 -10.634  -6.662  -3.826
  197   2HB   GLU  25          HB1       GLU  25 -10.030  -5.007  -3.828
  198   1HG   GLU  25          HG2       GLU  25  -8.115  -6.337  -4.274
  199   2HG   GLU  25          HG1       GLU  25  -7.984  -5.933  -2.562
  200    H    LYS  26           HN       LYS  26 -12.415  -6.751  -0.469
  201    HA   LYS  26           HA       LYS  26 -14.575  -5.546  -2.066
  202   1HB   LYS  26          HB2       LYS  26 -14.488  -7.393   0.331
  203   2HB   LYS  26          HB1       LYS  26 -15.998  -6.670  -0.220
  204   1HG   LYS  26          HG2       LYS  26 -15.816  -8.835  -1.254
  205   2HG   LYS  26          HG1       LYS  26 -15.554  -7.624  -2.504
  206   1HD   LYS  26          HD2       LYS  26 -13.052  -8.477  -1.142
  207   2HD   LYS  26          HD1       LYS  26 -13.867  -9.780  -1.999
  208   1HE   LYS  26          HE2       LYS  26 -13.388  -7.112  -3.326
  209   2HE   LYS  26          HE1       LYS  26 -12.153  -8.371  -3.320
  210   1HZ   LYS  26          HZ1       LYS  26 -13.330  -9.658  -4.719
  211   2HZ   LYS  26          HZ2       LYS  26 -14.047  -8.185  -5.169
  212   3HZ   LYS  26          HZ3       LYS  26 -14.830  -9.212  -4.066
  213    H    GLU  27           HN       GLU  27 -13.319  -5.379   1.258
  214    HA   GLU  27           HA       GLU  27 -15.077  -3.206   1.985
  215   1HB   GLU  27          HB2       GLU  27 -12.530  -4.203   3.288
  216   2HB   GLU  27          HB1       GLU  27 -13.650  -3.051   4.014
  217   1HG   GLU  27          HG2       GLU  27 -14.448  -5.832   3.113
  218   2HG   GLU  27          HG1       GLU  27 -14.001  -5.428   4.771
  219    H    ILE  28           HN       ILE  28 -12.254  -3.399   0.122
  220    HA   ILE  28           HA       ILE  28 -11.253  -0.720   0.772
  221    HB   ILE  28           HB       ILE  28 -10.544  -2.695  -1.413
  222   1HG1  ILE  28          HG12      ILE  28  -9.976  -3.521   0.824
  223   2HG1  ILE  28          HG11      ILE  28  -8.511  -3.082  -0.044
  224   1HG2  ILE  28          HG21      ILE  28  -9.361  -0.046  -0.617
  225   2HG2  ILE  28          HG22      ILE  28  -9.937  -0.548  -2.207
  226   3HG2  ILE  28          HG23      ILE  28  -8.465  -1.242  -1.541
  227   1HD1  ILE  28          HD11      ILE  28  -9.772  -1.786   2.327
  228   2HD1  ILE  28          HD12      ILE  28  -8.948  -0.729   1.183
  229   3HD1  ILE  28          HD13      ILE  28  -8.069  -2.041   1.959
  230    H    LEU  29           HN       LEU  29 -12.062  -2.113  -2.410
  231    HA   LEU  29           HA       LEU  29 -12.554   0.273  -3.750
  232   1HB   LEU  29          HB2       LEU  29 -14.195  -2.247  -4.141
  233   2HB   LEU  29          HB1       LEU  29 -13.863  -0.998  -5.341
  234    HG   LEU  29           HG       LEU  29 -11.806  -2.811  -4.045
  235   1HD1  LEU  29          HD11      LEU  29 -13.324  -3.831  -5.782
  236   2HD1  LEU  29          HD12      LEU  29 -11.614  -3.845  -6.211
  237   3HD1  LEU  29          HD13      LEU  29 -12.694  -2.653  -6.934
  238   1HD2  LEU  29          HD21      LEU  29 -11.587  -0.434  -5.894
  239   2HD2  LEU  29          HD22      LEU  29 -10.376  -1.716  -5.949
  240   3HD2  LEU  29          HD23      LEU  29 -10.633  -0.814  -4.458
  241    H    ASP  30           HN       ASP  30 -14.571  -1.312  -1.383
  242    HA   ASP  30           HA       ASP  30 -16.954   0.257  -1.976
  243   1HB   ASP  30          HB2       ASP  30 -16.095  -1.282   0.500
  244   2HB   ASP  30          HB1       ASP  30 -17.673  -0.517   0.313
  245    H    ALA  31           HN       ALA  31 -14.245   0.423   0.312
  246    HA   ALA  31           HA       ALA  31 -14.993   2.677   1.776
  247   1HB   ALA  31          HB1       ALA  31 -12.707   3.105   2.196
  248   2HB   ALA  31          HB2       ALA  31 -12.210   2.222   0.748
  249   3HB   ALA  31          HB3       ALA  31 -12.903   1.355   2.120
  250    H    PHE  32           HN       PHE  32 -13.071   2.689  -1.254
  251    HA   PHE  32           HA       PHE  32 -13.009   5.457  -1.630
  252   1HB   PHE  32          HB2       PHE  32 -13.302   3.233  -3.677
  253   2HB   PHE  32          HB1       PHE  32 -13.082   4.919  -4.136
  254    HD1  PHE  32           HD1      PHE  32 -10.917   5.902  -4.142
  255    HD2  PHE  32           HD2      PHE  32 -11.548   2.146  -2.151
  256    HE1  PHE  32           HE1      PHE  32  -8.477   5.668  -3.812
  257    HE2  PHE  32           HE2      PHE  32  -9.100   1.918  -1.825
  258    HZ   PHE  32           HZ       PHE  32  -7.568   3.677  -2.654
  259    H    ASP  33           HN       ASP  33 -15.718   3.229  -2.232
  260    HA   ASP  33           HA       ASP  33 -17.419   5.052  -3.570
  261   1HB   ASP  33          HB2       ASP  33 -17.823   2.540  -2.931
  262   2HB   ASP  33          HB1       ASP  33 -18.485   3.196  -1.434
  263    H    LYS  34           HN       LYS  34 -16.151   5.076  -0.397
  264    HA   LYS  34           HA       LYS  34 -18.168   7.090   0.538
  265   1HB   LYS  34          HB2       LYS  34 -16.022   5.505   2.001
  266   2HB   LYS  34          HB1       LYS  34 -16.895   6.834   2.750
  267   1HG   LYS  34          HG2       LYS  34 -18.511   5.348   3.337
  268   2HG   LYS  34          HG1       LYS  34 -18.940   5.218   1.634
  269   1HD   LYS  34          HD2       LYS  34 -18.540   2.992   2.282
  270   2HD   LYS  34          HD1       LYS  34 -17.027   3.466   1.515
  271   1HE   LYS  34          HE2       LYS  34 -16.363   2.442   3.564
  272   2HE   LYS  34          HE1       LYS  34 -16.262   4.175   3.874
  273   1HZ   LYS  34          HZ1       LYS  34 -18.314   2.254   4.760
  274   2HZ   LYS  34          HZ2       LYS  34 -18.674   3.911   4.651
  275   3HZ   LYS  34          HZ3       LYS  34 -17.433   3.374   5.680
  276    H    MET  35           HN       MET  35 -14.611   6.823   1.077
  277    HA   MET  35           HA       MET  35 -14.287   9.620   1.400
  278   1HB   MET  35          HB2       MET  35 -12.020   8.052   0.245
  279   2HB   MET  35          HB1       MET  35 -12.003   9.262   1.517
  280   1HG   MET  35          HG2       MET  35 -11.683   7.298   2.729
  281   2HG   MET  35          HG1       MET  35 -13.426   7.497   2.840
  282   1HE   MET  35          HE1       MET  35 -10.481   6.066   1.179
  283   2HE   MET  35          HE2       MET  35 -11.260   6.064  -0.399
  284   3HE   MET  35          HE3       MET  35 -10.979   4.540   0.441
  285    H    CYS  36           HN       CYS  36 -13.820   7.621  -1.509
  286    HA   CYS  36           HA       CYS  36 -13.141   9.928  -3.140
  287   1HB   CYS  36          HB2       CYS  36 -12.521   7.451  -3.532
  288   2HB   CYS  36          HB1       CYS  36 -14.154   7.275  -4.173
  289    H    SER  37           HN       SER  37 -15.800   9.594  -1.562
  290    HA   SER  37           HA       SER  37 -17.780   9.906  -3.743
  291   1HB   SER  37          HB2       SER  37 -19.431   9.671  -2.093
  292   2HB   SER  37          HB1       SER  37 -18.144   8.631  -1.503
  293    HG   SER  37           HG       SER  37 -19.242  10.558  -0.204
  294    H    LYS  38           HN       LYS  38 -16.633  11.701  -0.887
  295    HA   LYS  38           HA       LYS  38 -17.978  14.153  -1.608
  296   1HB   LYS  38          HB2       LYS  38 -16.552  15.146   0.181
  297   2HB   LYS  38          HB1       LYS  38 -17.381  13.684   0.715
  298   1HG   LYS  38          HG2       LYS  38 -15.277  12.395   0.080
  299   2HG   LYS  38          HG1       LYS  38 -14.483  13.957  -0.125
  300   1HD   LYS  38          HD2       LYS  38 -15.279  14.497   2.255
  301   2HD   LYS  38          HD1       LYS  38 -15.650  12.779   2.401
  302   1HE   LYS  38          HE2       LYS  38 -13.418  13.130   3.267
  303   2HE   LYS  38          HE1       LYS  38 -13.276  12.282   1.727
  304   1HZ   LYS  38          HZ1       LYS  38 -13.290  14.941   1.072
  305   2HZ   LYS  38          HZ2       LYS  38 -11.935  13.916   1.103
  306   3HZ   LYS  38          HZ3       LYS  38 -12.319  14.863   2.461
  307    H    LEU  39           HN       LEU  39 -14.964  12.702  -2.523
  308    HA   LEU  39           HA       LEU  39 -13.312  14.823  -3.105
  309   1HB   LEU  39          HB2       LEU  39 -13.551  12.114  -4.002
  310   2HB   LEU  39          HB1       LEU  39 -13.377  13.073  -5.450
  311    HG   LEU  39           HG       LEU  39 -11.392  14.089  -3.665
  312   1HD1  LEU  39          HD11      LEU  39 -11.884  11.921  -2.386
  313   2HD1  LEU  39          HD12      LEU  39 -10.202  12.236  -2.823
  314   3HD1  LEU  39          HD13      LEU  39 -11.157  11.089  -3.763
  315   1HD2  LEU  39          HD21      LEU  39  -9.838  13.261  -5.303
  316   2HD2  LEU  39          HD22      LEU  39 -11.296  13.765  -6.163
  317   3HD2  LEU  39          HD23      LEU  39 -10.995  12.053  -5.864
  318    HA   PRO  40           HA       PRO  40 -15.541  17.416  -5.962
  319   1HB   PRO  40          HB2       PRO  40 -13.221  17.960  -7.638
  320   2HB   PRO  40          HB1       PRO  40 -14.002  19.038  -6.474
  321   1HG   PRO  40          HG2       PRO  40 -11.464  17.709  -6.188
  322   2HG   PRO  40          HG1       PRO  40 -12.281  18.733  -4.996
  323   1HD   PRO  40          HD2       PRO  40 -11.950  15.861  -4.927
  324   2HD   PRO  40          HD1       PRO  40 -12.751  16.895  -3.727
  325    H    LYS  41           HN       LYS  41 -16.686  16.837  -7.790
  326    HA   LYS  41           HA       LYS  41 -16.725  14.399  -8.979
  327   1HB   LYS  41          HB2       LYS  41 -18.203  16.433  -9.403
  328   2HB   LYS  41          HB1       LYS  41 -17.024  16.898 -10.628
  329   1HG   LYS  41          HG2       LYS  41 -17.325  14.642 -11.684
  330   2HG   LYS  41          HG1       LYS  41 -18.627  14.333 -10.533
  331   1HD   LYS  41          HD2       LYS  41 -19.892  15.211 -12.267
  332   2HD   LYS  41          HD1       LYS  41 -19.498  16.708 -11.423
  333   1HE   LYS  41          HE2       LYS  41 -18.951  17.193 -13.662
  334   2HE   LYS  41          HE1       LYS  41 -17.394  16.754 -12.962
  335   1HZ   LYS  41          HZ1       LYS  41 -19.186  15.002 -14.552
  336   2HZ   LYS  41          HZ2       LYS  41 -17.779  14.468 -13.765
  337   3HZ   LYS  41          HZ3       LYS  41 -17.672  15.604 -15.024
  338    H    SER  42           HN       SER  42 -14.826  17.094 -10.260
  339    HA   SER  42           HA       SER  42 -13.646  15.882 -12.467
  340   1HB   SER  42          HB2       SER  42 -12.243  17.707 -10.500
  341   2HB   SER  42          HB1       SER  42 -11.787  17.443 -12.181
  342    HG   SER  42           HG       SER  42 -13.686  18.408 -12.825
  343    H    LEU  43           HN       LEU  43 -12.023  16.050  -9.262
  344    HA   LEU  43           HA       LEU  43 -10.205  13.921 -10.096
  345   1HB   LEU  43          HB2       LEU  43 -10.524  15.577  -7.605
  346   2HB   LEU  43          HB1       LEU  43  -9.534  14.119  -7.554
  347    HG   LEU  43           HG       LEU  43  -8.280  15.019  -9.566
  348   1HD1  LEU  43          HD11      LEU  43  -9.904  16.626 -10.360
  349   2HD1  LEU  43          HD12      LEU  43  -8.457  17.504  -9.861
  350   3HD1  LEU  43          HD13      LEU  43  -9.878  17.481  -8.816
  351   1HD2  LEU  43          HD21      LEU  43  -6.970  16.616  -8.169
  352   2HD2  LEU  43          HD22      LEU  43  -7.349  15.116  -7.318
  353   3HD2  LEU  43          HD23      LEU  43  -8.265  16.584  -6.970
  354    H    SER  44           HN       SER  44 -13.366  13.821  -9.022
  355    HA   SER  44           HA       SER  44 -13.039  11.447  -7.306
  356   1HB   SER  44          HB2       SER  44 -15.345  11.566  -6.932
  357   2HB   SER  44          HB1       SER  44 -14.986  13.257  -7.253
  358    HG   SER  44           HG       SER  44 -16.524  11.532  -8.641
  359    H    GLU  45           HN       GLU  45 -13.613  12.399 -10.569
  360    HA   GLU  45           HA       GLU  45 -14.395   9.765 -11.490
  361   1HB   GLU  45          HB2       GLU  45 -13.577  12.300 -12.923
  362   2HB   GLU  45          HB1       GLU  45 -14.002  10.814 -13.774
  363   1HG   GLU  45          HG2       GLU  45 -15.825  12.147 -11.757
  364   2HG   GLU  45          HG1       GLU  45 -15.912  12.456 -13.491
  365    H    GLU  46           HN       GLU  46 -11.484  11.665 -11.134
  366    HA   GLU  46           HA       GLU  46  -9.833   9.735 -12.616
  367   1HB   GLU  46          HB2       GLU  46  -8.989  12.099 -10.919
  368   2HB   GLU  46          HB1       GLU  46  -7.974  11.213 -12.056
  369   1HG   GLU  46          HG2       GLU  46  -9.479  11.872 -13.907
  370   2HG   GLU  46          HG1       GLU  46 -10.466  12.786 -12.767
  371    H    CYS  47           HN       CYS  47 -10.804  10.333  -9.317
  372    HA   CYS  47           HA       CYS  47  -8.613   8.839  -8.112
  373   1HB   CYS  47          HB2       CYS  47  -9.532  10.186  -6.467
  374   2HB   CYS  47          HB1       CYS  47 -11.122  10.145  -7.203
  375    H    GLN  48           HN       GLN  48 -11.738   8.072  -9.492
  376    HA   GLN  48           HA       GLN  48 -11.677   5.312  -8.423
  377   1HB   GLN  48          HB2       GLN  48 -13.633   6.974 -10.009
  378   2HB   GLN  48          HB1       GLN  48 -13.776   5.216 -10.036
  379   1HG   GLN  48          HG2       GLN  48 -13.552   6.732  -7.431
  380   2HG   GLN  48          HG1       GLN  48 -15.111   6.493  -8.222
  381   1HE2  GLN  48          HE21      GLN  48 -14.155   5.299  -5.641
  382   2HE2  GLN  48          HE22      GLN  48 -14.247   3.617  -5.854
  383    H    GLU  49           HN       GLU  49 -10.775   7.190 -11.168
  384    HA   GLU  49           HA       GLU  49 -10.685   5.020 -13.051
  385   1HB   GLU  49          HB2       GLU  49 -10.768   7.481 -13.644
  386   2HB   GLU  49          HB1       GLU  49  -9.089   7.586 -13.119
  387   1HG   GLU  49          HG2       GLU  49  -9.012   7.241 -15.472
  388   2HG   GLU  49          HG1       GLU  49  -8.599   5.692 -14.741
  389    H    VAL  50           HN       VAL  50  -8.296   6.654 -10.966
  390    HA   VAL  50           HA       VAL  50  -6.103   5.002 -11.817
  391    HB   VAL  50           HB       VAL  50  -5.879   7.214 -10.590
  392   1HG1  VAL  50          HG11      VAL  50  -6.323   5.544  -8.113
  393   2HG1  VAL  50          HG12      VAL  50  -7.609   6.505  -8.841
  394   3HG1  VAL  50          HG13      VAL  50  -6.158   7.296  -8.231
  395   1HG2  VAL  50          HG21      VAL  50  -4.086   5.317 -10.848
  396   2HG2  VAL  50          HG22      VAL  50  -4.423   4.992  -9.146
  397   3HG2  VAL  50          HG23      VAL  50  -3.804   6.569  -9.634
  398    H    VAL  51           HN       VAL  51  -8.404   4.784  -9.098
  399    HA   VAL  51           HA       VAL  51  -7.360   2.605  -7.666
  400    HB   VAL  51           HB       VAL  51 -10.219   3.299  -8.435
  401   1HG1  VAL  51          HG11      VAL  51 -10.284   0.944  -7.966
  402   2HG1  VAL  51          HG12      VAL  51 -10.857   1.769  -6.518
  403   3HG1  VAL  51          HG13      VAL  51  -9.215   1.134  -6.576
  404   1HG2  VAL  51          HG21      VAL  51 -10.321   4.438  -6.401
  405   2HG2  VAL  51          HG22      VAL  51  -8.633   4.702  -6.826
  406   3HG2  VAL  51          HG23      VAL  51  -9.059   3.453  -5.660
  407    H    ASP  52           HN       ASP  52  -9.410   2.462 -10.608
  408    HA   ASP  52           HA       ASP  52  -9.351  -0.356 -10.936
  409   1HB   ASP  52          HB2       ASP  52 -10.712   1.236 -12.334
  410   2HB   ASP  52          HB1       ASP  52  -9.225   1.720 -13.151
  411    H    THR  53           HN       THR  53  -7.007   2.169 -11.663
  412    HA   THR  53           HA       THR  53  -5.126   0.293 -12.875
  413    HB   THR  53           HB       THR  53  -4.790   3.189 -12.225
  414    HG1  THR  53           HG1      THR  53  -5.422   3.540 -14.226
  415   1HG2  THR  53          HG21      THR  53  -2.648   1.868 -12.352
  416   2HG2  THR  53          HG22      THR  53  -2.800   3.095 -13.607
  417   3HG2  THR  53          HG23      THR  53  -3.109   1.402 -13.987
  418    H    TYR  54           HN       TYR  54  -5.822   1.567  -9.774
  419    HA   TYR  54           HA       TYR  54  -3.474   0.079  -8.651
  420   1HB   TYR  54          HB2       TYR  54  -4.520   2.792  -7.825
  421   2HB   TYR  54          HB1       TYR  54  -3.428   1.821  -6.836
  422    HD1  TYR  54           HD1      TYR  54  -1.109   2.041  -7.157
  423    HD2  TYR  54           HD2      TYR  54  -3.800   3.112 -10.283
  424    HE1  TYR  54           HE1      TYR  54   0.794   2.930  -8.483
  425    HE2  TYR  54           HE2      TYR  54  -1.941   4.018 -11.627
  426    HH   TYR  54           HH       TYR  54   1.410   3.953 -10.360
  427    H    GLY  55           HN       GLY  55  -5.155  -1.604  -8.423
  428   1HA   GLY  55          HA2       GLY  55  -6.606  -1.283  -5.864
  429   2HA   GLY  55          HA1       GLY  55  -7.560  -1.732  -7.282
  430    H    SER  56           HN       SER  56  -7.338  -3.865  -8.122
  431    HA   SER  56           HA       SER  56  -6.826  -5.905  -6.308
  432   1HB   SER  56          HB2       SER  56  -7.923  -6.459  -8.365
  433   2HB   SER  56          HB1       SER  56  -6.557  -5.901  -9.325
  434    HG   SER  56           HG       SER  56  -5.819  -7.768  -7.502
  435    H    SER  57           HN       SER  57  -4.449  -3.934  -7.892
  436    HA   SER  57           HA       SER  57  -2.284  -5.898  -7.315
  437   1HB   SER  57          HB2       SER  57  -2.264  -3.191  -8.681
  438   2HB   SER  57          HB1       SER  57  -0.790  -4.078  -8.272
  439    HG   SER  57           HG       SER  57  -2.935  -4.926  -9.941
  440    H    ILE  58           HN       ILE  58  -2.163  -2.381  -6.893
  441    HA   ILE  58           HA       ILE  58  -0.553  -1.959  -4.807
  442    HB   ILE  58           HB       ILE  58  -2.070  -0.262  -5.802
  443   1HG1  ILE  58          HG12      ILE  58  -1.895  -0.440  -2.788
  444   2HG1  ILE  58          HG11      ILE  58  -0.868   0.503  -3.872
  445   1HG2  ILE  58          HG21      ILE  58  -4.115  -1.083  -3.788
  446   2HG2  ILE  58          HG22      ILE  58  -4.115  -1.773  -5.418
  447   3HG2  ILE  58          HG23      ILE  58  -4.311  -0.042  -5.184
  448   1HD1  ILE  58          HD11      ILE  58  -3.747   1.003  -3.086
  449   2HD1  ILE  58          HD12      ILE  58  -3.053   1.740  -4.533
  450   3HD1  ILE  58          HD13      ILE  58  -2.368   2.101  -2.947
  451    H    LEU  59           HN       LEU  59  -3.850  -3.181  -4.348
  452    HA   LEU  59           HA       LEU  59  -3.468  -3.507  -1.488
  453   1HB   LEU  59          HB2       LEU  59  -5.554  -5.052  -3.040
  454   2HB   LEU  59          HB1       LEU  59  -5.632  -4.454  -1.384
  455    HG   LEU  59           HG       LEU  59  -5.537  -2.654  -3.787
  456   1HD1  LEU  59          HD11      LEU  59  -7.935  -3.609  -2.243
  457   2HD1  LEU  59          HD12      LEU  59  -7.530  -4.054  -3.905
  458   3HD1  LEU  59          HD13      LEU  59  -7.954  -2.385  -3.513
  459   1HD2  LEU  59          HD21      LEU  59  -6.399  -2.132  -0.935
  460   2HD2  LEU  59          HD22      LEU  59  -6.297  -0.938  -2.234
  461   3HD2  LEU  59          HD23      LEU  59  -4.832  -1.673  -1.603
  462    H    SER  60           HN       SER  60  -3.711  -5.875  -4.187
  463    HA   SER  60           HA       SER  60  -2.837  -8.048  -2.444
  464   1HB   SER  60          HB2       SER  60  -4.400  -8.185  -4.504
  465   2HB   SER  60          HB1       SER  60  -2.915  -8.190  -5.451
  466    HG   SER  60           HG       SER  60  -4.020 -10.134  -3.855
  467    H    ILE  61           HN       ILE  61  -1.120  -5.583  -3.784
  468    HA   ILE  61           HA       ILE  61   1.108  -7.057  -4.875
  469    HB   ILE  61           HB       ILE  61   0.263  -4.509  -5.127
  470   1HG1  ILE  61          HG12      ILE  61   1.931  -5.718  -6.522
  471   2HG1  ILE  61          HG11      ILE  61   2.262  -4.008  -6.324
  472   1HG2  ILE  61          HG21      ILE  61   1.877  -2.960  -4.130
  473   2HG2  ILE  61          HG22      ILE  61   2.538  -4.262  -3.159
  474   3HG2  ILE  61          HG23      ILE  61   0.862  -3.747  -2.937
  475   1HD1  ILE  61          HD11      ILE  61   3.505  -6.134  -4.579
  476   2HD1  ILE  61          HD12      ILE  61   3.961  -4.435  -4.705
  477   3HD1  ILE  61          HD13      ILE  61   4.258  -5.534  -6.056
  478    H    LEU  62           HN       LEU  62   1.087  -5.061  -1.888
  479    HA   LEU  62           HA       LEU  62   3.445  -5.986  -0.766
  480   1HB   LEU  62          HB2       LEU  62   0.916  -5.419   0.759
  481   2HB   LEU  62          HB1       LEU  62   2.559  -5.384   1.405
  482    HG   LEU  62           HG       LEU  62   1.547  -3.654  -0.853
  483   1HD1  LEU  62          HD11      LEU  62   1.701  -1.804   0.770
  484   2HD1  LEU  62          HD12      LEU  62   2.170  -2.953   2.024
  485   3HD1  LEU  62          HD13      LEU  62   0.557  -3.031   1.313
  486   1HD2  LEU  62          HD21      LEU  62   3.813  -3.761  -1.292
  487   2HD2  LEU  62          HD22      LEU  62   4.229  -4.032   0.402
  488   3HD2  LEU  62          HD23      LEU  62   3.786  -2.419  -0.148
  489    H    LEU  63           HN       LEU  63   0.716  -7.932  -1.353
  490    HA   LEU  63           HA       LEU  63   1.266  -9.844   0.769
  491   1HB   LEU  63          HB2       LEU  63  -0.558  -9.822  -1.629
  492   2HB   LEU  63          HB1       LEU  63  -0.488 -11.159  -0.479
  493    HG   LEU  63           HG       LEU  63  -0.920  -9.495   1.351
  494   1HD1  LEU  63          HD11      LEU  63  -0.410  -7.383   0.629
  495   2HD1  LEU  63          HD12      LEU  63  -2.152  -7.374   0.378
  496   3HD1  LEU  63          HD13      LEU  63  -1.067  -7.650  -0.986
  497   1HD2  LEU  63          HD21      LEU  63  -2.688 -10.942   0.336
  498   2HD2  LEU  63          HD22      LEU  63  -3.074  -9.628  -0.769
  499   3HD2  LEU  63          HD23      LEU  63  -3.321  -9.422   0.963
  500    H    GLU  64           HN       GLU  64   1.487 -10.036  -2.837
  501    HA   GLU  64           HA       GLU  64   3.498 -12.251  -2.442
  502   1HB   GLU  64          HB2       GLU  64   1.309 -12.053  -4.516
  503   2HB   GLU  64          HB1       GLU  64   2.517 -13.336  -4.421
  504   1HG   GLU  64          HG2       GLU  64   0.620 -12.664  -2.156
  505   2HG   GLU  64          HG1       GLU  64   0.293 -13.914  -3.357
  506    H    GLU  65           HN       GLU  65   2.227 -10.156  -5.066
  507    HA   GLU  65           HA       GLU  65   4.329 -10.383  -6.832
  508   1HB   GLU  65          HB2       GLU  65   3.126  -7.687  -6.255
  509   2HB   GLU  65          HB1       GLU  65   3.688  -8.314  -7.801
  510   1HG   GLU  65          HG2       GLU  65   1.265  -9.238  -6.235
  511   2HG   GLU  65          HG1       GLU  65   1.269  -8.402  -7.787
  512    H    VAL  66           HN       VAL  66   4.491  -9.085  -3.735
  513    HA   VAL  66           HA       VAL  66   7.351  -8.424  -4.138
  514    HB   VAL  66           HB       VAL  66   5.840  -6.394  -4.553
  515   1HG1  VAL  66          HG11      VAL  66   5.678  -6.274  -1.550
  516   2HG1  VAL  66          HG12      VAL  66   4.418  -7.019  -2.517
  517   3HG1  VAL  66          HG13      VAL  66   4.789  -5.318  -2.735
  518   1HG2  VAL  66          HG21      VAL  66   7.341  -4.977  -2.890
  519   2HG2  VAL  66          HG22      VAL  66   8.075  -5.804  -4.256
  520   3HG2  VAL  66          HG23      VAL  66   8.151  -6.516  -2.647
  521    H    SER  67           HN       SER  67   8.471  -9.281  -2.422
  522    HA   SER  67           HA       SER  67   7.047 -10.310  -0.112
  523   1HB   SER  67          HB2       SER  67   9.893 -10.223  -1.021
  524   2HB   SER  67          HB1       SER  67   9.627 -10.420   0.706
  525    HG   SER  67           HG       SER  67   9.275 -12.180  -1.326
  526    HA   PRO  68           HA       PRO  68   6.935  -6.661   2.340
  527   1HB   PRO  68          HB2       PRO  68   7.876  -7.712   4.826
  528   2HB   PRO  68          HB1       PRO  68   6.190  -7.561   4.293
  529   1HG   PRO  68          HG2       PRO  68   7.871  -9.989   4.433
  530   2HG   PRO  68          HG1       PRO  68   6.111  -9.858   4.286
  531   1HD   PRO  68          HD2       PRO  68   7.870 -10.624   2.219
  532   2HD   PRO  68          HD1       PRO  68   6.186 -10.102   2.007
  533    H    GLU  69           HN       GLU  69   9.927  -8.577   2.865
  534    HA   GLU  69           HA       GLU  69  11.502  -6.372   3.789
  535   1HB   GLU  69          HB2       GLU  69  13.443  -7.788   3.369
  536   2HB   GLU  69          HB1       GLU  69  12.156  -8.744   4.097
  537   1HG   GLU  69          HG2       GLU  69  11.491  -9.498   1.799
  538   2HG   GLU  69          HG1       GLU  69  12.902  -8.651   1.160
  539    H    LEU  70           HN       LEU  70  10.816  -7.529   0.497
  540    HA   LEU  70           HA       LEU  70  12.825  -5.965  -0.811
  541   1HB   LEU  70          HB2       LEU  70  11.767  -7.622  -2.140
  542   2HB   LEU  70          HB1       LEU  70  10.158  -7.081  -1.682
  543    HG   LEU  70           HG       LEU  70  10.444  -5.016  -2.991
  544   1HD1  LEU  70          HD11      LEU  70  12.812  -4.619  -2.728
  545   2HD1  LEU  70          HD12      LEU  70  12.513  -4.844  -4.447
  546   3HD1  LEU  70          HD13      LEU  70  13.214  -6.153  -3.493
  547   1HD2  LEU  70          HD21      LEU  70  10.226  -5.981  -5.125
  548   2HD2  LEU  70          HD22      LEU  70   9.813  -7.325  -4.060
  549   3HD2  LEU  70          HD23      LEU  70  11.413  -7.242  -4.792
  550    H    VAL  71           HN       VAL  71   9.428  -5.275   0.002
  551    HA   VAL  71           HA       VAL  71   9.059  -2.752  -1.061
  552    HB   VAL  71           HB       VAL  71   8.338  -3.202   1.838
  553   1HG1  VAL  71          HG11      VAL  71   6.673  -2.166  -0.468
  554   2HG1  VAL  71          HG12      VAL  71   7.712  -1.118   0.495
  555   3HG1  VAL  71          HG13      VAL  71   6.373  -1.971   1.259
  556   1HG2  VAL  71          HG21      VAL  71   7.936  -5.332   0.807
  557   2HG2  VAL  71          HG22      VAL  71   7.180  -4.586  -0.591
  558   3HG2  VAL  71          HG23      VAL  71   6.389  -4.528   0.986
  559    H    CYS  72           HN       CYS  72  10.609  -3.412   2.109
  560    HA   CYS  72           HA       CYS  72  11.391  -0.795   2.767
  561   1HB   CYS  72          HB2       CYS  72  12.856  -3.407   3.127
  562   2HB   CYS  72          HB1       CYS  72  13.493  -1.883   3.733
  563    H    SER  73           HN       SER  73  12.930  -3.047   0.485
  564    HA   SER  73           HA       SER  73  15.123  -1.309  -0.176
  565   1HB   SER  73          HB2       SER  73  14.194  -3.872  -0.998
  566   2HB   SER  73          HB1       SER  73  14.364  -2.910  -2.463
  567    HG   SER  73           HG       SER  73  16.448  -2.926  -2.197
  568    H    MET  74           HN       MET  74  12.075  -1.945  -2.023
  569    HA   MET  74           HA       MET  74  12.366   0.116  -3.920
  570   1HB   MET  74          HB2       MET  74   9.895  -0.966  -2.541
  571   2HB   MET  74          HB1       MET  74   9.793   0.267  -3.794
  572   1HG   MET  74          HG2       MET  74  11.206  -1.370  -5.233
  573   2HG   MET  74          HG1       MET  74  10.747  -2.586  -4.042
  574   1HE   MET  74          HE1       MET  74   8.605  -3.141  -3.324
  575   2HE   MET  74          HE2       MET  74   7.106  -3.106  -4.260
  576   3HE   MET  74          HE3       MET  74   7.565  -1.709  -3.281
  577    H    LEU  75           HN       LEU  75  11.023   0.305  -0.633
  578    HA   LEU  75           HA       LEU  75  10.390   3.097  -0.711
  579   1HB   LEU  75          HB2       LEU  75  11.136   1.379   1.679
  580   2HB   LEU  75          HB1       LEU  75  10.318   2.937   1.751
  581    HG   LEU  75           HG       LEU  75   9.148   0.676   0.127
  582   1HD1  LEU  75          HD11      LEU  75   7.690   0.367   2.312
  583   2HD1  LEU  75          HD12      LEU  75   9.123   1.006   3.118
  584   3HD1  LEU  75          HD13      LEU  75   9.233  -0.465   2.159
  585   1HD2  LEU  75          HD21      LEU  75   7.028   1.880   0.750
  586   2HD2  LEU  75          HD22      LEU  75   8.140   2.856  -0.207
  587   3HD2  LEU  75          HD23      LEU  75   8.012   3.115   1.533
  588    H    HIS  76           HN       HIS  76  13.298   1.671  -1.101
  589    HA   HIS  76           HA       HIS  76  15.530   2.284  -0.679
  590   1HB   HIS  76          HB2       HIS  76  15.994   4.569  -1.406
  591   2HB   HIS  76          HB1       HIS  76  14.760   3.848  -2.441
  592    HD1  HIS  76           HD1      HIS  76  15.247   6.466   0.204
  593    HD2  HIS  76           HD2      HIS  76  12.160   4.951  -2.147
  594    HE1  HIS  76           HE1      HIS  76  13.304   8.072   0.455
  595    H    LEU  77           HN       LEU  77  14.063   2.023   1.759
  596    HA   LEU  77           HA       LEU  77  14.787   4.346   3.431
  597   1HB   LEU  77          HB2       LEU  77  13.455   1.690   4.006
  598   2HB   LEU  77          HB1       LEU  77  13.941   2.775   5.298
  599    HG   LEU  77           HG       LEU  77  12.187   3.683   3.005
  600   1HD1  LEU  77          HD11      LEU  77  11.356   2.568   5.704
  601   2HD1  LEU  77          HD12      LEU  77  11.075   1.810   4.137
  602   3HD1  LEU  77          HD13      LEU  77  10.267   3.326   4.541
  603   1HD2  LEU  77          HD21      LEU  77  12.995   5.597   4.130
  604   2HD2  LEU  77          HD22      LEU  77  12.985   4.804   5.702
  605   3HD2  LEU  77          HD23      LEU  77  11.469   5.296   4.953
  606    H    CYS  78           HN       CYS  78  16.029   1.194   2.605
  607    HA   CYS  78           HA       CYS  78  18.128   1.409   4.728
  608   1HB   CYS  78          HB2       CYS  78  16.684  -0.758   4.137
  609   2HB   CYS  78          HB1       CYS  78  17.931  -0.975   2.909
  610    H    SER  79           HN       SER  79  17.697   2.484   1.675
  611    HA   SER  79           HA       SER  79  20.247   1.672   0.502
  612   1HB   SER  79          HB2       SER  79  19.652   3.089  -1.336
  613   2HB   SER  79          HB1       SER  79  18.160   2.318  -0.808
  614    HG   SER  79           HG       SER  79  18.713   4.625   0.541
  615    H    GLY  80           HN       GLY  80  21.396   2.409   2.576
  616   1HA   GLY  80          HA2       GLY  80  21.662   5.255   3.075
  617   2HA   GLY  80          HA1       GLY  80  22.708   3.993   3.729
  618    H    LEU  81           HN       LEU  81  23.464   2.847   1.236
  619    HA   LEU  81           HA       LEU  81  25.231   4.979   0.133
  620   1HB   LEU  81          HB2       LEU  81  26.524   2.844  -0.667
  621   2HB   LEU  81          HB1       LEU  81  26.656   3.333   1.019
  622    HG   LEU  81           HG       LEU  81  24.985   1.724   1.686
  623   1HD1  LEU  81          HD11      LEU  81  24.196   0.050  -0.132
  624   2HD1  LEU  81          HD12      LEU  81  24.676   1.283  -1.292
  625   3HD1  LEU  81          HD13      LEU  81  23.422   1.631  -0.103
  626   1HD2  LEU  81          HD21      LEU  81  26.182  -0.355   1.106
  627   2HD2  LEU  81          HD22      LEU  81  27.316   0.947   1.468
  628   3HD2  LEU  81          HD23      LEU  81  27.004   0.488  -0.207
  629    H    VAL  82           HN       VAL  82  25.938   3.940  -2.227
  630    HA   VAL  82           HA       VAL  82  23.421   4.013  -3.690
  631    HB   VAL  82           HB       VAL  82  25.038   3.564  -5.700
  632   1HG1  VAL  82          HG11      VAL  82  25.277   6.097  -4.049
  633   2HG1  VAL  82          HG12      VAL  82  23.973   5.734  -5.181
  634   3HG1  VAL  82          HG13      VAL  82  25.622   5.945  -5.773
  635   1HG2  VAL  82          HG21      VAL  82  27.361   4.071  -5.266
  636   2HG2  VAL  82          HG22      VAL  82  26.881   2.812  -4.129
  637   3HG2  VAL  82          HG23      VAL  82  27.013   4.486  -3.588
  638    HA   PRO  83           HA       PRO  83  22.709  -0.341  -3.316
  639   1HB   PRO  83          HB2       PRO  83  21.758  -0.324  -6.131
  640   2HB   PRO  83          HB1       PRO  83  20.909  -0.819  -4.655
  641   1HG   PRO  83          HG2       PRO  83  20.473   1.593  -6.012
  642   2HG   PRO  83          HG1       PRO  83  20.023   1.267  -4.333
  643   1HD   PRO  83          HD2       PRO  83  22.137   3.041  -5.328
  644   2HD   PRO  83          HD1       PRO  83  21.511   2.858  -3.668
  645    H    ARG  84           HN       ARG  84  24.529  -1.622  -3.395
  646    HA   ARG  84           HA       ARG  84  26.482  -1.399  -5.540
  647   1HB   ARG  84          HB2       ARG  84  26.228  -3.482  -3.346
  648   2HB   ARG  84          HB1       ARG  84  27.648  -3.220  -4.355
  649   1HG   ARG  84          HG2       ARG  84  26.504  -0.930  -2.755
  650   2HG   ARG  84          HG1       ARG  84  27.541  -2.118  -1.969
  651   1HD   ARG  84          HD2       ARG  84  28.274  -0.454  -4.399
  652   2HD   ARG  84          HD1       ARG  84  28.886  -0.228  -2.762
  653    HE   ARG  84           HE       ARG  84  29.533  -2.855  -3.343
  654   1HH1  ARG  84          HH21      ARG  84  29.990   0.218  -4.836
  655   2HH1  ARG  84          HH22      ARG  84  31.488  -0.221  -5.586
  656   1HH2  ARG  84          HH11      ARG  84  31.486  -3.447  -4.314
  657   2HH2  ARG  84          HH12      ARG  84  32.335  -2.295  -5.291
  Start of MODEL    8
    1   1H    SER   1           HT1      SER   1  23.547   4.592  11.360
    2   2H    SER   1           HT2      SER   1  23.475   2.951  10.926
    3   3H    SER   1           HT3      SER   1  22.147   3.691  11.683
    4    HA   SER   1           HA       SER   1  22.012   5.224   9.714
    5   1HB   SER   1          HB2       SER   1  23.841   3.085   8.582
    6   2HB   SER   1          HB1       SER   1  23.079   4.376   7.657
    7    HG   SER   1           HG       SER   1  24.302   5.440   9.768
    8    H    ASP   2           HN       ASP   2  22.425   1.680   9.354
    9    HA   ASP   2           HA       ASP   2  19.923   1.363   7.968
   10   1HB   ASP   2          HB2       ASP   2  21.657  -0.639   9.448
   11   2HB   ASP   2          HB1       ASP   2  20.274  -1.076   8.444
   12    H    VAL   3           HN       VAL   3  18.897   2.826   9.796
   13    HA   VAL   3           HA       VAL   3  18.036   1.242  12.142
   14    HB   VAL   3           HB       VAL   3  17.496   4.107  11.418
   15   1HG1  VAL   3          HG11      VAL   3  17.013   4.193  13.942
   16   2HG1  VAL   3          HG12      VAL   3  16.923   2.434  13.860
   17   3HG1  VAL   3          HG13      VAL   3  15.798   3.420  12.926
   18   1HG2  VAL   3          HG21      VAL   3  19.505   2.876  13.321
   19   2HG2  VAL   3          HG22      VAL   3  19.210   4.605  13.137
   20   3HG2  VAL   3          HG23      VAL   3  19.886   3.679  11.797
   21    H    TYR   4           HN       TYR   4  16.577   3.065   9.441
   22    HA   TYR   4           HA       TYR   4  13.899   2.125  10.095
   23   1HB   TYR   4          HB2       TYR   4  15.145   3.765   7.909
   24   2HB   TYR   4          HB1       TYR   4  13.557   3.065   7.608
   25    HD1  TYR   4           HD1      TYR   4  12.244   5.061   7.615
   26    HD2  TYR   4           HD2      TYR   4  14.820   4.174  10.941
   27    HE1  TYR   4           HE1      TYR   4  11.182   6.876   8.929
   28    HE2  TYR   4           HE2      TYR   4  13.760   5.985  12.247
   29    HH   TYR   4           HH       TYR   4  12.507   8.091  11.793
   30    H    CYS   5           HN       CYS   5  16.335   1.260   7.623
   31    HA   CYS   5           HA       CYS   5  14.862  -0.559   6.104
   32   1HB   CYS   5          HB2       CYS   5  17.740  -0.455   6.945
   33   2HB   CYS   5          HB1       CYS   5  17.162  -1.897   6.112
   34    H    GLU   6           HN       GLU   6  16.219  -1.012   9.342
   35    HA   GLU   6           HA       GLU   6  15.428  -3.833   9.447
   36   1HB   GLU   6          HB2       GLU   6  16.355  -1.941  11.632
   37   2HB   GLU   6          HB1       GLU   6  16.151  -3.685  11.812
   38   1HG   GLU   6          HG2       GLU   6  17.819  -4.050  10.012
   39   2HG   GLU   6          HG1       GLU   6  18.053  -2.304   9.895
   40    H    VAL   7           HN       VAL   7  14.433  -0.924  11.295
   41    HA   VAL   7           HA       VAL   7  12.215  -2.000  12.608
   42    HB   VAL   7           HB       VAL   7  12.468   0.764  11.379
   43   1HG1  VAL   7          HG11      VAL   7  10.861   1.347  13.258
   44   2HG1  VAL   7          HG12      VAL   7  10.606  -0.384  13.475
   45   3HG1  VAL   7          HG13      VAL   7  10.165   0.389  11.952
   46   1HG2  VAL   7          HG21      VAL   7  12.971  -0.050  14.250
   47   2HG2  VAL   7          HG22      VAL   7  13.447   1.443  13.437
   48   3HG2  VAL   7          HG23      VAL   7  14.255  -0.073  13.042
   49    H    CYS   8           HN       CYS   8  12.230  -0.444   9.387
   50    HA   CYS   8           HA       CYS   8   9.514  -0.811   8.748
   51   1HB   CYS   8          HB2       CYS   8  10.159  -0.543   6.448
   52   2HB   CYS   8          HB1       CYS   8  11.260   0.449   7.403
   53    H    GLU   9           HN       GLU   9  12.234  -3.045   8.223
   54    HA   GLU   9           HA       GLU   9  10.789  -5.092   6.873
   55   1HB   GLU   9          HB2       GLU   9  13.248  -5.291   7.121
   56   2HB   GLU   9          HB1       GLU   9  13.057  -5.548   8.864
   57   1HG   GLU   9          HG2       GLU   9  11.917  -7.614   8.525
   58   2HG   GLU   9          HG1       GLU   9  11.715  -7.302   6.801
   59    H    PHE  10           HN       PHE  10  10.904  -4.315  10.304
   60    HA   PHE  10           HA       PHE  10   9.437  -6.738  11.062
   61   1HB   PHE  10          HB2       PHE  10  11.015  -5.752  12.643
   62   2HB   PHE  10          HB1       PHE  10  10.128  -4.228  12.617
   63    HD1  PHE  10           HD1      PHE  10   8.289  -3.881  14.066
   64    HD2  PHE  10           HD2      PHE  10   9.768  -7.861  13.414
   65    HE1  PHE  10           HE1      PHE  10   6.792  -4.731  15.852
   66    HE2  PHE  10           HE2      PHE  10   8.271  -8.710  15.200
   67    HZ   PHE  10           HZ       PHE  10   6.783  -7.145  16.419
   68    H    LEU  11           HN       LEU  11   8.620  -3.551   9.978
   69    HA   LEU  11           HA       LEU  11   5.894  -3.683  11.132
   70   1HB   LEU  11          HB2       LEU  11   7.198  -1.630   9.320
   71   2HB   LEU  11          HB1       LEU  11   5.601  -1.474  10.049
   72    HG   LEU  11           HG       LEU  11   8.180  -1.814  11.611
   73   1HD1  LEU  11          HD11      LEU  11   7.762   0.600  12.220
   74   2HD1  LEU  11          HD12      LEU  11   6.519   0.639  10.969
   75   3HD1  LEU  11          HD13      LEU  11   8.202   0.346  10.530
   76   1HD2  LEU  11          HD21      LEU  11   6.498  -0.855  13.429
   77   2HD2  LEU  11          HD22      LEU  11   6.511  -2.575  13.062
   78   3HD2  LEU  11          HD23      LEU  11   5.272  -1.535  12.359
   79    H    VAL  12           HN       VAL  12   7.406  -3.696   7.885
   80    HA   VAL  12           HA       VAL  12   4.851  -4.045   6.568
   81    HB   VAL  12           HB       VAL  12   6.157  -4.389   4.547
   82   1HG1  VAL  12          HG11      VAL  12   7.393  -2.272   4.556
   83   2HG1  VAL  12          HG12      VAL  12   7.404  -2.269   6.320
   84   3HG1  VAL  12          HG13      VAL  12   5.882  -2.092   5.448
   85   1HG2  VAL  12          HG21      VAL  12   8.366  -4.887   6.524
   86   2HG2  VAL  12          HG22      VAL  12   8.774  -4.185   4.959
   87   3HG2  VAL  12          HG23      VAL  12   7.976  -5.748   5.038
   88    H    LYS  13           HN       LYS  13   7.230  -6.222   7.920
   89    HA   LYS  13           HA       LYS  13   6.113  -8.609   6.605
   90   1HB   LYS  13          HB2       LYS  13   8.496  -8.457   7.159
   91   2HB   LYS  13          HB1       LYS  13   8.092  -8.321   8.867
   92   1HG   LYS  13          HG2       LYS  13   6.729 -10.657   7.931
   93   2HG   LYS  13          HG1       LYS  13   8.338 -10.731   7.228
   94   1HD   LYS  13          HD2       LYS  13   8.575 -11.821   9.306
   95   2HD   LYS  13          HD1       LYS  13   9.202 -10.202   9.609
   96   1HE   LYS  13          HE2       LYS  13   7.077  -9.522  10.601
   97   2HE   LYS  13          HE1       LYS  13   6.360 -11.084  10.202
   98   1HZ   LYS  13          HZ1       LYS  13   7.011 -11.220  12.439
   99   2HZ   LYS  13          HZ2       LYS  13   8.526 -10.511  12.138
  100   3HZ   LYS  13          HZ3       LYS  13   8.195 -12.081  11.581
  101    H    GLU  14           HN       GLU  14   5.984  -7.088   9.832
  102    HA   GLU  14           HA       GLU  14   4.415  -9.209  11.019
  103   1HB   GLU  14          HB2       GLU  14   5.708  -7.444  12.299
  104   2HB   GLU  14          HB1       GLU  14   4.457  -6.289  11.838
  105   1HG   GLU  14          HG2       GLU  14   3.868  -7.125  14.016
  106   2HG   GLU  14          HG1       GLU  14   2.762  -7.871  12.862
  107    H    VAL  15           HN       VAL  15   3.495  -5.946   9.903
  108    HA   VAL  15           HA       VAL  15   0.722  -6.148  10.110
  109    HB   VAL  15           HB       VAL  15   2.089  -4.147   9.306
  110   1HG1  VAL  15          HG11      VAL  15   1.707  -5.438   6.594
  111   2HG1  VAL  15          HG12      VAL  15   3.229  -5.475   7.481
  112   3HG1  VAL  15          HG13      VAL  15   2.550  -3.935   6.961
  113   1HG2  VAL  15          HG21      VAL  15  -0.484  -5.037   8.005
  114   2HG2  VAL  15          HG22      VAL  15   0.207  -3.446   7.684
  115   3HG2  VAL  15          HG23      VAL  15  -0.260  -3.890   9.324
  116    H    THR  16           HN       THR  16   2.821  -7.403   7.530
  117    HA   THR  16           HA       THR  16   0.836  -8.372   5.794
  118    HB   THR  16           HB       THR  16   2.903 -10.351   5.907
  119    HG1  THR  16           HG1      THR  16   4.163  -7.921   5.830
  120   1HG2  THR  16          HG21      THR  16   2.480  -7.878   4.216
  121   2HG2  THR  16          HG22      THR  16   1.984  -9.534   3.834
  122   3HG2  THR  16          HG23      THR  16   3.704  -9.105   3.870
  123    H    LYS  17           HN       LYS  17   2.255  -9.943   8.673
  124    HA   LYS  17           HA       LYS  17   0.947 -12.403   8.576
  125   1HB   LYS  17          HB2       LYS  17   1.569 -10.640  10.962
  126   2HB   LYS  17          HB1       LYS  17   0.933 -12.271  11.129
  127   1HG   LYS  17          HG2       LYS  17   3.354 -11.836   9.391
  128   2HG   LYS  17          HG1       LYS  17   3.555 -11.846  11.141
  129   1HD   LYS  17          HD2       LYS  17   2.549 -14.070  11.286
  130   2HD   LYS  17          HD1       LYS  17   2.229 -14.067   9.553
  131   1HE   LYS  17          HE2       LYS  17   5.008 -13.762  10.706
  132   2HE   LYS  17          HE1       LYS  17   4.321 -15.322  10.258
  133   1HZ   LYS  17          HZ1       LYS  17   4.000 -14.509   8.014
  134   2HZ   LYS  17          HZ2       LYS  17   5.633 -14.368   8.462
  135   3HZ   LYS  17          HZ3       LYS  17   4.633 -12.994   8.441
  136    H    LEU  18           HN       LEU  18  -0.368  -9.287   9.701
  137    HA   LEU  18           HA       LEU  18  -2.996 -10.548  10.214
  138   1HB   LEU  18          HB2       LEU  18  -3.343  -8.755  11.578
  139   2HB   LEU  18          HB1       LEU  18  -1.647  -8.378  11.309
  140    HG   LEU  18           HG       LEU  18  -2.393  -7.018   9.284
  141   1HD1  LEU  18          HD11      LEU  18  -4.573  -7.012   8.675
  142   2HD1  LEU  18          HD12      LEU  18  -5.076  -6.498  10.283
  143   3HD1  LEU  18          HD13      LEU  18  -4.911  -8.216   9.916
  144   1HD2  LEU  18          HD21      LEU  18  -3.405  -6.185  12.020
  145   2HD2  LEU  18          HD22      LEU  18  -3.018  -5.098  10.687
  146   3HD2  LEU  18          HD23      LEU  18  -1.739  -6.037  11.457
  147    H    ILE  19           HN       ILE  19  -1.541  -8.332   7.871
  148    HA   ILE  19           HA       ILE  19  -3.952  -7.887   6.351
  149    HB   ILE  19           HB       ILE  19  -1.060  -7.331   6.196
  150   1HG1  ILE  19          HG12      ILE  19  -3.350  -5.672   5.162
  151   2HG1  ILE  19          HG11      ILE  19  -2.867  -5.699   6.858
  152   1HG2  ILE  19          HG21      ILE  19  -1.151  -6.668   3.777
  153   2HG2  ILE  19          HG22      ILE  19  -2.642  -7.596   3.649
  154   3HG2  ILE  19          HG23      ILE  19  -1.129  -8.403   4.069
  155   1HD1  ILE  19          HD11      ILE  19  -1.520  -3.962   6.202
  156   2HD1  ILE  19          HD12      ILE  19  -1.502  -4.476   4.519
  157   3HD1  ILE  19          HD13      ILE  19  -0.434  -5.258   5.687
  158    H    ASP  20           HN       ASP  20  -1.841 -10.531   6.717
  159    HA   ASP  20           HA       ASP  20  -1.505 -11.793   4.332
  160   1HB   ASP  20          HB2       ASP  20  -0.981 -12.769   6.577
  161   2HB   ASP  20          HB1       ASP  20  -2.685 -13.189   6.753
  162    H    ASN  21           HN       ASN  21  -4.638 -11.671   6.082
  163    HA   ASN  21           HA       ASN  21  -6.040 -11.988   3.535
  164   1HB   ASN  21          HB2       ASN  21  -6.269 -14.096   5.692
  165   2HB   ASN  21          HB1       ASN  21  -7.356 -13.961   4.306
  166   1HD2  ASN  21          HD21      ASN  21  -3.956 -14.606   5.208
  167   2HD2  ASN  21          HD22      ASN  21  -3.548 -15.378   3.752
  168    H    ASN  22           HN       ASN  22  -5.803 -10.256   6.064
  169    HA   ASN  22           HA       ASN  22  -8.655 -10.236   6.915
  170   1HB   ASN  22          HB2       ASN  22  -6.327  -8.537   7.872
  171   2HB   ASN  22          HB1       ASN  22  -7.908  -8.693   8.641
  172   1HD2  ASN  22          HD21      ASN  22  -5.870 -11.331   7.239
  173   2HD2  ASN  22          HD22      ASN  22  -5.714 -12.175   8.702
  174    H    LYS  23           HN       LYS  23  -6.172  -8.227   5.407
  175    HA   LYS  23           HA       LYS  23  -8.049  -6.105   4.732
  176   1HB   LYS  23          HB2       LYS  23  -5.678  -5.696   5.346
  177   2HB   LYS  23          HB1       LYS  23  -5.165  -6.623   3.940
  178   1HG   LYS  23          HG2       LYS  23  -7.096  -4.407   3.432
  179   2HG   LYS  23          HG1       LYS  23  -5.476  -3.930   3.913
  180   1HD   LYS  23          HD2       LYS  23  -4.577  -5.423   2.072
  181   2HD   LYS  23          HD1       LYS  23  -6.239  -5.644   1.531
  182   1HE   LYS  23          HE2       LYS  23  -6.453  -3.425   0.857
  183   2HE   LYS  23          HE1       LYS  23  -5.149  -2.864   1.900
  184   1HZ   LYS  23          HZ1       LYS  23  -5.039  -3.911  -0.766
  185   2HZ   LYS  23          HZ2       LYS  23  -3.937  -4.666   0.284
  186   3HZ   LYS  23          HZ3       LYS  23  -3.901  -2.980   0.081
  187    H    THR  24           HN       THR  24  -9.517  -6.783   3.177
  188    HA   THR  24           HA       THR  24  -8.521  -8.377   0.854
  189    HB   THR  24           HB       THR  24 -10.876  -8.864   0.428
  190    HG1  THR  24           HG1      THR  24 -12.080  -7.231   1.052
  191   1HG2  THR  24          HG21      THR  24  -9.620 -10.215   2.083
  192   2HG2  THR  24          HG22      THR  24 -11.340 -10.130   2.465
  193   3HG2  THR  24          HG23      THR  24 -10.187  -9.141   3.361
  194    H    GLU  25           HN       GLU  25 -10.234  -7.756  -1.099
  195    HA   GLU  25           HA       GLU  25  -9.591  -4.893  -1.697
  196   1HB   GLU  25          HB2       GLU  25 -10.524  -6.978  -3.678
  197   2HB   GLU  25          HB1       GLU  25  -9.651  -5.479  -3.997
  198   1HG   GLU  25          HG2       GLU  25  -7.751  -6.461  -2.588
  199   2HG   GLU  25          HG1       GLU  25  -8.604  -8.000  -2.696
  200    H    LYS  26           HN       LYS  26 -12.190  -6.782  -0.710
  201    HA   LYS  26           HA       LYS  26 -14.242  -5.403  -2.296
  202   1HB   LYS  26          HB2       LYS  26 -14.363  -7.297   0.071
  203   2HB   LYS  26          HB1       LYS  26 -15.797  -6.599  -0.678
  204   1HG   LYS  26          HG2       LYS  26 -15.520  -7.789  -2.667
  205   2HG   LYS  26          HG1       LYS  26 -13.784  -7.989  -2.436
  206   1HD   LYS  26          HD2       LYS  26 -15.689  -9.296  -0.497
  207   2HD   LYS  26          HD1       LYS  26 -15.402 -10.043  -2.067
  208   1HE   LYS  26          HE2       LYS  26 -13.074  -9.192  -0.349
  209   2HE   LYS  26          HE1       LYS  26 -13.880 -10.736  -0.068
  210   1HZ   LYS  26          HZ1       LYS  26 -12.931 -11.607  -1.859
  211   2HZ   LYS  26          HZ2       LYS  26 -11.932 -10.235  -1.918
  212   3HZ   LYS  26          HZ3       LYS  26 -13.360 -10.289  -2.836
  213    H    GLU  27           HN       GLU  27 -12.868  -5.310   0.943
  214    HA   GLU  27           HA       GLU  27 -14.667  -3.280   1.922
  215   1HB   GLU  27          HB2       GLU  27 -13.627  -4.604   3.587
  216   2HB   GLU  27          HB1       GLU  27 -12.034  -4.421   2.858
  217   1HG   GLU  27          HG2       GLU  27 -11.795  -2.208   3.635
  218   2HG   GLU  27          HG1       GLU  27 -13.525  -2.026   3.928
  219    H    ILE  28           HN       ILE  28 -11.843  -3.274  -0.068
  220    HA   ILE  28           HA       ILE  28 -11.167  -0.480   0.461
  221    HB   ILE  28           HB       ILE  28 -10.186  -2.356  -1.702
  222   1HG1  ILE  28          HG12      ILE  28  -9.881  -3.134   0.746
  223   2HG1  ILE  28          HG11      ILE  28  -8.452  -3.078  -0.275
  224   1HG2  ILE  28          HG21      ILE  28  -8.124  -0.745  -1.350
  225   2HG2  ILE  28          HG22      ILE  28  -9.348   0.355  -0.721
  226   3HG2  ILE  28          HG23      ILE  28  -9.474  -0.258  -2.370
  227   1HD1  ILE  28          HD11      ILE  28  -7.707  -1.040   0.713
  228   2HD1  ILE  28          HD12      ILE  28  -8.191  -2.082   2.050
  229   3HD1  ILE  28          HD13      ILE  28  -9.248  -0.787   1.521
  230    H    LEU  29           HN       LEU  29 -11.690  -2.084  -2.673
  231    HA   LEU  29           HA       LEU  29 -12.321   0.167  -4.138
  232   1HB   LEU  29          HB2       LEU  29 -13.686  -2.525  -4.418
  233   2HB   LEU  29          HB1       LEU  29 -13.576  -1.292  -5.671
  234    HG   LEU  29           HG       LEU  29 -11.120  -2.475  -4.353
  235   1HD1  LEU  29          HD11      LEU  29 -10.993  -3.857  -6.502
  236   2HD1  LEU  29          HD12      LEU  29 -12.694  -3.458  -6.737
  237   3HD1  LEU  29          HD13      LEU  29 -12.190  -4.369  -5.313
  238   1HD2  LEU  29          HD21      LEU  29 -11.655  -0.860  -6.864
  239   2HD2  LEU  29          HD22      LEU  29 -10.161  -1.766  -6.641
  240   3HD2  LEU  29          HD23      LEU  29 -10.576  -0.471  -5.524
  241    H    ASP  30           HN       ASP  30 -14.326  -1.489  -1.820
  242    HA   ASP  30           HA       ASP  30 -16.808  -0.145  -2.536
  243   1HB   ASP  30          HB2       ASP  30 -15.873  -1.554  -0.016
  244   2HB   ASP  30          HB1       ASP  30 -17.474  -0.833  -0.169
  245    H    ALA  31           HN       ALA  31 -14.262   0.290  -0.128
  246    HA   ALA  31           HA       ALA  31 -15.372   2.630   1.051
  247   1HB   ALA  31          HB1       ALA  31 -12.537   1.616   0.899
  248   2HB   ALA  31          HB2       ALA  31 -13.675   1.451   2.240
  249   3HB   ALA  31          HB3       ALA  31 -13.022   3.035   1.830
  250    H    PHE  32           HN       PHE  32 -13.224   2.157  -1.752
  251    HA   PHE  32           HA       PHE  32 -12.490   4.877  -2.085
  252   1HB   PHE  32          HB2       PHE  32 -12.710   2.514  -3.899
  253   2HB   PHE  32          HB1       PHE  32 -12.668   4.089  -4.683
  254    HD1  PHE  32           HD1      PHE  32 -10.722   5.587  -4.418
  255    HD2  PHE  32           HD2      PHE  32 -10.772   1.647  -2.710
  256    HE1  PHE  32           HE1      PHE  32  -8.269   5.698  -4.090
  257    HE2  PHE  32           HE2      PHE  32  -8.316   1.760  -2.385
  258    HZ   PHE  32           HZ       PHE  32  -7.067   3.784  -3.072
  259    H    ASP  33           HN       ASP  33 -15.460   3.171  -3.044
  260    HA   ASP  33           HA       ASP  33 -16.554   5.555  -4.352
  261   1HB   ASP  33          HB2       ASP  33 -17.223   3.232  -4.996
  262   2HB   ASP  33          HB1       ASP  33 -17.990   3.050  -3.417
  263    H    LYS  34           HN       LYS  34 -16.149   4.538  -1.166
  264    HA   LYS  34           HA       LYS  34 -18.415   6.200  -0.136
  265   1HB   LYS  34          HB2       LYS  34 -18.720   4.405   1.232
  266   2HB   LYS  34          HB1       LYS  34 -17.334   3.622   0.487
  267   1HG   LYS  34          HG2       LYS  34 -15.845   4.791   2.073
  268   2HG   LYS  34          HG1       LYS  34 -17.257   5.503   2.844
  269   1HD   LYS  34          HD2       LYS  34 -17.786   3.559   3.952
  270   2HD   LYS  34          HD1       LYS  34 -17.485   2.565   2.535
  271   1HE   LYS  34          HE2       LYS  34 -15.739   1.777   3.789
  272   2HE   LYS  34          HE1       LYS  34 -14.907   3.223   3.237
  273   1HZ   LYS  34          HZ1       LYS  34 -15.141   2.658   5.771
  274   2HZ   LYS  34          HZ2       LYS  34 -16.632   3.453   5.586
  275   3HZ   LYS  34          HZ3       LYS  34 -15.183   4.262   5.222
  276    H    MET  35           HN       MET  35 -15.085   6.066  -0.551
  277    HA   MET  35           HA       MET  35 -14.458   8.059   1.569
  278   1HB   MET  35          HB2       MET  35 -12.961   6.206   1.539
  279   2HB   MET  35          HB1       MET  35 -12.871   6.237  -0.216
  280   1HG   MET  35          HG2       MET  35 -11.562   8.270  -0.189
  281   2HG   MET  35          HG1       MET  35 -11.824   8.469   1.545
  282   1HE   MET  35          HE1       MET  35  -9.416   5.224  -0.594
  283   2HE   MET  35          HE2       MET  35 -10.776   6.175  -1.188
  284   3HE   MET  35          HE3       MET  35 -11.066   4.811  -0.102
  285    H    CYS  36           HN       CYS  36 -13.596   7.510  -1.857
  286    HA   CYS  36           HA       CYS  36 -12.949  10.281  -2.327
  287   1HB   CYS  36          HB2       CYS  36 -12.290   8.108  -3.663
  288   2HB   CYS  36          HB1       CYS  36 -13.800   8.409  -4.531
  289    H    SER  37           HN       SER  37 -15.807   8.948  -1.543
  290    HA   SER  37           HA       SER  37 -17.665   9.994  -3.448
  291   1HB   SER  37          HB2       SER  37 -18.129   8.334  -1.558
  292   2HB   SER  37          HB1       SER  37 -18.164   9.722  -0.478
  293    HG   SER  37           HG       SER  37 -20.014   8.848  -2.281
  294    H    LYS  38           HN       LYS  38 -16.144  11.359  -0.562
  295    HA   LYS  38           HA       LYS  38 -17.645  13.858  -0.722
  296   1HB   LYS  38          HB2       LYS  38 -16.207  14.572   1.125
  297   2HB   LYS  38          HB1       LYS  38 -16.794  12.936   1.427
  298   1HG   LYS  38          HG2       LYS  38 -14.541  12.252   0.172
  299   2HG   LYS  38          HG1       LYS  38 -14.027  13.855   0.690
  300   1HD   LYS  38          HD2       LYS  38 -14.840  13.168   3.037
  301   2HD   LYS  38          HD1       LYS  38 -14.887  11.520   2.406
  302   1HE   LYS  38          HE2       LYS  38 -12.485  11.801   1.702
  303   2HE   LYS  38          HE1       LYS  38 -12.474  13.348   2.549
  304   1HZ   LYS  38          HZ1       LYS  38 -11.834  12.084   4.271
  305   2HZ   LYS  38          HZ2       LYS  38 -12.470  10.653   3.614
  306   3HZ   LYS  38          HZ3       LYS  38 -13.489  11.746   4.421
  307    H    LEU  39           HN       LEU  39 -14.762  12.585  -2.143
  308    HA   LEU  39           HA       LEU  39 -13.272  14.942  -2.541
  309   1HB   LEU  39          HB2       LEU  39 -13.233  12.248  -3.576
  310   2HB   LEU  39          HB1       LEU  39 -13.162  13.313  -4.955
  311    HG   LEU  39           HG       LEU  39 -11.282  14.452  -3.211
  312   1HD1  LEU  39          HD11      LEU  39 -10.687  11.512  -3.182
  313   2HD1  LEU  39          HD12      LEU  39 -11.637  12.240  -1.885
  314   3HD1  LEU  39          HD13      LEU  39  -9.995  12.801  -2.198
  315   1HD2  LEU  39          HD21      LEU  39  -9.636  13.625  -4.803
  316   2HD2  LEU  39          HD22      LEU  39 -11.101  14.079  -5.674
  317   3HD2  LEU  39          HD23      LEU  39 -10.756  12.381  -5.355
  318    HA   PRO  40           HA       PRO  40 -15.891  17.407  -5.185
  319   1HB   PRO  40          HB2       PRO  40 -13.651  18.019  -7.001
  320   2HB   PRO  40          HB1       PRO  40 -14.541  19.114  -5.932
  321   1HG   PRO  40          HG2       PRO  40 -11.897  18.126  -5.524
  322   2HG   PRO  40          HG1       PRO  40 -12.873  19.033  -4.359
  323   1HD   PRO  40          HD2       PRO  40 -12.152  16.229  -4.265
  324   2HD   PRO  40          HD1       PRO  40 -13.084  17.153  -3.073
  325    H    LYS  41           HN       LYS  41 -16.653  17.320  -7.528
  326    HA   LYS  41           HA       LYS  41 -16.851  14.639  -8.431
  327   1HB   LYS  41          HB2       LYS  41 -18.468  16.450  -8.966
  328   2HB   LYS  41          HB1       LYS  41 -17.269  17.139 -10.062
  329   1HG   LYS  41          HG2       LYS  41 -17.266  15.176 -11.430
  330   2HG   LYS  41          HG1       LYS  41 -18.256  14.292 -10.268
  331   1HD   LYS  41          HD2       LYS  41 -20.212  15.389 -10.871
  332   2HD   LYS  41          HD1       LYS  41 -19.372  16.872 -11.325
  333   1HE   LYS  41          HE2       LYS  41 -18.588  15.878 -13.377
  334   2HE   LYS  41          HE1       LYS  41 -19.213  14.298 -12.911
  335   1HZ   LYS  41          HZ1       LYS  41 -21.455  15.350 -12.835
  336   2HZ   LYS  41          HZ2       LYS  41 -20.769  15.275 -14.388
  337   3HZ   LYS  41          HZ3       LYS  41 -20.777  16.741 -13.528
  338    H    SER  42           HN       SER  42 -14.981  17.331  -9.759
  339    HA   SER  42           HA       SER  42 -13.802  16.056 -11.957
  340   1HB   SER  42          HB2       SER  42 -12.429  18.015 -10.108
  341   2HB   SER  42          HB1       SER  42 -12.046  17.725 -11.803
  342    HG   SER  42           HG       SER  42 -14.594  18.574 -10.887
  343    H    LEU  43           HN       LEU  43 -12.150  16.531  -8.835
  344    HA   LEU  43           HA       LEU  43 -10.114  14.601  -9.492
  345   1HB   LEU  43          HB2       LEU  43 -10.867  16.002  -6.924
  346   2HB   LEU  43          HB1       LEU  43  -9.473  14.928  -7.057
  347    HG   LEU  43           HG       LEU  43  -9.817  17.198  -9.016
  348   1HD1  LEU  43          HD11      LEU  43  -8.726  17.368  -6.198
  349   2HD1  LEU  43          HD12      LEU  43 -10.004  18.347  -6.920
  350   3HD1  LEU  43          HD13      LEU  43  -8.334  18.544  -7.453
  351   1HD2  LEU  43          HD21      LEU  43  -8.042  15.616  -9.516
  352   2HD2  LEU  43          HD22      LEU  43  -7.442  15.695  -7.860
  353   3HD2  LEU  43          HD23      LEU  43  -7.295  17.095  -8.918
  354    H    SER  44           HN       SER  44 -13.284  14.038  -8.741
  355    HA   SER  44           HA       SER  44 -12.793  11.712  -6.988
  356   1HB   SER  44          HB2       SER  44 -14.847  12.679  -6.407
  357   2HB   SER  44          HB1       SER  44 -15.233  13.064  -8.081
  358    HG   SER  44           HG       SER  44 -15.521  10.689  -6.663
  359    H    GLU  45           HN       GLU  45 -13.328  12.607 -10.283
  360    HA   GLU  45           HA       GLU  45 -13.818   9.884 -11.186
  361   1HB   GLU  45          HB2       GLU  45 -13.239  12.454 -12.681
  362   2HB   GLU  45          HB1       GLU  45 -13.593  10.916 -13.470
  363   1HG   GLU  45          HG2       GLU  45 -15.777  10.822 -12.344
  364   2HG   GLU  45          HG1       GLU  45 -15.425  12.338 -11.513
  365    H    GLU  46           HN       GLU  46 -11.141  12.095 -10.820
  366    HA   GLU  46           HA       GLU  46  -9.276  10.435 -12.341
  367   1HB   GLU  46          HB2       GLU  46  -8.737  12.745 -10.453
  368   2HB   GLU  46          HB1       GLU  46  -7.585  12.043 -11.589
  369   1HG   GLU  46          HG2       GLU  46 -10.230  13.276 -12.408
  370   2HG   GLU  46          HG1       GLU  46  -8.688  14.134 -12.444
  371    H    CYS  47           HN       CYS  47 -10.411  10.616  -9.057
  372    HA   CYS  47           HA       CYS  47  -8.089   9.257  -7.916
  373   1HB   CYS  47          HB2       CYS  47  -9.234   9.335  -5.855
  374   2HB   CYS  47          HB1       CYS  47  -9.735  10.804  -6.683
  375    H    GLN  48           HN       GLN  48 -11.286   8.345  -9.105
  376    HA   GLN  48           HA       GLN  48 -10.947   5.545  -8.306
  377   1HB   GLN  48          HB2       GLN  48 -13.039   7.117  -9.817
  378   2HB   GLN  48          HB1       GLN  48 -13.064   5.353  -9.834
  379   1HG   GLN  48          HG2       GLN  48 -12.893   6.889  -7.234
  380   2HG   GLN  48          HG1       GLN  48 -14.447   6.559  -8.001
  381   1HE2  GLN  48          HE21      GLN  48 -14.945   5.136  -6.104
  382   2HE2  GLN  48          HE22      GLN  48 -14.285   3.573  -6.036
  383    H    GLU  49           HN       GLU  49 -10.050   7.637 -10.821
  384    HA   GLU  49           HA       GLU  49  -9.992   5.749 -12.973
  385   1HB   GLU  49          HB2       GLU  49  -9.908   8.155 -13.419
  386   2HB   GLU  49          HB1       GLU  49  -8.391   8.282 -12.526
  387   1HG   GLU  49          HG2       GLU  49  -7.227   6.950 -14.141
  388   2HG   GLU  49          HG1       GLU  49  -8.731   6.495 -14.940
  389    H    VAL  50           HN       VAL  50  -7.490   6.980 -10.737
  390    HA   VAL  50           HA       VAL  50  -5.419   5.254 -11.701
  391    HB   VAL  50           HB       VAL  50  -5.691   6.352  -8.892
  392   1HG1  VAL  50          HG11      VAL  50  -3.409   5.300 -10.588
  393   2HG1  VAL  50          HG12      VAL  50  -3.960   4.714  -9.016
  394   3HG1  VAL  50          HG13      VAL  50  -3.145   6.271  -9.136
  395   1HG2  VAL  50          HG21      VAL  50  -4.716   7.586 -11.478
  396   2HG2  VAL  50          HG22      VAL  50  -4.153   8.162  -9.908
  397   3HG2  VAL  50          HG23      VAL  50  -5.866   8.249 -10.315
  398    H    VAL  51           HN       VAL  51  -7.824   4.875  -9.080
  399    HA   VAL  51           HA       VAL  51  -6.960   2.491  -7.875
  400    HB   VAL  51           HB       VAL  51  -9.770   3.325  -8.702
  401   1HG1  VAL  51          HG11      VAL  51 -10.489   1.717  -6.895
  402   2HG1  VAL  51          HG12      VAL  51  -8.844   1.089  -6.885
  403   3HG1  VAL  51          HG13      VAL  51  -9.835   0.942  -8.337
  404   1HG2  VAL  51          HG21      VAL  51  -8.353   4.722  -7.055
  405   2HG2  VAL  51          HG22      VAL  51  -8.540   3.367  -5.942
  406   3HG2  VAL  51          HG23      VAL  51  -9.962   4.235  -6.524
  407    H    ASP  52           HN       ASP  52  -8.951   2.737 -10.854
  408    HA   ASP  52           HA       ASP  52  -8.982  -0.017 -11.491
  409   1HB   ASP  52          HB2       ASP  52  -8.771   2.361 -13.373
  410   2HB   ASP  52          HB1       ASP  52  -9.214   0.725 -13.860
  411    H    THR  53           HN       THR  53  -6.501   2.454 -11.903
  412    HA   THR  53           HA       THR  53  -4.678   0.614 -13.257
  413    HB   THR  53           HB       THR  53  -4.227   3.408 -12.299
  414    HG1  THR  53           HG1      THR  53  -5.494   2.376 -14.395
  415   1HG2  THR  53          HG21      THR  53  -2.145   2.005 -12.507
  416   2HG2  THR  53          HG22      THR  53  -2.202   3.356 -13.635
  417   3HG2  THR  53          HG23      THR  53  -2.577   1.727 -14.192
  418    H    TYR  54           HN       TYR  54  -5.383   1.625 -10.055
  419    HA   TYR  54           HA       TYR  54  -3.156  -0.102  -9.030
  420   1HB   TYR  54          HB2       TYR  54  -4.069   2.577  -7.971
  421   2HB   TYR  54          HB1       TYR  54  -3.071   1.452  -7.051
  422    HD1  TYR  54           HD1      TYR  54  -3.241   3.053 -10.382
  423    HD2  TYR  54           HD2      TYR  54  -0.732   1.599  -7.262
  424    HE1  TYR  54           HE1      TYR  54  -1.297   3.990 -11.569
  425    HE2  TYR  54           HE2      TYR  54   1.263   2.509  -8.438
  426    HH   TYR  54           HH       TYR  54   1.279   4.757 -10.543
  427    H    GLY  55           HN       GLY  55  -4.859  -1.729  -8.939
  428   1HA   GLY  55          HA2       GLY  55  -6.405  -1.536  -6.429
  429   2HA   GLY  55          HA1       GLY  55  -7.326  -1.833  -7.908
  430    H    SER  56           HN       SER  56  -7.202  -3.904  -8.874
  431    HA   SER  56           HA       SER  56  -6.838  -6.105  -7.248
  432   1HB   SER  56          HB2       SER  56  -7.832  -6.267  -9.495
  433   2HB   SER  56          HB1       SER  56  -6.256  -5.982 -10.227
  434    HG   SER  56           HG       SER  56  -5.679  -7.899  -8.772
  435    H    SER  57           HN       SER  57  -4.294  -4.147  -8.612
  436    HA   SER  57           HA       SER  57  -2.256  -6.245  -8.052
  437   1HB   SER  57          HB2       SER  57  -2.013  -3.444  -9.192
  438   2HB   SER  57          HB1       SER  57  -0.622  -4.463  -8.798
  439    HG   SER  57           HG       SER  57  -1.075  -5.719 -10.454
  440    H    ILE  58           HN       ILE  58  -2.036  -2.775  -7.354
  441    HA   ILE  58           HA       ILE  58  -0.517  -2.639  -5.145
  442    HB   ILE  58           HB       ILE  58  -1.803  -0.753  -6.120
  443   1HG1  ILE  58          HG12      ILE  58  -1.841  -1.154  -3.129
  444   2HG1  ILE  58          HG11      ILE  58  -0.697  -0.201  -4.077
  445   1HG2  ILE  58          HG21      ILE  58  -4.062  -1.522  -4.326
  446   2HG2  ILE  58          HG22      ILE  58  -3.995  -2.088  -6.001
  447   3HG2  ILE  58          HG23      ILE  58  -4.056  -0.368  -5.641
  448   1HD1  ILE  58          HD11      ILE  58  -3.578   0.427  -3.396
  449   2HD1  ILE  58          HD12      ILE  58  -2.762   1.226  -4.743
  450   3HD1  ILE  58          HD13      ILE  58  -2.143   1.416  -3.100
  451    H    LEU  59           HN       LEU  59  -3.944  -3.559  -4.984
  452    HA   LEU  59           HA       LEU  59  -3.830  -4.069  -2.149
  453   1HB   LEU  59          HB2       LEU  59  -5.847  -5.408  -3.955
  454   2HB   LEU  59          HB1       LEU  59  -6.038  -4.906  -2.279
  455    HG   LEU  59           HG       LEU  59  -5.629  -2.966  -4.541
  456   1HD1  LEU  59          HD11      LEU  59  -8.022  -2.589  -4.518
  457   2HD1  LEU  59          HD12      LEU  59  -8.216  -3.795  -3.249
  458   3HD1  LEU  59          HD13      LEU  59  -7.692  -4.289  -4.863
  459   1HD2  LEU  59          HD21      LEU  59  -5.065  -2.115  -2.294
  460   2HD2  LEU  59          HD22      LEU  59  -6.653  -2.623  -1.715
  461   3HD2  LEU  59          HD23      LEU  59  -6.518  -1.340  -2.918
  462    H    SER  60           HN       SER  60  -3.667  -6.233  -5.007
  463    HA   SER  60           HA       SER  60  -3.165  -8.553  -3.236
  464   1HB   SER  60          HB2       SER  60  -4.616  -8.578  -5.362
  465   2HB   SER  60          HB1       SER  60  -3.096  -8.566  -6.252
  466    HG   SER  60           HG       SER  60  -3.614 -10.400  -4.162
  467    H    ILE  61           HN       ILE  61  -1.232  -6.149  -4.436
  468    HA   ILE  61           HA       ILE  61   1.008  -7.850  -5.270
  469    HB   ILE  61           HB       ILE  61   0.257  -5.385  -6.017
  470   1HG1  ILE  61          HG12      ILE  61   2.006  -6.806  -7.041
  471   2HG1  ILE  61          HG11      ILE  61   2.383  -5.095  -7.081
  472   1HG2  ILE  61          HG21      ILE  61   0.677  -4.279  -3.917
  473   2HG2  ILE  61          HG22      ILE  61   1.770  -3.678  -5.151
  474   3HG2  ILE  61          HG23      ILE  61   2.367  -4.800  -3.937
  475   1HD1  ILE  61          HD11      ILE  61   3.883  -5.325  -5.204
  476   2HD1  ILE  61          HD12      ILE  61   4.308  -6.542  -6.409
  477   3HD1  ILE  61          HD13      ILE  61   3.403  -7.005  -4.970
  478    H    LEU  62           HN       LEU  62   0.775  -5.394  -2.651
  479    HA   LEU  62           HA       LEU  62   3.060  -6.209  -1.247
  480   1HB   LEU  62          HB2       LEU  62   0.494  -5.198  -0.031
  481   2HB   LEU  62          HB1       LEU  62   2.089  -5.167   0.725
  482    HG   LEU  62           HG       LEU  62   1.373  -3.787  -1.863
  483   1HD1  LEU  62          HD11      LEU  62   1.852  -2.649   0.900
  484   2HD1  LEU  62          HD12      LEU  62   0.292  -2.733   0.081
  485   3HD1  LEU  62          HD13      LEU  62   1.570  -1.701  -0.560
  486   1HD2  LEU  62          HD21      LEU  62   3.652  -2.605  -1.191
  487   2HD2  LEU  62          HD22      LEU  62   3.643  -4.119  -2.093
  488   3HD2  LEU  62          HD23      LEU  62   3.925  -4.132  -0.351
  489    H    LEU  63           HN       LEU  63   0.390  -8.101  -1.870
  490    HA   LEU  63           HA       LEU  63   0.420  -9.613   0.629
  491   1HB   LEU  63          HB2       LEU  63  -0.943  -9.911  -2.040
  492   2HB   LEU  63          HB1       LEU  63  -1.163 -11.064  -0.731
  493    HG   LEU  63           HG       LEU  63  -2.873  -9.122  -1.013
  494   1HD1  LEU  63          HD11      LEU  63  -3.291  -9.076   1.389
  495   2HD1  LEU  63          HD12      LEU  63  -1.645  -9.617   1.706
  496   3HD1  LEU  63          HD13      LEU  63  -2.788 -10.694   0.905
  497   1HD2  LEU  63          HD21      LEU  63  -1.202  -7.283  -1.117
  498   2HD2  LEU  63          HD22      LEU  63  -0.763  -7.625   0.559
  499   3HD2  LEU  63          HD23      LEU  63  -2.382  -7.065   0.169
  500    H    GLU  64           HN       GLU  64   1.110 -10.460  -2.808
  501    HA   GLU  64           HA       GLU  64   3.031 -12.547  -1.792
  502   1HB   GLU  64          HB2       GLU  64   1.008 -12.782  -4.024
  503   2HB   GLU  64          HB1       GLU  64   2.222 -14.000  -3.629
  504   1HG   GLU  64          HG2       GLU  64   1.270 -14.262  -1.384
  505   2HG   GLU  64          HG1       GLU  64   0.091 -12.994  -1.719
  506    H    GLU  65           HN       GLU  65   2.007 -11.000  -4.863
  507    HA   GLU  65           HA       GLU  65   4.181 -11.568  -6.426
  508   1HB   GLU  65          HB2       GLU  65   3.028  -8.788  -6.369
  509   2HB   GLU  65          HB1       GLU  65   3.677  -9.659  -7.757
  510   1HG   GLU  65          HG2       GLU  65   1.829 -11.373  -7.381
  511   2HG   GLU  65          HG1       GLU  65   1.119 -10.225  -6.245
  512    H    VAL  66           HN       VAL  66   4.284  -9.749  -3.597
  513    HA   VAL  66           HA       VAL  66   7.176  -9.208  -4.038
  514    HB   VAL  66           HB       VAL  66   5.719  -7.215  -4.657
  515   1HG1  VAL  66          HG11      VAL  66   4.252  -7.699  -2.540
  516   2HG1  VAL  66          HG12      VAL  66   4.510  -6.038  -3.056
  517   3HG1  VAL  66          HG13      VAL  66   5.442  -6.707  -1.715
  518   1HG2  VAL  66          HG21      VAL  66   7.944  -6.614  -4.327
  519   2HG2  VAL  66          HG22      VAL  66   7.955  -7.186  -2.659
  520   3HG2  VAL  66          HG23      VAL  66   7.172  -5.665  -3.060
  521    H    SER  67           HN       SER  67   8.329  -9.761  -2.222
  522    HA   SER  67           HA       SER  67   6.902 -10.718   0.112
  523   1HB   SER  67          HB2       SER  67   9.769 -10.532  -0.722
  524   2HB   SER  67          HB1       SER  67   9.435 -10.730   0.995
  525    HG   SER  67           HG       SER  67   8.463 -12.361  -1.120
  526    HA   PRO  68           HA       PRO  68   6.592  -6.989   2.458
  527   1HB   PRO  68          HB2       PRO  68   7.631  -8.008   4.942
  528   2HB   PRO  68          HB1       PRO  68   5.934  -7.807   4.468
  529   1HG   PRO  68          HG2       PRO  68   7.507 -10.278   4.640
  530   2HG   PRO  68          HG1       PRO  68   5.761 -10.092   4.413
  531   1HD   PRO  68          HD2       PRO  68   7.617 -10.922   2.440
  532   2HD   PRO  68          HD1       PRO  68   5.937 -10.429   2.161
  533    H    GLU  69           HN       GLU  69   9.663  -8.715   3.205
  534    HA   GLU  69           HA       GLU  69  11.085  -6.390   4.005
  535   1HB   GLU  69          HB2       GLU  69  13.124  -7.701   3.657
  536   2HB   GLU  69          HB1       GLU  69  11.887  -8.687   4.434
  537   1HG   GLU  69          HG2       GLU  69  11.269  -9.577   2.160
  538   2HG   GLU  69          HG1       GLU  69  12.668  -8.719   1.507
  539    H    LEU  70           HN       LEU  70  10.521  -7.686   0.755
  540    HA   LEU  70           HA       LEU  70  12.483  -6.059  -0.563
  541   1HB   LEU  70          HB2       LEU  70  11.577  -7.889  -1.791
  542   2HB   LEU  70          HB1       LEU  70   9.924  -7.378  -1.477
  543    HG   LEU  70           HG       LEU  70  10.194  -5.436  -2.923
  544   1HD1  LEU  70          HD11      LEU  70  12.453  -4.768  -2.575
  545   2HD1  LEU  70          HD12      LEU  70  12.409  -5.305  -4.248
  546   3HD1  LEU  70          HD13      LEU  70  13.076  -6.358  -3.000
  547   1HD2  LEU  70          HD21      LEU  70  11.465  -7.676  -4.496
  548   2HD2  LEU  70          HD22      LEU  70  10.188  -6.560  -4.980
  549   3HD2  LEU  70          HD23      LEU  70   9.835  -7.872  -3.857
  550    H    VAL  71           HN       VAL  71   8.994  -5.563   0.030
  551    HA   VAL  71           HA       VAL  71   8.570  -3.118  -1.200
  552    HB   VAL  71           HB       VAL  71   7.611  -3.473   1.638
  553   1HG1  VAL  71          HG11      VAL  71   6.158  -2.675  -0.901
  554   2HG1  VAL  71          HG12      VAL  71   6.931  -1.520   0.184
  555   3HG1  VAL  71          HG13      VAL  71   5.583  -2.501   0.758
  556   1HG2  VAL  71          HG21      VAL  71   6.881  -5.129  -0.782
  557   2HG2  VAL  71          HG22      VAL  71   5.832  -4.986   0.631
  558   3HG2  VAL  71          HG23      VAL  71   7.434  -5.686   0.791
  559    H    CYS  72           HN       CYS  72   9.779  -3.480   2.156
  560    HA   CYS  72           HA       CYS  72  10.346  -0.765   2.649
  561   1HB   CYS  72          HB2       CYS  72  10.678  -2.556   4.353
  562   2HB   CYS  72          HB1       CYS  72  12.127  -3.079   3.488
  563    H    SER  73           HN       SER  73  12.097  -3.092   0.676
  564    HA   SER  73           HA       SER  73  14.368  -1.328   0.219
  565   1HB   SER  73          HB2       SER  73  13.669  -4.030  -0.421
  566   2HB   SER  73          HB1       SER  73  14.077  -3.222  -1.932
  567    HG   SER  73           HG       SER  73  15.632  -3.129   0.445
  568    H    MET  74           HN       MET  74  11.609  -2.351  -1.875
  569    HA   MET  74           HA       MET  74  12.087  -0.558  -4.001
  570   1HB   MET  74          HB2       MET  74   9.491  -1.595  -2.827
  571   2HB   MET  74          HB1       MET  74   9.522  -0.562  -4.253
  572   1HG   MET  74          HG2       MET  74  11.226  -2.312  -5.190
  573   2HG   MET  74          HG1       MET  74  10.577  -3.363  -3.932
  574   1HE   MET  74          HE1       MET  74   7.278  -2.349  -3.929
  575   2HE   MET  74          HE2       MET  74   8.302  -3.699  -3.448
  576   3HE   MET  74          HE3       MET  74   7.018  -3.954  -4.635
  577    H    LEU  75           HN       LEU  75  10.248  -0.020  -0.999
  578    HA   LEU  75           HA       LEU  75   9.489   2.671  -1.550
  579   1HB   LEU  75          HB2       LEU  75  10.096   1.376   1.129
  580   2HB   LEU  75          HB1       LEU  75   9.212   2.882   0.906
  581    HG   LEU  75           HG       LEU  75   8.331   0.277  -0.366
  582   1HD1  LEU  75          HD11      LEU  75   8.212  -0.254   1.926
  583   2HD1  LEU  75          HD12      LEU  75   6.596   0.345   1.561
  584   3HD1  LEU  75          HD13      LEU  75   7.757   1.390   2.378
  585   1HD2  LEU  75          HD21      LEU  75   7.245   2.082  -1.436
  586   2HD2  LEU  75          HD22      LEU  75   7.078   2.994   0.064
  587   3HD2  LEU  75          HD23      LEU  75   6.086   1.565  -0.215
  588    H    HIS  76           HN       HIS  76  12.504   1.255  -0.503
  589    HA   HIS  76           HA       HIS  76  14.559   2.238   0.094
  590   1HB   HIS  76          HB2       HIS  76  13.505   3.860  -2.227
  591   2HB   HIS  76          HB1       HIS  76  15.109   4.152  -1.553
  592    HD1  HIS  76           HD1      HIS  76  16.577   1.768  -1.322
  593    HD2  HIS  76           HD2      HIS  76  13.549   1.926  -4.183
  594    HE1  HIS  76           HE1      HIS  76  17.057  -0.090  -2.975
  595    H    LEU  77           HN       LEU  77  12.495   3.117   1.859
  596    HA   LEU  77           HA       LEU  77  12.631   6.021   2.070
  597   1HB   LEU  77          HB2       LEU  77  11.265   5.812   4.007
  598   2HB   LEU  77          HB1       LEU  77  10.707   4.557   2.907
  599    HG   LEU  77           HG       LEU  77  12.590   4.146   5.262
  600   1HD1  LEU  77          HD11      LEU  77  10.615   2.731   6.036
  601   2HD1  LEU  77          HD12      LEU  77   9.673   3.528   4.776
  602   3HD1  LEU  77          HD13      LEU  77  10.380   4.478   6.083
  603   1HD2  LEU  77          HD21      LEU  77  11.506   2.288   3.128
  604   2HD2  LEU  77          HD22      LEU  77  12.092   1.693   4.681
  605   3HD2  LEU  77          HD23      LEU  77  13.190   2.538   3.592
  606    H    CYS  78           HN       CYS  78  14.677   3.449   2.958
  607    HA   CYS  78           HA       CYS  78  15.869   4.506   5.337
  608   1HB   CYS  78          HB2       CYS  78  17.067   2.769   3.154
  609   2HB   CYS  78          HB1       CYS  78  17.837   3.097   4.705
  610    H    SER  79           HN       SER  79  17.051   4.667   1.958
  611    HA   SER  79           HA       SER  79  19.171   6.479   2.455
  612   1HB   SER  79          HB2       SER  79  17.491   6.225  -0.056
  613   2HB   SER  79          HB1       SER  79  19.082   6.974   0.047
  614    HG   SER  79           HG       SER  79  19.038   4.719  -0.639
  615    H    GLY  80           HN       GLY  80  18.389   8.107   3.901
  616   1HA   GLY  80          HA2       GLY  80  16.164   9.836   3.088
  617   2HA   GLY  80          HA1       GLY  80  17.189  10.059   4.508
  618    H    LEU  81           HN       LEU  81  19.654   9.835   2.968
  619    HA   LEU  81           HA       LEU  81  19.661  12.496   1.622
  620   1HB   LEU  81          HB2       LEU  81  22.213  12.251   2.164
  621   2HB   LEU  81          HB1       LEU  81  21.111  12.698   3.460
  622    HG   LEU  81           HG       LEU  81  21.011  10.419   4.252
  623   1HD1  LEU  81          HD11      LEU  81  22.659   8.741   3.156
  624   2HD1  LEU  81          HD12      LEU  81  22.632   9.823   1.767
  625   3HD1  LEU  81          HD13      LEU  81  21.145   9.051   2.313
  626   1HD2  LEU  81          HD21      LEU  81  23.871  11.243   3.678
  627   2HD2  LEU  81          HD22      LEU  81  23.352  10.145   4.957
  628   3HD2  LEU  81          HD23      LEU  81  22.885  11.844   5.011
  629    H    VAL  82           HN       VAL  82  21.924  12.380   0.205
  630    HA   VAL  82           HA       VAL  82  21.285  10.352  -1.789
  631    HB   VAL  82           HB       VAL  82  23.440  11.343  -2.897
  632   1HG1  VAL  82          HG11      VAL  82  20.987  13.072  -2.455
  633   2HG1  VAL  82          HG12      VAL  82  21.123  11.775  -3.644
  634   3HG1  VAL  82          HG13      VAL  82  22.130  13.216  -3.790
  635   1HG2  VAL  82          HG21      VAL  82  24.086  13.528  -2.093
  636   2HG2  VAL  82          HG22      VAL  82  24.137  12.429  -0.713
  637   3HG2  VAL  82          HG23      VAL  82  22.778  13.537  -0.909
  638    HA   PRO  83           HA       PRO  83  23.751   7.221   0.140
  639   1HB   PRO  83          HB2       PRO  83  24.662   6.413  -2.569
  640   2HB   PRO  83          HB1       PRO  83  23.830   5.460  -1.327
  641   1HG   PRO  83          HG2       PRO  83  22.606   6.498  -3.624
  642   2HG   PRO  83          HG1       PRO  83  21.759   5.974  -2.161
  643   1HD   PRO  83          HD2       PRO  83  22.117   8.709  -3.165
  644   2HD   PRO  83          HD1       PRO  83  21.089   8.127  -1.830
  645    H    ARG  84           HN       ARG  84  25.582   8.028   1.129
  646    HA   ARG  84           HA       ARG  84  27.538   9.612  -0.342
  647   1HB   ARG  84          HB2       ARG  84  27.575   8.502   2.481
  648   2HB   ARG  84          HB1       ARG  84  28.754   9.644   1.844
  649   1HG   ARG  84          HG2       ARG  84  25.829  10.331   1.631
  650   2HG   ARG  84          HG1       ARG  84  26.615  10.491   3.199
  651   1HD   ARG  84          HD2       ARG  84  26.597  12.486   1.357
  652   2HD   ARG  84          HD1       ARG  84  27.899  12.282   2.529
  653    HE   ARG  84           HE       ARG  84  28.725  10.735   0.406
  654   1HH1  ARG  84          HH21      ARG  84  27.588  13.960   0.826
  655   2HH1  ARG  84          HH22      ARG  84  28.525  14.603  -0.480
  656   1HH2  ARG  84          HH11      ARG  84  29.957  11.554  -1.303
  657   2HH2  ARG  84          HH12      ARG  84  29.868  13.240  -1.686
  Start of MODEL    9
    1   1H    SER   1           HT1      SER   1  25.704   4.115   8.172
    2   2H    SER   1           HT2      SER   1  24.292   4.396   7.270
    3   3H    SER   1           HT3      SER   1  25.035   2.869   7.235
    4    HA   SER   1           HA       SER   1  24.636   2.928   9.789
    5   1HB   SER   1          HB2       SER   1  22.638   4.171  10.390
    6   2HB   SER   1          HB1       SER   1  23.793   5.290   9.671
    7    HG   SER   1           HG       SER   1  21.642   4.002   8.331
    8    H    ASP   2           HN       ASP   2  22.539   1.745  10.445
    9    HA   ASP   2           HA       ASP   2  20.859   0.670   8.349
   10   1HB   ASP   2          HB2       ASP   2  21.683  -1.697   8.569
   11   2HB   ASP   2          HB1       ASP   2  22.836  -0.619   7.780
   12    H    VAL   3           HN       VAL   3  19.853   1.791  10.466
   13    HA   VAL   3           HA       VAL   3  19.404  -0.244  12.586
   14    HB   VAL   3           HB       VAL   3  18.695   2.672  12.495
   15   1HG1  VAL   3          HG11      VAL   3  18.444   2.249  15.019
   16   2HG1  VAL   3          HG12      VAL   3  18.401   0.536  14.602
   17   3HG1  VAL   3          HG13      VAL   3  17.164   1.629  13.978
   18   1HG2  VAL   3          HG21      VAL   3  20.901   1.198  13.957
   19   2HG2  VAL   3          HG22      VAL   3  20.547   2.918  14.116
   20   3HG2  VAL   3          HG23      VAL   3  21.126   2.275  12.579
   21    H    TYR   4           HN       TYR   4  17.548   2.029  10.546
   22    HA   TYR   4           HA       TYR   4  15.009   0.813  11.247
   23   1HB   TYR   4          HB2       TYR   4  15.940   2.884   9.279
   24   2HB   TYR   4          HB1       TYR   4  14.351   2.165   9.034
   25    HD1  TYR   4           HD1      TYR   4  12.910   3.968   9.599
   26    HD2  TYR   4           HD2      TYR   4  16.044   2.818  12.303
   27    HE1  TYR   4           HE1      TYR   4  11.961   5.455  11.339
   28    HE2  TYR   4           HE2      TYR   4  15.097   4.300  14.039
   29    HH   TYR   4           HH       TYR   4  12.265   5.309  14.248
   30    H    CYS   5           HN       CYS   5  17.487   0.087   8.945
   31    HA   CYS   5           HA       CYS   5  15.913  -1.271   6.979
   32   1HB   CYS   5          HB2       CYS   5  18.389  -0.657   6.821
   33   2HB   CYS   5          HB1       CYS   5  18.707  -2.070   7.828
   34    H    GLU   6           HN       GLU   6  17.300  -2.318  10.067
   35    HA   GLU   6           HA       GLU   6  16.391  -5.084   9.690
   36   1HB   GLU   6          HB2       GLU   6  17.568  -3.610  12.065
   37   2HB   GLU   6          HB1       GLU   6  17.142  -5.323  12.087
   38   1HG   GLU   6          HG2       GLU   6  18.687  -5.753  10.227
   39   2HG   GLU   6          HG1       GLU   6  19.091  -4.038  10.151
   40    H    VAL   7           HN       VAL   7  15.515  -2.380  11.868
   41    HA   VAL   7           HA       VAL   7  13.359  -3.600  13.193
   42    HB   VAL   7           HB       VAL   7  13.512  -0.714  12.264
   43   1HG1  VAL   7          HG11      VAL   7  12.128  -0.362  14.350
   44   2HG1  VAL   7          HG12      VAL   7  11.952  -2.114  14.452
   45   3HG1  VAL   7          HG13      VAL   7  11.297  -1.241  13.067
   46   1HG2  VAL   7          HG21      VAL   7  15.508  -1.625  13.570
   47   2HG2  VAL   7          HG22      VAL   7  14.397  -1.881  14.915
   48   3HG2  VAL   7          HG23      VAL   7  14.683  -0.251  14.305
   49    H    CYS   8           HN       CYS   8  13.232  -1.676  10.176
   50    HA   CYS   8           HA       CYS   8  10.479  -1.992   9.648
   51   1HB   CYS   8          HB2       CYS   8  11.000  -1.420   7.362
   52   2HB   CYS   8          HB1       CYS   8  12.102  -0.512   8.397
   53    H    GLU   9           HN       GLU   9  13.194  -4.052   8.619
   54    HA   GLU   9           HA       GLU   9  11.858  -5.938   7.046
   55   1HB   GLU   9          HB2       GLU   9  14.278  -6.212   7.457
   56   2HB   GLU   9          HB1       GLU   9  13.960  -6.629   9.149
   57   1HG   GLU   9          HG2       GLU   9  12.860  -8.653   8.536
   58   2HG   GLU   9          HG1       GLU   9  12.776  -8.178   6.839
   59    H    PHE  10           HN       PHE  10  11.821  -5.745  10.587
   60    HA   PHE  10           HA       PHE  10  10.177  -8.156  10.826
   61   1HB   PHE  10          HB2       PHE  10  11.737  -7.601  12.612
   62   2HB   PHE  10          HB1       PHE  10  10.960  -6.035  12.845
   63    HD1  PHE  10           HD1      PHE  10   8.978  -5.817  14.151
   64    HD2  PHE  10           HD2      PHE  10  10.427  -9.712  13.069
   65    HE1  PHE  10           HE1      PHE  10   7.349  -6.854  15.706
   66    HE2  PHE  10           HE2      PHE  10   8.799 -10.750  14.625
   67    HZ   PHE  10           HZ       PHE  10   7.259  -9.321  15.944
   68    H    LEU  11           HN       LEU  11   9.572  -4.793  10.295
   69    HA   LEU  11           HA       LEU  11   6.811  -4.955  11.357
   70   1HB   LEU  11          HB2       LEU  11   8.265  -2.701   9.943
   71   2HB   LEU  11          HB1       LEU  11   6.669  -2.581  10.680
   72    HG   LEU  11           HG       LEU  11   9.192  -3.347  12.182
   73   1HD1  LEU  11          HD11      LEU  11   9.470  -1.069  11.554
   74   2HD1  LEU  11          HD12      LEU  11   8.831  -1.016  13.197
   75   3HD1  LEU  11          HD13      LEU  11   7.766  -0.704  11.826
   76   1HD2  LEU  11          HD21      LEU  11   7.569  -2.587  14.124
   77   2HD2  LEU  11          HD22      LEU  11   7.416  -4.207  13.454
   78   3HD2  LEU  11          HD23      LEU  11   6.300  -2.938  12.950
   79    H    VAL  12           HN       VAL  12   8.467  -4.771   8.213
   80    HA   VAL  12           HA       VAL  12   5.944  -4.591   6.760
   81    HB   VAL  12           HB       VAL  12   7.294  -4.735   4.769
   82   1HG1  VAL  12          HG11      VAL  12   8.737  -3.171   6.927
   83   2HG1  VAL  12          HG12      VAL  12   7.342  -2.604   6.011
   84   3HG1  VAL  12          HG13      VAL  12   8.877  -2.892   5.191
   85   1HG2  VAL  12          HG21      VAL  12   9.381  -5.782   6.676
   86   2HG2  VAL  12          HG22      VAL  12   9.838  -5.067   5.129
   87   3HG2  VAL  12          HG23      VAL  12   8.804  -6.487   5.170
   88    H    LYS  13           HN       LYS  13   8.071  -7.181   7.807
   89    HA   LYS  13           HA       LYS  13   6.738  -9.235   6.157
   90   1HB   LYS  13          HB2       LYS  13   9.105  -9.428   6.706
   91   2HB   LYS  13          HB1       LYS  13   8.726  -9.431   8.423
   92   1HG   LYS  13          HG2       LYS  13   7.125 -11.503   7.232
   93   2HG   LYS  13          HG1       LYS  13   8.741 -11.674   6.562
   94   1HD   LYS  13          HD2       LYS  13   8.775 -12.991   8.524
   95   2HD   LYS  13          HD1       LYS  13   9.584 -11.498   8.997
   96   1HE   LYS  13          HE2       LYS  13   7.526 -10.660  10.012
   97   2HE   LYS  13          HE1       LYS  13   6.642 -12.081   9.453
   98   1HZ   LYS  13          HZ1       LYS  13   7.571 -13.394  11.019
   99   2HZ   LYS  13          HZ2       LYS  13   7.707 -11.923  11.859
  100   3HZ   LYS  13          HZ3       LYS  13   9.047 -12.558  11.028
  101    H    GLU  14           HN       GLU  14   6.742  -8.191   9.574
  102    HA   GLU  14           HA       GLU  14   4.934 -10.267  10.458
  103   1HB   GLU  14          HB2       GLU  14   6.431  -8.863  11.952
  104   2HB   GLU  14          HB1       GLU  14   5.305  -7.527  11.700
  105   1HG   GLU  14          HG2       GLU  14   4.631  -8.603  13.735
  106   2HG   GLU  14          HG1       GLU  14   3.461  -9.084  12.505
  107    H    VAL  15           HN       VAL  15   4.417  -6.811   9.724
  108    HA   VAL  15           HA       VAL  15   1.625  -6.750  10.015
  109    HB   VAL  15           HB       VAL  15   3.159  -4.788   9.479
  110   1HG1  VAL  15          HG11      VAL  15   3.662  -4.300   7.188
  111   2HG1  VAL  15          HG12      VAL  15   2.672  -5.641   6.617
  112   3HG1  VAL  15          HG13      VAL  15   4.177  -5.958   7.478
  113   1HG2  VAL  15          HG21      VAL  15   1.366  -3.688   8.006
  114   2HG2  VAL  15          HG22      VAL  15   0.823  -4.360   9.543
  115   3HG2  VAL  15          HG23      VAL  15   0.539  -5.246   8.045
  116    H    THR  16           HN       THR  16   3.575  -7.814   7.242
  117    HA   THR  16           HA       THR  16   1.505  -8.324   5.415
  118    HB   THR  16           HB       THR  16   3.360 -10.495   5.205
  119    HG1  THR  16           HG1      THR  16   4.661  -8.070   5.744
  120   1HG2  THR  16          HG21      THR  16   3.198  -7.767   3.903
  121   2HG2  THR  16          HG22      THR  16   2.538  -9.289   3.284
  122   3HG2  THR  16          HG23      THR  16   4.293  -9.046   3.365
  123    H    LYS  17           HN       LYS  17   2.768 -10.475   7.986
  124    HA   LYS  17           HA       LYS  17   1.190 -12.727   7.533
  125   1HB   LYS  17          HB2       LYS  17   2.160 -11.445  10.089
  126   2HB   LYS  17          HB1       LYS  17   1.163 -12.896  10.142
  127   1HG   LYS  17          HG2       LYS  17   2.783 -14.043   8.654
  128   2HG   LYS  17          HG1       LYS  17   3.794 -12.598   8.664
  129   1HD   LYS  17          HD2       LYS  17   4.251 -12.807  10.992
  130   2HD   LYS  17          HD1       LYS  17   2.967 -13.998  11.212
  131   1HE   LYS  17          HE2       LYS  17   5.278 -14.996  11.147
  132   2HE   LYS  17          HE1       LYS  17   4.187 -15.643   9.922
  133   1HZ   LYS  17          HZ1       LYS  17   5.585 -14.971   8.364
  134   2HZ   LYS  17          HZ2       LYS  17   6.642 -14.359   9.547
  135   3HZ   LYS  17          HZ3       LYS  17   5.434 -13.363   8.884
  136    H    LEU  18           HN       LEU  18   0.224  -9.683   9.108
  137    HA   LEU  18           HA       LEU  18  -2.528 -10.725   9.485
  138   1HB   LEU  18          HB2       LEU  18  -2.675  -9.142  11.119
  139   2HB   LEU  18          HB1       LEU  18  -0.947  -8.917  10.888
  140    HG   LEU  18           HG       LEU  18  -1.536  -7.179   9.112
  141   1HD1  LEU  18          HD11      LEU  18  -3.701  -6.829   8.555
  142   2HD1  LEU  18          HD12      LEU  18  -4.143  -6.535  10.234
  143   3HD1  LEU  18          HD13      LEU  18  -4.171  -8.176   9.590
  144   1HD2  LEU  18          HD21      LEU  18  -0.772  -6.634  11.399
  145   2HD2  LEU  18          HD22      LEU  18  -2.442  -6.681  11.964
  146   3HD2  LEU  18          HD23      LEU  18  -1.938  -5.448  10.809
  147    H    ILE  19           HN       ILE  19  -0.827  -8.348   7.485
  148    HA   ILE  19           HA       ILE  19  -3.174  -7.397   6.107
  149    HB   ILE  19           HB       ILE  19  -0.251  -7.125   6.016
  150   1HG1  ILE  19          HG12      ILE  19  -2.338  -5.144   5.126
  151   2HG1  ILE  19          HG11      ILE  19  -1.923  -5.409   6.819
  152   1HG2  ILE  19          HG21      ILE  19  -0.355  -7.941   3.778
  153   2HG2  ILE  19          HG22      ILE  19  -0.204  -6.190   3.684
  154   3HG2  ILE  19          HG23      ILE  19  -1.772  -6.953   3.421
  155   1HD1  ILE  19          HD11      ILE  19   0.584  -5.091   5.719
  156   2HD1  ILE  19          HD12      ILE  19  -0.364  -3.787   6.442
  157   3HD1  ILE  19          HD13      ILE  19  -0.392  -4.028   4.698
  158    H    ASP  20           HN       ASP  20  -1.298 -10.259   5.969
  159    HA   ASP  20           HA       ASP  20  -1.240 -11.129   3.377
  160   1HB   ASP  20          HB2       ASP  20  -0.562 -12.501   5.333
  161   2HB   ASP  20          HB1       ASP  20  -2.262 -12.791   5.704
  162    H    ASN  21           HN       ASN  21  -4.142 -11.511   5.487
  163    HA   ASN  21           HA       ASN  21  -5.889 -10.996   3.194
  164   1HB   ASN  21          HB2       ASN  21  -5.862 -13.715   4.526
  165   2HB   ASN  21          HB1       ASN  21  -7.086 -13.162   3.379
  166   1HD2  ASN  21          HD21      ASN  21  -6.450 -12.933   1.117
  167   2HD2  ASN  21          HD22      ASN  21  -5.005 -13.603   0.531
  168    H    ASN  22           HN       ASN  22  -6.044  -9.328   5.093
  169    HA   ASN  22           HA       ASN  22  -8.204 -10.221   6.980
  170   1HB   ASN  22          HB2       ASN  22  -6.066  -8.097   7.263
  171   2HB   ASN  22          HB1       ASN  22  -7.457  -8.217   8.344
  172   1HD2  ASN  22          HD21      ASN  22  -5.670 -10.951   6.874
  173   2HD2  ASN  22          HD22      ASN  22  -5.137 -11.602   8.350
  174    H    LYS  23           HN       LYS  23  -6.997  -7.279   5.354
  175    HA   LYS  23           HA       LYS  23  -9.811  -6.351   5.073
  176   1HB   LYS  23          HB2       LYS  23  -8.921  -4.182   4.608
  177   2HB   LYS  23          HB1       LYS  23  -8.027  -4.818   5.981
  178   1HG   LYS  23          HG2       LYS  23  -6.201  -4.151   4.755
  179   2HG   LYS  23          HG1       LYS  23  -6.423  -5.711   3.970
  180   1HD   LYS  23          HD2       LYS  23  -8.093  -4.318   2.420
  181   2HD   LYS  23          HD1       LYS  23  -7.130  -2.957   2.984
  182   1HE   LYS  23          HE2       LYS  23  -6.168  -5.391   1.470
  183   2HE   LYS  23          HE1       LYS  23  -6.084  -3.702   0.973
  184   1HZ   LYS  23          HZ1       LYS  23  -4.827  -3.965   3.461
  185   2HZ   LYS  23          HZ2       LYS  23  -4.136  -3.530   1.971
  186   3HZ   LYS  23          HZ3       LYS  23  -4.206  -5.164   2.434
  187    H    THR  24           HN       THR  24 -10.799  -7.129   3.306
  188    HA   THR  24           HA       THR  24  -9.283  -7.990   0.966
  189    HB   THR  24           HB       THR  24 -11.499  -8.590   0.056
  190    HG1  THR  24           HG1      THR  24 -13.237  -8.242   1.718
  191   1HG2  THR  24          HG21      THR  24 -11.361  -9.337   2.980
  192   2HG2  THR  24          HG22      THR  24 -10.257 -10.002   1.774
  193   3HG2  THR  24          HG23      THR  24 -11.991 -10.302   1.644
  194    H    GLU  25           HN       GLU  25 -10.784  -7.263  -1.184
  195    HA   GLU  25           HA       GLU  25 -10.159  -4.367  -1.388
  196   1HB   GLU  25          HB2       GLU  25 -10.294  -4.646  -3.771
  197   2HB   GLU  25          HB1       GLU  25  -9.349  -5.991  -3.133
  198   1HG   GLU  25          HG2       GLU  25 -11.544  -7.318  -3.094
  199   2HG   GLU  25          HG1       GLU  25 -12.227  -6.015  -4.063
  200    H    LYS  26           HN       LYS  26 -12.891  -6.334  -0.865
  201    HA   LYS  26           HA       LYS  26 -14.831  -4.689  -2.262
  202   1HB   LYS  26          HB2       LYS  26 -15.175  -6.577   0.094
  203   2HB   LYS  26          HB1       LYS  26 -16.488  -5.896  -0.863
  204   1HG   LYS  26          HG2       LYS  26 -15.947  -7.156  -2.762
  205   2HG   LYS  26          HG1       LYS  26 -14.285  -7.425  -2.243
  206   1HD   LYS  26          HD2       LYS  26 -16.544  -8.546  -0.588
  207   2HD   LYS  26          HD1       LYS  26 -16.057  -9.380  -2.061
  208   1HE   LYS  26          HE2       LYS  26 -13.712  -9.449  -1.219
  209   2HE   LYS  26          HE1       LYS  26 -14.252  -8.700   0.283
  210   1HZ   LYS  26          HZ1       LYS  26 -15.679 -11.080  -0.623
  211   2HZ   LYS  26          HZ2       LYS  26 -15.305 -10.571   0.954
  212   3HZ   LYS  26          HZ3       LYS  26 -14.113 -11.304  -0.011
  213    H    GLU  27           HN       GLU  27 -13.306  -4.795   0.870
  214    HA   GLU  27           HA       GLU  27 -14.961  -2.745   2.058
  215   1HB   GLU  27          HB2       GLU  27 -13.629  -4.490   3.329
  216   2HB   GLU  27          HB1       GLU  27 -12.174  -3.600   2.884
  217   1HG   GLU  27          HG2       GLU  27 -12.847  -2.870   5.085
  218   2HG   GLU  27          HG1       GLU  27 -13.186  -1.560   3.954
  219    H    ILE  28           HN       ILE  28 -12.252  -2.827  -0.069
  220    HA   ILE  28           HA       ILE  28 -11.402  -0.071   0.495
  221    HB   ILE  28           HB       ILE  28 -10.587  -2.089  -1.604
  222   1HG1  ILE  28          HG12      ILE  28  -9.911  -2.755   0.639
  223   2HG1  ILE  28          HG11      ILE  28  -8.500  -2.233  -0.270
  224   1HG2  ILE  28          HG21      ILE  28  -8.619  -0.483  -1.854
  225   2HG2  ILE  28          HG22      ILE  28  -9.612   0.694  -1.006
  226   3HG2  ILE  28          HG23      ILE  28 -10.151   0.032  -2.548
  227   1HD1  ILE  28          HD11      ILE  28  -9.085   0.119   0.851
  228   2HD1  ILE  28          HD12      ILE  28  -8.142  -1.097   1.707
  229   3HD1  ILE  28          HD13      ILE  28  -9.863  -0.923   2.042
  230    H    LEU  29           HN       LEU  29 -12.193  -1.605  -2.664
  231    HA   LEU  29           HA       LEU  29 -12.826   0.660  -4.086
  232   1HB   LEU  29          HB2       LEU  29 -13.915  -2.142  -4.160
  233   2HB   LEU  29          HB1       LEU  29 -14.730  -0.924  -5.135
  234    HG   LEU  29           HG       LEU  29 -12.441  -0.331  -6.088
  235   1HD1  LEU  29          HD11      LEU  29 -11.744  -2.855  -4.591
  236   2HD1  LEU  29          HD12      LEU  29 -10.947  -1.282  -4.511
  237   3HD1  LEU  29          HD13      LEU  29 -10.800  -2.271  -5.962
  238   1HD2  LEU  29          HD21      LEU  29 -13.400  -3.162  -6.575
  239   2HD2  LEU  29          HD22      LEU  29 -12.502  -2.147  -7.704
  240   3HD2  LEU  29          HD23      LEU  29 -14.156  -1.725  -7.263
  241    H    ASP  30           HN       ASP  30 -14.736  -0.806  -1.544
  242    HA   ASP  30           HA       ASP  30 -17.132   0.757  -2.065
  243   1HB   ASP  30          HB2       ASP  30 -17.165  -1.293  -0.652
  244   2HB   ASP  30          HB1       ASP  30 -16.147  -0.475   0.535
  245    H    ALA  31           HN       ALA  31 -14.481   1.023   0.305
  246    HA   ALA  31           HA       ALA  31 -15.085   3.476   1.485
  247   1HB   ALA  31          HB1       ALA  31 -13.128   2.011   2.038
  248   2HB   ALA  31          HB2       ALA  31 -12.724   3.724   1.916
  249   3HB   ALA  31          HB3       ALA  31 -12.324   2.624   0.593
  250    H    PHE  32           HN       PHE  32 -13.295   2.953  -1.569
  251    HA   PHE  32           HA       PHE  32 -12.844   5.660  -2.210
  252   1HB   PHE  32          HB2       PHE  32 -13.291   3.186  -3.879
  253   2HB   PHE  32          HB1       PHE  32 -13.168   4.756  -4.671
  254    HD1  PHE  32           HD1      PHE  32 -11.351   2.097  -2.965
  255    HD2  PHE  32           HD2      PHE  32 -11.108   6.154  -4.364
  256    HE1  PHE  32           HE1      PHE  32  -8.876   2.017  -2.792
  257    HE2  PHE  32           HE2      PHE  32  -8.638   6.068  -4.188
  258    HZ   PHE  32           HZ       PHE  32  -7.524   3.998  -3.402
  259    H    ASP  33           HN       ASP  33 -15.775   3.710  -2.512
  260    HA   ASP  33           HA       ASP  33 -17.257   5.708  -3.989
  261   1HB   ASP  33          HB2       ASP  33 -17.846   3.221  -3.739
  262   2HB   ASP  33          HB1       ASP  33 -18.440   3.632  -2.129
  263    H    LYS  34           HN       LYS  34 -16.036   5.588  -0.880
  264    HA   LYS  34           HA       LYS  34 -18.141   7.413   0.230
  265   1HB   LYS  34          HB2       LYS  34 -15.884   6.039   1.719
  266   2HB   LYS  34          HB1       LYS  34 -17.296   6.838   2.416
  267   1HG   LYS  34          HG2       LYS  34 -18.774   5.159   1.415
  268   2HG   LYS  34          HG1       LYS  34 -17.395   4.390   0.634
  269   1HD   LYS  34          HD2       LYS  34 -16.475   4.298   3.158
  270   2HD   LYS  34          HD1       LYS  34 -18.194   4.377   3.531
  271   1HE   LYS  34          HE2       LYS  34 -17.047   2.356   1.585
  272   2HE   LYS  34          HE1       LYS  34 -17.210   2.038   3.307
  273   1HZ   LYS  34          HZ1       LYS  34 -19.153   1.229   2.260
  274   2HZ   LYS  34          HZ2       LYS  34 -19.370   2.663   1.376
  275   3HZ   LYS  34          HZ3       LYS  34 -19.602   2.656   3.059
  276    H    MET  35           HN       MET  35 -14.565   7.089   0.549
  277    HA   MET  35           HA       MET  35 -14.268   9.890   1.199
  278   1HB   MET  35          HB2       MET  35 -11.994   8.289   0.029
  279   2HB   MET  35          HB1       MET  35 -11.946   9.539   1.260
  280   1HG   MET  35          HG2       MET  35 -12.555   8.083   2.968
  281   2HG   MET  35          HG1       MET  35 -13.423   6.998   1.888
  282   1HE   MET  35          HE1       MET  35 -10.830   6.196  -0.508
  283   2HE   MET  35          HE2       MET  35 -12.497   6.008   0.007
  284   3HE   MET  35          HE3       MET  35 -11.343   4.724   0.329
  285    H    CYS  36           HN       CYS  36 -13.638   8.003  -1.753
  286    HA   CYS  36           HA       CYS  36 -12.950  10.366  -3.291
  287   1HB   CYS  36          HB2       CYS  36 -12.898   7.508  -3.638
  288   2HB   CYS  36          HB1       CYS  36 -13.774   8.196  -5.008
  289    H    SER  37           HN       SER  37 -15.676   9.819  -1.834
  290    HA   SER  37           HA       SER  37 -17.596  10.135  -4.039
  291   1HB   SER  37          HB2       SER  37 -19.250   9.821  -2.430
  292   2HB   SER  37          HB1       SER  37 -17.907   8.962  -1.684
  293    HG   SER  37           HG       SER  37 -17.430  10.950  -0.577
  294    H    LYS  38           HN       LYS  38 -16.733  12.050  -1.141
  295    HA   LYS  38           HA       LYS  38 -18.043  14.439  -1.924
  296   1HB   LYS  38          HB2       LYS  38 -16.504  15.566  -0.325
  297   2HB   LYS  38          HB1       LYS  38 -17.203  14.098   0.356
  298   1HG   LYS  38          HG2       LYS  38 -15.089  12.903  -0.514
  299   2HG   LYS  38          HG1       LYS  38 -14.408  14.515  -0.711
  300   1HD   LYS  38          HD2       LYS  38 -14.999  14.946   1.718
  301   2HD   LYS  38          HD1       LYS  38 -15.381  13.228   1.848
  302   1HE   LYS  38          HE2       LYS  38 -13.096  12.652   1.140
  303   2HE   LYS  38          HE1       LYS  38 -12.707  14.364   0.977
  304   1HZ   LYS  38          HZ1       LYS  38 -13.725  14.187   3.482
  305   2HZ   LYS  38          HZ2       LYS  38 -12.071  14.226   3.092
  306   3HZ   LYS  38          HZ3       LYS  38 -12.854  12.738   3.338
  307    H    LEU  39           HN       LEU  39 -15.009  13.055  -2.953
  308    HA   LEU  39           HA       LEU  39 -13.550  15.196  -3.873
  309   1HB   LEU  39          HB2       LEU  39 -13.691  12.399  -4.503
  310   2HB   LEU  39          HB1       LEU  39 -13.682  13.234  -6.039
  311    HG   LEU  39           HG       LEU  39 -11.628  14.513  -4.552
  312   1HD1  LEU  39          HD11      LEU  39 -10.284  12.847  -3.578
  313   2HD1  LEU  39          HD12      LEU  39 -11.206  11.541  -4.326
  314   3HD1  LEU  39          HD13      LEU  39 -11.910  12.472  -3.000
  315   1HD2  LEU  39          HD21      LEU  39 -11.396  12.270  -6.572
  316   2HD2  LEU  39          HD22      LEU  39 -10.140  13.442  -6.177
  317   3HD2  LEU  39          HD23      LEU  39 -11.626  13.974  -6.966
  318    HA   PRO  40           HA       PRO  40 -16.203  17.427  -6.699
  319   1HB   PRO  40          HB2       PRO  40 -13.988  17.820  -8.596
  320   2HB   PRO  40          HB1       PRO  40 -14.829  19.028  -7.614
  321   1HG   PRO  40          HG2       PRO  40 -12.198  18.004  -7.173
  322   2HG   PRO  40          HG1       PRO  40 -13.114  19.066  -6.094
  323   1HD   PRO  40          HD2       PRO  40 -12.473  16.271  -5.696
  324   2HD   PRO  40          HD1       PRO  40 -13.368  17.348  -4.608
  325    H    LYS  41           HN       LYS  41 -17.529  16.506  -8.221
  326    HA   LYS  41           HA       LYS  41 -17.469  13.961  -9.177
  327   1HB   LYS  41          HB2       LYS  41 -19.286  15.624  -9.556
  328   2HB   LYS  41          HB1       LYS  41 -18.318  16.320 -10.855
  329   1HG   LYS  41          HG2       LYS  41 -18.356  14.234 -12.077
  330   2HG   LYS  41          HG1       LYS  41 -19.199  13.427 -10.752
  331   1HD   LYS  41          HD2       LYS  41 -21.225  14.462 -11.212
  332   2HD   LYS  41          HD1       LYS  41 -20.463  15.912 -11.865
  333   1HE   LYS  41          HE2       LYS  41 -19.851  14.723 -13.898
  334   2HE   LYS  41          HE1       LYS  41 -20.505  13.219 -13.253
  335   1HZ   LYS  41          HZ1       LYS  41 -22.003  14.495 -14.793
  336   2HZ   LYS  41          HZ2       LYS  41 -22.138  15.671 -13.573
  337   3HZ   LYS  41          HZ3       LYS  41 -22.680  14.085 -13.292
  338    H    SER  42           HN       SER  42 -15.860  16.684 -10.729
  339    HA   SER  42           HA       SER  42 -14.948  15.377 -13.070
  340   1HB   SER  42          HB2       SER  42 -14.781  17.865 -12.406
  341   2HB   SER  42          HB1       SER  42 -13.313  17.411 -11.541
  342    HG   SER  42           HG       SER  42 -12.603  17.891 -13.534
  343    H    LEU  43           HN       LEU  43 -13.029  16.026 -10.141
  344    HA   LEU  43           HA       LEU  43 -11.023  14.074 -10.920
  345   1HB   LEU  43          HB2       LEU  43 -11.469  15.745  -8.446
  346   2HB   LEU  43          HB1       LEU  43 -10.111  14.632  -8.602
  347    HG   LEU  43           HG       LEU  43 -10.698  16.770 -10.661
  348   1HD1  LEU  43          HD11      LEU  43  -9.084  16.948  -8.111
  349   2HD1  LEU  43          HD12      LEU  43 -10.378  18.015  -8.656
  350   3HD1  LEU  43          HD13      LEU  43  -8.816  18.034  -9.474
  351   1HD2  LEU  43          HD21      LEU  43  -8.103  16.470 -10.892
  352   2HD2  LEU  43          HD22      LEU  43  -9.155  15.240 -11.582
  353   3HD2  LEU  43          HD23      LEU  43  -8.363  14.954 -10.034
  354    H    SER  44           HN       SER  44 -14.067  13.675  -9.626
  355    HA   SER  44           HA       SER  44 -13.340  11.505  -7.758
  356   1HB   SER  44          HB2       SER  44 -15.590  11.484  -7.134
  357   2HB   SER  44          HB1       SER  44 -15.425  13.159  -7.645
  358    HG   SER  44           HG       SER  44 -16.395  10.965  -9.167
  359    H    GLU  45           HN       GLU  45 -14.415  12.101 -11.001
  360    HA   GLU  45           HA       GLU  45 -15.030   9.332 -11.580
  361   1HB   GLU  45          HB2       GLU  45 -14.640  11.773 -13.324
  362   2HB   GLU  45          HB1       GLU  45 -15.018  10.180 -13.980
  363   1HG   GLU  45          HG2       GLU  45 -17.108  10.098 -12.778
  364   2HG   GLU  45          HG1       GLU  45 -16.704  11.559 -11.876
  365    H    GLU  46           HN       GLU  46 -12.293  11.485 -11.761
  366    HA   GLU  46           HA       GLU  46 -10.662   9.637 -13.333
  367   1HB   GLU  46          HB2       GLU  46  -9.953  12.155 -11.801
  368   2HB   GLU  46          HB1       GLU  46  -8.834  11.264 -12.833
  369   1HG   GLU  46          HG2       GLU  46 -10.420  11.576 -14.743
  370   2HG   GLU  46          HG1       GLU  46 -11.425  12.580 -13.698
  371    H    CYS  47           HN       CYS  47 -11.245  10.276  -9.921
  372    HA   CYS  47           HA       CYS  47  -8.855   8.844  -9.055
  373   1HB   CYS  47          HB2       CYS  47  -9.469   9.368  -6.882
  374   2HB   CYS  47          HB1       CYS  47 -10.252  10.661  -7.773
  375    H    GLN  48           HN       GLN  48 -12.104   7.984  -9.928
  376    HA   GLN  48           HA       GLN  48 -11.938   5.330  -8.654
  377   1HB   GLN  48          HB2       GLN  48 -14.005   6.835 -10.256
  378   2HB   GLN  48          HB1       GLN  48 -14.137   5.083 -10.111
  379   1HG   GLN  48          HG2       GLN  48 -13.748   6.811  -7.663
  380   2HG   GLN  48          HG1       GLN  48 -15.354   6.555  -8.345
  381   1HE2  GLN  48          HE21      GLN  48 -12.522   4.766  -7.050
  382   2HE2  GLN  48          HE22      GLN  48 -13.410   3.401  -6.571
  383    H    GLU  49           HN       GLU  49 -11.244   6.939 -11.621
  384    HA   GLU  49           HA       GLU  49 -11.314   4.628 -13.317
  385   1HB   GLU  49          HB2       GLU  49 -10.089   7.368 -13.508
  386   2HB   GLU  49          HB1       GLU  49  -9.630   6.142 -14.688
  387   1HG   GLU  49          HG2       GLU  49 -12.531   6.734 -14.084
  388   2HG   GLU  49          HG1       GLU  49 -11.632   7.666 -15.281
  389    H    VAL  50           HN       VAL  50  -8.668   6.306 -11.597
  390    HA   VAL  50           HA       VAL  50  -6.637   4.444 -12.382
  391    HB   VAL  50           HB       VAL  50  -6.726   6.099  -9.848
  392   1HG1  VAL  50          HG11      VAL  50  -5.000   4.446  -9.734
  393   2HG1  VAL  50          HG12      VAL  50  -4.203   5.943 -10.219
  394   3HG1  VAL  50          HG13      VAL  50  -4.548   4.696 -11.424
  395   1HG2  VAL  50          HG21      VAL  50  -5.283   7.644 -11.310
  396   2HG2  VAL  50          HG22      VAL  50  -7.009   7.622 -11.668
  397   3HG2  VAL  50          HG23      VAL  50  -5.884   6.724 -12.690
  398    H    VAL  51           HN       VAL  51  -8.828   4.540  -9.553
  399    HA   VAL  51           HA       VAL  51  -7.776   2.430  -8.013
  400    HB   VAL  51           HB       VAL  51 -10.662   3.132  -8.673
  401   1HG1  VAL  51          HG11      VAL  51 -10.727   0.840  -7.972
  402   2HG1  VAL  51          HG12      VAL  51 -11.173   1.804  -6.565
  403   3HG1  VAL  51          HG13      VAL  51  -9.549   1.133  -6.692
  404   1HG2  VAL  51          HG21      VAL  51  -9.283   3.537  -6.021
  405   2HG2  VAL  51          HG22      VAL  51 -10.631   4.432  -6.726
  406   3HG2  VAL  51          HG23      VAL  51  -8.996   4.679  -7.332
  407    H    ASP  52           HN       ASP  52  -9.973   2.156 -10.838
  408    HA   ASP  52           HA       ASP  52 -10.058  -0.676 -10.943
  409   1HB   ASP  52          HB2       ASP  52 -10.037   1.359 -13.200
  410   2HB   ASP  52          HB1       ASP  52 -10.402  -0.353 -13.420
  411    H    THR  53           HN       THR  53  -7.629   1.661 -11.940
  412    HA   THR  53           HA       THR  53  -5.884  -0.401 -13.068
  413    HB   THR  53           HB       THR  53  -5.425   2.529 -12.687
  414    HG1  THR  53           HG1      THR  53  -6.447   0.923 -14.708
  415   1HG2  THR  53          HG21      THR  53  -3.843   0.505 -14.282
  416   2HG2  THR  53          HG22      THR  53  -3.318   1.182 -12.744
  417   3HG2  THR  53          HG23      THR  53  -3.494   2.228 -14.149
  418    H    TYR  54           HN       TYR  54  -6.406   1.146 -10.055
  419    HA   TYR  54           HA       TYR  54  -4.031  -0.289  -8.913
  420   1HB   TYR  54          HB2       TYR  54  -5.020   2.495  -8.273
  421   2HB   TYR  54          HB1       TYR  54  -3.921   1.596  -7.229
  422    HD1  TYR  54           HD1      TYR  54  -4.331   2.538 -10.789
  423    HD2  TYR  54           HD2      TYR  54  -1.612   1.832  -7.585
  424    HE1  TYR  54           HE1      TYR  54  -2.492   3.317 -12.233
  425    HE2  TYR  54           HE2      TYR  54   0.274   2.590  -9.013
  426    HH   TYR  54           HH       TYR  54  -0.026   3.005 -12.376
  427    H    GLY  55           HN       GLY  55  -5.734  -1.929  -8.498
  428   1HA   GLY  55          HA2       GLY  55  -7.075  -1.394  -5.908
  429   2HA   GLY  55          HA1       GLY  55  -8.073  -1.978  -7.245
  430    H    SER  56           HN       SER  56  -7.800  -4.180  -7.936
  431    HA   SER  56           HA       SER  56  -7.201  -6.039  -5.935
  432   1HB   SER  56          HB2       SER  56  -6.773  -7.631  -7.966
  433   2HB   SER  56          HB1       SER  56  -8.367  -6.907  -7.782
  434    HG   SER  56           HG       SER  56  -7.971  -6.259  -9.755
  435    H    SER  57           HN       SER  57  -4.966  -4.216  -7.840
  436    HA   SER  57           HA       SER  57  -2.725  -6.073  -7.253
  437   1HB   SER  57          HB2       SER  57  -2.871  -3.489  -8.829
  438   2HB   SER  57          HB1       SER  57  -1.349  -4.309  -8.465
  439    HG   SER  57           HG       SER  57  -3.260  -4.897 -10.311
  440    H    ILE  58           HN       ILE  58  -2.684  -2.529  -7.101
  441    HA   ILE  58           HA       ILE  58  -0.898  -1.900  -5.223
  442    HB   ILE  58           HB       ILE  58  -2.577  -0.335  -6.157
  443   1HG1  ILE  58          HG12      ILE  58  -2.113  -0.309  -3.165
  444   2HG1  ILE  58          HG11      ILE  58  -1.241   0.606  -4.401
  445   1HG2  ILE  58          HG21      ILE  58  -4.764  -0.179  -5.361
  446   2HG2  ILE  58          HG22      ILE  58  -4.392  -1.099  -3.917
  447   3HG2  ILE  58          HG23      ILE  58  -4.498  -1.915  -5.481
  448   1HD1  ILE  58          HD11      ILE  58  -4.055   1.029  -3.375
  449   2HD1  ILE  58          HD12      ILE  58  -3.534   1.700  -4.923
  450   3HD1  ILE  58          HD13      ILE  58  -2.725   2.191  -3.432
  451    H    LEU  59           HN       LEU  59  -4.051  -3.258  -4.371
  452    HA   LEU  59           HA       LEU  59  -3.392  -3.353  -1.538
  453   1HB   LEU  59          HB2       LEU  59  -5.531  -5.078  -2.800
  454   2HB   LEU  59          HB1       LEU  59  -5.478  -4.415  -1.171
  455    HG   LEU  59           HG       LEU  59  -5.716  -2.735  -3.650
  456   1HD1  LEU  59          HD11      LEU  59  -8.116  -2.500  -2.927
  457   2HD1  LEU  59          HD12      LEU  59  -7.828  -3.849  -1.827
  458   3HD1  LEU  59          HD13      LEU  59  -7.677  -4.085  -3.572
  459   1HD2  LEU  59          HD21      LEU  59  -6.216  -2.101  -0.733
  460   2HD2  LEU  59          HD22      LEU  59  -6.400  -0.978  -2.080
  461   3HD2  LEU  59          HD23      LEU  59  -4.808  -1.576  -1.656
  462    H    SER  60           HN       SER  60  -3.695  -5.889  -4.077
  463    HA   SER  60           HA       SER  60  -2.542  -7.891  -2.247
  464   1HB   SER  60          HB2       SER  60  -4.340  -8.374  -3.965
  465   2HB   SER  60          HB1       SER  60  -3.103  -8.185  -5.204
  466    HG   SER  60           HG       SER  60  -2.965  -9.973  -2.998
  467    H    ILE  61           HN       ILE  61  -1.128  -5.480  -3.983
  468    HA   ILE  61           HA       ILE  61   1.020  -6.976  -5.232
  469    HB   ILE  61           HB       ILE  61  -0.004  -4.584  -5.734
  470   1HG1  ILE  61          HG12      ILE  61   1.734  -5.814  -7.047
  471   2HG1  ILE  61          HG11      ILE  61   1.857  -4.068  -7.125
  472   1HG2  ILE  61          HG21      ILE  61   2.351  -3.819  -4.007
  473   2HG2  ILE  61          HG22      ILE  61   0.652  -3.562  -3.616
  474   3HG2  ILE  61          HG23      ILE  61   1.371  -2.741  -4.990
  475   1HD1  ILE  61          HD11      ILE  61   3.663  -4.084  -5.500
  476   2HD1  ILE  61          HD12      ILE  61   4.052  -5.191  -6.817
  477   3HD1  ILE  61          HD13      ILE  61   3.486  -5.825  -5.277
  478    H    LEU  62           HN       LEU  62   1.155  -4.696  -2.457
  479    HA   LEU  62           HA       LEU  62   3.777  -5.323  -1.695
  480   1HB   LEU  62          HB2       LEU  62   1.482  -4.548   0.091
  481   2HB   LEU  62          HB1       LEU  62   3.189  -4.474   0.535
  482    HG   LEU  62           HG       LEU  62   1.994  -3.044  -1.841
  483   1HD1  LEU  62          HD11      LEU  62   2.639  -2.048   0.940
  484   2HD1  LEU  62          HD12      LEU  62   1.059  -2.061   0.154
  485   3HD1  LEU  62          HD13      LEU  62   2.326  -0.983  -0.431
  486   1HD2  LEU  62          HD21      LEU  62   4.740  -3.238  -0.694
  487   2HD2  LEU  62          HD22      LEU  62   4.246  -1.702  -1.399
  488   3HD2  LEU  62          HD23      LEU  62   4.224  -3.167  -2.380
  489    H    LEU  63           HN       LEU  63   1.286  -7.520  -1.777
  490    HA   LEU  63           HA       LEU  63   2.227  -9.070   0.546
  491   1HB   LEU  63          HB2       LEU  63  -0.065  -9.406  -1.386
  492   2HB   LEU  63          HB1       LEU  63   0.292 -10.529  -0.075
  493    HG   LEU  63           HG       LEU  63   0.214  -8.531   1.488
  494   1HD1  LEU  63          HD11      LEU  63  -1.383  -6.703   0.488
  495   2HD1  LEU  63          HD12      LEU  63  -0.663  -7.213  -1.040
  496   3HD1  LEU  63          HD13      LEU  63   0.357  -6.601   0.261
  497   1HD2  LEU  63          HD21      LEU  63  -2.217  -8.615   1.680
  498   2HD2  LEU  63          HD22      LEU  63  -1.613 -10.215   1.252
  499   3HD2  LEU  63          HD23      LEU  63  -2.348  -9.191   0.018
  500    H    GLU  64           HN       GLU  64   1.892  -9.531  -3.030
  501    HA   GLU  64           HA       GLU  64   3.745 -11.869  -2.743
  502   1HB   GLU  64          HB2       GLU  64   1.778 -12.933  -3.332
  503   2HB   GLU  64          HB1       GLU  64   1.119 -11.483  -4.084
  504   1HG   GLU  64          HG2       GLU  64   2.310 -11.833  -6.080
  505   2HG   GLU  64          HG1       GLU  64   3.383 -13.024  -5.344
  506    H    GLU  65           HN       GLU  65   2.536  -9.682  -5.346
  507    HA   GLU  65           HA       GLU  65   4.772 -10.136  -7.025
  508   1HB   GLU  65          HB2       GLU  65   3.369  -7.469  -6.866
  509   2HB   GLU  65          HB1       GLU  65   4.061  -8.254  -8.284
  510   1HG   GLU  65          HG2       GLU  65   2.347 -10.088  -7.994
  511   2HG   GLU  65          HG1       GLU  65   1.587  -9.090  -6.753
  512    H    VAL  66           HN       VAL  66   4.727  -8.886  -4.024
  513    HA   VAL  66           HA       VAL  66   7.394  -7.631  -4.316
  514    HB   VAL  66           HB       VAL  66   4.802  -6.447  -3.479
  515   1HG1  VAL  66          HG11      VAL  66   5.867  -6.284  -1.364
  516   2HG1  VAL  66          HG12      VAL  66   5.974  -4.696  -2.131
  517   3HG1  VAL  66          HG13      VAL  66   7.384  -5.763  -2.102
  518   1HG2  VAL  66          HG21      VAL  66   5.707  -4.467  -4.518
  519   2HG2  VAL  66          HG22      VAL  66   5.898  -5.867  -5.574
  520   3HG2  VAL  66          HG23      VAL  66   7.281  -5.245  -4.674
  521    H    SER  67           HN       SER  67   8.693  -8.627  -2.811
  522    HA   SER  67           HA       SER  67   7.524 -10.244  -0.686
  523   1HB   SER  67          HB2       SER  67   9.727 -10.672  -1.998
  524   2HB   SER  67          HB1       SER  67  10.446  -9.496  -0.903
  525    HG   SER  67           HG       SER  67  10.657 -11.211   0.315
  526    HA   PRO  68           HA       PRO  68   7.207  -7.025   2.361
  527   1HB   PRO  68          HB2       PRO  68   8.325  -8.605   4.518
  528   2HB   PRO  68          HB1       PRO  68   6.632  -8.171   4.215
  529   1HG   PRO  68          HG2       PRO  68   7.939 -10.743   3.791
  530   2HG   PRO  68          HG1       PRO  68   6.224 -10.343   3.618
  531   1HD   PRO  68          HD2       PRO  68   8.046 -10.887   1.508
  532   2HD   PRO  68          HD1       PRO  68   6.403 -10.243   1.345
  533    H    GLU  69           HN       GLU  69  10.285  -8.813   2.148
  534    HA   GLU  69           HA       GLU  69  11.828  -6.811   3.516
  535   1HB   GLU  69          HB2       GLU  69  12.604  -9.164   2.979
  536   2HB   GLU  69          HB1       GLU  69  12.824  -8.639   1.311
  537   1HG   GLU  69          HG2       GLU  69  14.958  -8.403   2.378
  538   2HG   GLU  69          HG1       GLU  69  14.301  -6.774   2.214
  539    H    LEU  70           HN       LEU  70  11.137  -7.320   0.048
  540    HA   LEU  70           HA       LEU  70  12.642  -5.180  -0.998
  541   1HB   LEU  70          HB2       LEU  70  11.610  -6.672  -2.544
  542   2HB   LEU  70          HB1       LEU  70  10.021  -6.450  -1.822
  543    HG   LEU  70           HG       LEU  70   9.929  -4.144  -2.656
  544   1HD1  LEU  70          HD11      LEU  70  12.708  -4.807  -3.677
  545   2HD1  LEU  70          HD12      LEU  70  12.252  -3.502  -2.588
  546   3HD1  LEU  70          HD13      LEU  70  11.766  -3.444  -4.278
  547   1HD2  LEU  70          HD21      LEU  70  10.849  -5.899  -4.944
  548   2HD2  LEU  70          HD22      LEU  70   9.582  -4.672  -4.946
  549   3HD2  LEU  70          HD23      LEU  70   9.329  -6.198  -4.102
  550    H    VAL  71           HN       VAL  71   9.379  -5.209   0.397
  551    HA   VAL  71           HA       VAL  71   8.550  -2.601  -0.082
  552    HB   VAL  71           HB       VAL  71   8.267  -4.007   2.585
  553   1HG1  VAL  71          HG11      VAL  71   6.021  -2.794   2.467
  554   2HG1  VAL  71          HG12      VAL  71   6.701  -1.867   1.129
  555   3HG1  VAL  71          HG13      VAL  71   7.433  -1.774   2.730
  556   1HG2  VAL  71          HG21      VAL  71   7.690  -5.500   0.728
  557   2HG2  VAL  71          HG22      VAL  71   6.666  -4.261   0.033
  558   3HG2  VAL  71          HG23      VAL  71   6.230  -4.998   1.574
  559    H    CYS  72           HN       CYS  72  10.294  -3.567   2.904
  560    HA   CYS  72           HA       CYS  72  10.834  -1.028   3.922
  561   1HB   CYS  72          HB2       CYS  72  11.587  -3.136   5.033
  562   2HB   CYS  72          HB1       CYS  72  12.889  -3.261   3.845
  563    H    SER  73           HN       SER  73  12.222  -2.549   1.099
  564    HA   SER  73           HA       SER  73  14.300  -0.517   0.766
  565   1HB   SER  73          HB2       SER  73  13.688  -3.027  -0.423
  566   2HB   SER  73          HB1       SER  73  13.629  -1.843  -1.725
  567    HG   SER  73           HG       SER  73  15.748  -2.732  -0.201
  568    H    MET  74           HN       MET  74  11.194  -1.249  -0.914
  569    HA   MET  74           HA       MET  74  11.147   1.096  -2.519
  570   1HB   MET  74          HB2       MET  74   8.899  -0.532  -1.296
  571   2HB   MET  74          HB1       MET  74   8.601   0.824  -2.381
  572   1HG   MET  74          HG2       MET  74  10.272  -0.419  -3.978
  573   2HG   MET  74          HG1       MET  74   9.896  -1.823  -2.981
  574   1HE   MET  74          HE1       MET  74   7.746  -2.888  -2.666
  575   2HE   MET  74          HE2       MET  74   6.203  -2.476  -3.417
  576   3HE   MET  74          HE3       MET  74   6.860  -1.451  -2.136
  577    H    LEU  75           HN       LEU  75  10.044   0.573   0.824
  578    HA   LEU  75           HA       LEU  75   8.904   3.165   1.189
  579   1HB   LEU  75          HB2       LEU  75  10.288   1.420   3.257
  580   2HB   LEU  75          HB1       LEU  75   9.195   2.758   3.604
  581    HG   LEU  75           HG       LEU  75   8.460   0.229   2.100
  582   1HD1  LEU  75          HD11      LEU  75   8.023   1.162   4.934
  583   2HD1  LEU  75          HD12      LEU  75   8.648  -0.388   4.370
  584   3HD1  LEU  75          HD13      LEU  75   6.937  -0.006   4.182
  585   1HD2  LEU  75          HD21      LEU  75   6.988   2.786   2.696
  586   2HD2  LEU  75          HD22      LEU  75   6.089   1.271   2.610
  587   3HD2  LEU  75          HD23      LEU  75   7.006   1.828   1.214
  588    H    HIS  76           HN       HIS  76  12.099   2.236   0.617
  589    HA   HIS  76           HA       HIS  76  14.026   3.546   0.455
  590   1HB   HIS  76          HB2       HIS  76  12.004   5.312   0.083
  591   2HB   HIS  76          HB1       HIS  76  12.683   5.984   1.562
  592    HD1  HIS  76           HD1      HIS  76  15.313   6.613   1.436
  593    HD2  HIS  76           HD2      HIS  76  13.446   5.845  -2.210
  594    HE1  HIS  76           HE1      HIS  76  16.843   7.540  -0.358
  595    H    LEU  77           HN       LEU  77  13.023   2.219   3.005
  596    HA   LEU  77           HA       LEU  77  14.349   3.890   5.082
  597   1HB   LEU  77          HB2       LEU  77  12.806   1.283   5.237
  598   2HB   LEU  77          HB1       LEU  77  13.553   2.066   6.626
  599    HG   LEU  77           HG       LEU  77  11.483   3.374   4.833
  600   1HD1  LEU  77          HD11      LEU  77   9.988   3.041   6.845
  601   2HD1  LEU  77          HD12      LEU  77  11.234   1.987   7.516
  602   3HD1  LEU  77          HD13      LEU  77  10.428   1.551   6.008
  603   1HD2  LEU  77          HD21      LEU  77  13.027   4.237   7.273
  604   2HD2  LEU  77          HD22      LEU  77  11.375   4.819   7.074
  605   3HD2  LEU  77          HD23      LEU  77  12.583   5.169   5.844
  606    H    CYS  78           HN       CYS  78  15.470   2.005   2.749
  607    HA   CYS  78           HA       CYS  78  17.878   1.291   4.230
  608   1HB   CYS  78          HB2       CYS  78  16.220  -0.591   4.709
  609   2HB   CYS  78          HB1       CYS  78  16.311  -0.984   2.992
  610    H    SER  79           HN       SER  79  17.218   2.917   1.929
  611    HA   SER  79           HA       SER  79  17.685   1.670  -0.565
  612   1HB   SER  79          HB2       SER  79  18.435   3.892  -1.333
  613   2HB   SER  79          HB1       SER  79  16.990   4.028  -0.335
  614    HG   SER  79           HG       SER  79  19.644   4.732   0.211
  615    H    GLY  80           HN       GLY  80  19.311   0.054  -0.276
  616   1HA   GLY  80          HA2       GLY  80  21.979   0.791   0.666
  617   2HA   GLY  80          HA1       GLY  80  21.512  -0.770  -0.012
  618    H    LEU  81           HN       LEU  81  20.351   0.377  -2.412
  619    HA   LEU  81           HA       LEU  81  22.824   1.161  -3.863
  620   1HB   LEU  81          HB2       LEU  81  22.206  -0.262  -5.565
  621   2HB   LEU  81          HB1       LEU  81  21.313  -1.064  -4.284
  622    HG   LEU  81           HG       LEU  81  20.268   0.889  -6.327
  623   1HD1  LEU  81          HD11      LEU  81  20.487  -1.369  -7.145
  624   2HD1  LEU  81          HD12      LEU  81  18.774  -1.044  -6.875
  625   3HD1  LEU  81          HD13      LEU  81  19.683  -2.009  -5.712
  626   1HD2  LEU  81          HD21      LEU  81  19.185   0.275  -3.658
  627   2HD2  LEU  81          HD22      LEU  81  18.031  -0.045  -4.943
  628   3HD2  LEU  81          HD23      LEU  81  18.734   1.560  -4.775
  629    H    VAL  82           HN       VAL  82  21.970   2.366  -6.042
  630    HA   VAL  82           HA       VAL  82  20.682   4.734  -5.012
  631    HB   VAL  82           HB       VAL  82  20.621   5.337  -7.563
  632   1HG1  VAL  82          HG11      VAL  82  23.258   4.844  -6.147
  633   2HG1  VAL  82          HG12      VAL  82  22.224   6.255  -5.914
  634   3HG1  VAL  82          HG13      VAL  82  22.988   5.970  -7.478
  635   1HG2  VAL  82          HG21      VAL  82  20.960   2.871  -8.154
  636   2HG2  VAL  82          HG22      VAL  82  22.623   3.063  -7.599
  637   3HG2  VAL  82          HG23      VAL  82  22.035   4.007  -8.969
  638    HA   PRO  83           HA       PRO  83  16.515   3.283  -5.318
  639   1HB   PRO  83          HB2       PRO  83  15.731   5.972  -6.301
  640   2HB   PRO  83          HB1       PRO  83  15.169   5.087  -4.871
  641   1HG   PRO  83          HG2       PRO  83  16.974   7.232  -4.817
  642   2HG   PRO  83          HG1       PRO  83  16.745   6.049  -3.521
  643   1HD   PRO  83          HD2       PRO  83  19.052   6.350  -5.306
  644   2HD   PRO  83          HD1       PRO  83  18.875   5.326  -3.859
  645    H    ARG  84           HN       ARG  84  16.023   1.975  -7.059
  646    HA   ARG  84           HA       ARG  84  16.634   2.855  -9.803
  647   1HB   ARG  84          HB2       ARG  84  15.331   0.304  -8.799
  648   2HB   ARG  84          HB1       ARG  84  15.906   0.589 -10.438
  649   1HG   ARG  84          HG2       ARG  84  17.769   0.874  -8.077
  650   2HG   ARG  84          HG1       ARG  84  17.456  -0.706  -8.789
  651   1HD   ARG  84          HD2       ARG  84  18.608   1.720 -10.199
  652   2HD   ARG  84          HD1       ARG  84  19.442   0.215  -9.830
  653    HE   ARG  84           HE       ARG  84  17.304  -0.600 -11.381
  654   1HH1  ARG  84          HH21      ARG  84  19.830   1.733 -11.633
  655   2HH1  ARG  84          HH22      ARG  84  19.918   1.647 -13.362
  656   1HH2  ARG  84          HH11      ARG  84  17.403  -0.724 -13.637
  657   2HH2  ARG  84          HH12      ARG  84  18.545   0.255 -14.495
  Start of MODEL   10
    1   1H    SER   1           HT1      SER   1  25.824   0.681   9.893
    2   2H    SER   1           HT2      SER   1  25.240  -0.647  10.778
    3   3H    SER   1           HT3      SER   1  26.206   0.526  11.539
    4    HA   SER   1           HA       SER   1  24.189   1.244  12.249
    5   1HB   SER   1          HB2       SER   1  24.372   2.427   9.462
    6   2HB   SER   1          HB1       SER   1  23.432   3.088  10.797
    7    HG   SER   1           HG       SER   1  26.248   2.724  10.681
    8    H    ASP   2           HN       ASP   2  23.789  -1.369  11.107
    9    HA   ASP   2           HA       ASP   2  21.519  -1.287   9.296
   10   1HB   ASP   2          HB2       ASP   2  22.627  -3.506  11.044
   11   2HB   ASP   2          HB1       ASP   2  21.346  -3.726   9.852
   12    H    VAL   3           HN       VAL   3  20.436   0.380  10.828
   13    HA   VAL   3           HA       VAL   3  18.990  -0.932  13.071
   14    HB   VAL   3           HB       VAL   3  19.136   1.976  12.340
   15   1HG1  VAL   3          HG11      VAL   3  18.316   2.291  14.664
   16   2HG1  VAL   3          HG12      VAL   3  18.180   0.540  14.826
   17   3HG1  VAL   3          HG13      VAL   3  17.164   1.400  13.670
   18   1HG2  VAL   3          HG21      VAL   3  21.354   1.110  12.941
   19   2HG2  VAL   3          HG22      VAL   3  20.682   0.383  14.399
   20   3HG2  VAL   3          HG23      VAL   3  20.733   2.137  14.232
   21    H    TYR   4           HN       TYR   4  18.211   1.460  10.526
   22    HA   TYR   4           HA       TYR   4  15.384   0.900  10.671
   23   1HB   TYR   4          HB2       TYR   4  17.176   2.483   8.854
   24   2HB   TYR   4          HB1       TYR   4  15.548   2.117   8.290
   25    HD1  TYR   4           HD1      TYR   4  14.488   4.236   8.416
   26    HD2  TYR   4           HD2      TYR   4  16.635   2.727  11.816
   27    HE1  TYR   4           HE1      TYR   4  13.584   6.076   9.806
   28    HE2  TYR   4           HE2      TYR   4  15.734   4.562  13.205
   29    HH   TYR   4           HH       TYR   4  14.225   6.231  13.293
   30    H    CYS   5           HN       CYS   5  17.998  -0.696   9.095
   31    HA   CYS   5           HA       CYS   5  16.493  -1.841   6.906
   32   1HB   CYS   5          HB2       CYS   5  19.043  -1.736   7.134
   33   2HB   CYS   5          HB1       CYS   5  18.898  -3.099   8.242
   34    H    GLU   6           HN       GLU   6  17.289  -2.952  10.193
   35    HA   GLU   6           HA       GLU   6  15.801  -5.447   9.847
   36   1HB   GLU   6          HB2       GLU   6  16.921  -4.126  12.340
   37   2HB   GLU   6          HB1       GLU   6  16.277  -5.767  12.256
   38   1HG   GLU   6          HG2       GLU   6  18.578  -4.776  10.552
   39   2HG   GLU   6          HG1       GLU   6  18.786  -5.649  12.071
   40    H    VAL   7           HN       VAL   7  15.318  -2.444  11.733
   41    HA   VAL   7           HA       VAL   7  12.859  -3.045  12.919
   42    HB   VAL   7           HB       VAL   7  13.737  -0.400  11.721
   43   1HG1  VAL   7          HG11      VAL   7  12.158   0.499  13.508
   44   2HG1  VAL   7          HG12      VAL   7  11.535  -1.144  13.661
   45   3HG1  VAL   7          HG13      VAL   7  11.379  -0.280  12.132
   46   1HG2  VAL   7          HG21      VAL   7  14.671   0.084  13.862
   47   2HG2  VAL   7          HG22      VAL   7  15.209  -1.552  13.486
   48   3HG2  VAL   7          HG23      VAL   7  13.872  -1.300  14.607
   49    H    CYS   8           HN       CYS   8  13.114  -1.138   9.891
   50    HA   CYS   8           HA       CYS   8  10.436  -1.287   9.126
   51   1HB   CYS   8          HB2       CYS   8  11.127  -0.693   6.948
   52   2HB   CYS   8          HB1       CYS   8  12.415  -0.072   7.978
   53    H    GLU   9           HN       GLU   9  13.005  -3.654   8.469
   54    HA   GLU   9           HA       GLU   9  11.455  -5.447   6.873
   55   1HB   GLU   9          HB2       GLU   9  13.903  -5.808   7.130
   56   2HB   GLU   9          HB1       GLU   9  13.653  -6.268   8.823
   57   1HG   GLU   9          HG2       GLU   9  12.390  -8.196   8.203
   58   2HG   GLU   9          HG1       GLU   9  12.266  -7.661   6.527
   59    H    PHE  10           HN       PHE  10  11.705  -5.170  10.393
   60    HA   PHE  10           HA       PHE  10  10.042  -7.509  10.875
   61   1HB   PHE  10          HB2       PHE  10  11.646  -6.807  12.566
   62   2HB   PHE  10          HB1       PHE  10  10.884  -5.221  12.678
   63    HD1  PHE  10           HD1      PHE  10   8.983  -4.866  14.061
   64    HD2  PHE  10           HD2      PHE  10  10.300  -8.865  13.211
   65    HE1  PHE  10           HE1      PHE  10   7.396  -5.747  15.751
   66    HE2  PHE  10           HE2      PHE  10   8.714  -9.746  14.901
   67    HZ   PHE  10           HZ       PHE  10   7.262  -8.187  16.171
   68    H    LEU  11           HN       LEU  11   9.421  -4.191  10.117
   69    HA   LEU  11           HA       LEU  11   6.691  -4.254  11.250
   70   1HB   LEU  11          HB2       LEU  11   8.141  -2.160   9.609
   71   2HB   LEU  11          HB1       LEU  11   6.535  -1.957  10.305
   72    HG   LEU  11           HG       LEU  11   9.036  -2.574  11.910
   73   1HD1  LEU  11          HD11      LEU  11   7.571   0.031  11.403
   74   2HD1  LEU  11          HD12      LEU  11   9.234  -0.355  10.962
   75   3HD1  LEU  11          HD13      LEU  11   8.790  -0.185  12.660
   76   1HD2  LEU  11          HD21      LEU  11   7.359  -1.605  13.735
   77   2HD2  LEU  11          HD22      LEU  11   7.277  -3.299  13.267
   78   3HD2  LEU  11          HD23      LEU  11   6.130  -2.143  12.590
   79    H    VAL  12           HN       VAL  12   8.107  -3.834   7.974
   80    HA   VAL  12           HA       VAL  12   5.603  -3.994   6.627
   81    HB   VAL  12           HB       VAL  12   6.914  -4.426   4.607
   82   1HG1  VAL  12          HG11      VAL  12   8.185  -2.444   6.517
   83   2HG1  VAL  12          HG12      VAL  12   6.816  -2.136   5.448
   84   3HG1  VAL  12          HG13      VAL  12   8.415  -2.443   4.768
   85   1HG2  VAL  12          HG21      VAL  12   8.591  -5.958   5.137
   86   2HG2  VAL  12          HG22      VAL  12   9.032  -5.128   6.628
   87   3HG2  VAL  12          HG23      VAL  12   9.519  -4.464   5.068
   88    H    LYS  13           HN       LYS  13   7.703  -6.491   7.898
   89    HA   LYS  13           HA       LYS  13   6.373  -8.674   6.441
   90   1HB   LYS  13          HB2       LYS  13   8.722  -8.848   7.064
   91   2HB   LYS  13          HB1       LYS  13   8.302  -8.683   8.767
   92   1HG   LYS  13          HG2       LYS  13   6.704 -10.833   7.670
   93   2HG   LYS  13          HG1       LYS  13   8.367 -11.096   7.168
   94   1HD   LYS  13          HD2       LYS  13   8.168 -12.207   9.256
   95   2HD   LYS  13          HD1       LYS  13   9.014 -10.706   9.623
   96   1HE   LYS  13          HE2       LYS  13   6.962  -9.678  10.413
   97   2HE   LYS  13          HE1       LYS  13   6.015 -11.070   9.891
   98   1HZ   LYS  13          HZ1       LYS  13   6.523 -11.082  12.284
   99   2HZ   LYS  13          HZ2       LYS  13   8.180 -11.173  11.919
  100   3HZ   LYS  13          HZ3       LYS  13   7.139 -12.441  11.479
  101    H    GLU  14           HN       GLU  14   6.235  -7.227   9.694
  102    HA   GLU  14           HA       GLU  14   4.418  -9.227  10.758
  103   1HB   GLU  14          HB2       GLU  14   5.884  -7.678  12.136
  104   2HB   GLU  14          HB1       GLU  14   4.770  -6.375  11.721
  105   1HG   GLU  14          HG2       GLU  14   4.050  -7.240  13.841
  106   2HG   GLU  14          HG1       GLU  14   2.902  -7.832  12.639
  107    H    VAL  15           HN       VAL  15   3.940  -5.860   9.649
  108    HA   VAL  15           HA       VAL  15   1.134  -5.775   9.864
  109    HB   VAL  15           HB       VAL  15   2.663  -3.865   9.187
  110   1HG1  VAL  15          HG11      VAL  15   3.785  -5.253   7.381
  111   2HG1  VAL  15          HG12      VAL  15   3.300  -3.631   6.890
  112   3HG1  VAL  15          HG13      VAL  15   2.331  -5.025   6.411
  113   1HG2  VAL  15          HG21      VAL  15   0.947  -2.918   7.569
  114   2HG2  VAL  15          HG22      VAL  15   0.288  -3.535   9.084
  115   3HG2  VAL  15          HG23      VAL  15   0.156  -4.494   7.610
  116    H    THR  16           HN       THR  16   3.185  -7.189   7.350
  117    HA   THR  16           HA       THR  16   1.172  -7.873   5.500
  118    HB   THR  16           HB       THR  16   3.029 -10.057   5.620
  119    HG1  THR  16           HG1      THR  16   4.457  -7.689   5.711
  120   1HG2  THR  16          HG21      THR  16   2.254  -9.098   3.545
  121   2HG2  THR  16          HG22      THR  16   4.008  -8.863   3.638
  122   3HG2  THR  16          HG23      THR  16   2.919  -7.517   3.982
  123    H    LYS  17           HN       LYS  17   2.355  -9.711   8.344
  124    HA   LYS  17           HA       LYS  17   0.790 -12.000   8.116
  125   1HB   LYS  17          HB2       LYS  17   2.093 -10.561  10.314
  126   2HB   LYS  17          HB1       LYS  17   0.631 -11.366  10.870
  127   1HG   LYS  17          HG2       LYS  17   1.433 -13.496   9.962
  128   2HG   LYS  17          HG1       LYS  17   2.865 -12.700   9.307
  129   1HD   LYS  17          HD2       LYS  17   3.544 -12.052  11.599
  130   2HD   LYS  17          HD1       LYS  17   2.127 -12.883  12.244
  131   1HE   LYS  17          HE2       LYS  17   4.360 -14.177  10.651
  132   2HE   LYS  17          HE1       LYS  17   4.118 -14.325  12.392
  133   1HZ   LYS  17          HZ1       LYS  17   2.891 -15.776  10.305
  134   2HZ   LYS  17          HZ2       LYS  17   1.701 -14.951  11.193
  135   3HZ   LYS  17          HZ3       LYS  17   2.769 -16.013  11.980
  136    H    LEU  18           HN       LEU  18  -0.251  -8.761   9.064
  137    HA   LEU  18           HA       LEU  18  -3.028  -9.763   9.503
  138   1HB   LEU  18          HB2       LEU  18  -2.721  -6.823   9.559
  139   2HB   LEU  18          HB1       LEU  18  -3.369  -7.901  10.784
  140    HG   LEU  18           HG       LEU  18  -0.406  -7.523  10.280
  141   1HD1  LEU  18          HD11      LEU  18  -1.381  -5.435  11.031
  142   2HD1  LEU  18          HD12      LEU  18  -0.497  -6.174  12.370
  143   3HD1  LEU  18          HD13      LEU  18  -2.259  -6.268  12.315
  144   1HD2  LEU  18          HD21      LEU  18  -0.107  -8.827  12.242
  145   2HD2  LEU  18          HD22      LEU  18  -1.396  -9.678  11.386
  146   3HD2  LEU  18          HD23      LEU  18  -1.784  -8.617  12.741
  147    H    ILE  19           HN       ILE  19  -1.373  -7.305   7.505
  148    HA   ILE  19           HA       ILE  19  -3.499  -6.713   5.777
  149    HB   ILE  19           HB       ILE  19  -0.564  -6.530   5.808
  150   1HG1  ILE  19          HG12      ILE  19  -2.547  -4.626   4.575
  151   2HG1  ILE  19          HG11      ILE  19  -2.223  -4.684   6.307
  152   1HG2  ILE  19          HG21      ILE  19  -0.409  -5.899   3.374
  153   2HG2  ILE  19          HG22      ILE  19  -1.979  -6.670   3.152
  154   3HG2  ILE  19          HG23      ILE  19  -0.595  -7.621   3.694
  155   1HD1  ILE  19          HD11      ILE  19  -0.564  -3.601   4.119
  156   2HD1  ILE  19          HD12      ILE  19   0.342  -4.572   5.283
  157   3HD1  ILE  19          HD13      ILE  19  -0.591  -3.174   5.827
  158    H    ASP  20           HN       ASP  20  -1.529  -9.547   6.081
  159    HA   ASP  20           HA       ASP  20  -1.594 -10.755   3.590
  160   1HB   ASP  20          HB2       ASP  20  -0.543 -11.884   5.454
  161   2HB   ASP  20          HB1       ASP  20  -2.078 -12.012   6.312
  162    H    ASN  21           HN       ASN  21  -4.170 -11.139   6.088
  163    HA   ASN  21           HA       ASN  21  -6.207 -11.017   3.986
  164   1HB   ASN  21          HB2       ASN  21  -6.001 -13.489   5.710
  165   2HB   ASN  21          HB1       ASN  21  -7.190 -13.177   4.441
  166   1HD2  ASN  21          HD21      ASN  21  -6.179 -12.780   2.176
  167   2HD2  ASN  21          HD22      ASN  21  -4.811 -13.701   1.772
  168    H    ASN  22           HN       ASN  22  -5.798  -9.243   6.058
  169    HA   ASN  22           HA       ASN  22  -7.921  -9.891   8.061
  170   1HB   ASN  22          HB2       ASN  22  -5.843  -7.684   7.950
  171   2HB   ASN  22          HB1       ASN  22  -7.074  -7.828   9.205
  172   1HD2  ASN  22          HD21      ASN  22  -5.398 -10.600   7.685
  173   2HD2  ASN  22          HD22      ASN  22  -4.573 -11.076   9.103
  174    H    LYS  23           HN       LYS  23  -6.897  -7.426   5.724
  175    HA   LYS  23           HA       LYS  23  -9.703  -6.370   5.653
  176   1HB   LYS  23          HB2       LYS  23  -8.791  -4.296   4.834
  177   2HB   LYS  23          HB1       LYS  23  -7.873  -4.757   6.263
  178   1HG   LYS  23          HG2       LYS  23  -6.065  -4.327   4.907
  179   2HG   LYS  23          HG1       LYS  23  -6.351  -5.976   4.361
  180   1HD   LYS  23          HD2       LYS  23  -8.031  -4.758   2.671
  181   2HD   LYS  23          HD1       LYS  23  -6.993  -3.374   2.998
  182   1HE   LYS  23          HE2       LYS  23  -6.025  -6.078   2.026
  183   2HE   LYS  23          HE1       LYS  23  -6.217  -4.642   1.021
  184   1HZ   LYS  23          HZ1       LYS  23  -4.126  -5.316   2.870
  185   2HZ   LYS  23          HZ2       LYS  23  -4.737  -3.748   3.103
  186   3HZ   LYS  23          HZ3       LYS  23  -4.121  -4.206   1.588
  187    H    THR  24           HN       THR  24 -10.837  -7.129   3.943
  188    HA   THR  24           HA       THR  24  -9.444  -8.411   1.707
  189    HB   THR  24           HB       THR  24 -11.752  -8.873   0.888
  190    HG1  THR  24           HG1      THR  24 -12.479  -6.827   2.005
  191   1HG2  THR  24          HG21      THR  24 -10.523 -10.259   2.656
  192   2HG2  THR  24          HG22      THR  24 -12.276 -10.449   2.593
  193   3HG2  THR  24          HG23      THR  24 -11.544  -9.447   3.845
  194    H    GLU  25           HN       GLU  25 -10.900  -7.818  -0.505
  195    HA   GLU  25           HA       GLU  25 -10.161  -4.965  -1.004
  196   1HB   GLU  25          HB2       GLU  25 -10.855  -7.078  -3.052
  197   2HB   GLU  25          HB1       GLU  25 -10.039  -5.538  -3.324
  198   1HG   GLU  25          HG2       GLU  25  -8.157  -6.320  -1.886
  199   2HG   GLU  25          HG1       GLU  25  -8.957  -7.884  -1.732
  200    H    LYS  26           HN       LYS  26 -12.908  -6.971  -0.570
  201    HA   LYS  26           HA       LYS  26 -14.712  -5.434  -2.264
  202   1HB   LYS  26          HB2       LYS  26 -15.236  -7.344   0.041
  203   2HB   LYS  26          HB1       LYS  26 -16.491  -6.660  -0.991
  204   1HG   LYS  26          HG2       LYS  26 -15.804  -7.871  -2.873
  205   2HG   LYS  26          HG1       LYS  26 -14.170  -8.109  -2.259
  206   1HD   LYS  26          HD2       LYS  26 -16.486  -9.329  -0.764
  207   2HD   LYS  26          HD1       LYS  26 -15.901 -10.111  -2.229
  208   1HE   LYS  26          HE2       LYS  26 -13.622 -10.197  -1.283
  209   2HE   LYS  26          HE1       LYS  26 -14.200  -9.417   0.189
  210   1HZ   LYS  26          HZ1       LYS  26 -15.253 -11.984  -0.862
  211   2HZ   LYS  26          HZ2       LYS  26 -15.632 -11.258   0.626
  212   3HZ   LYS  26          HZ3       LYS  26 -14.070 -11.864   0.347
  213    H    GLU  27           HN       GLU  27 -13.675  -5.493   1.085
  214    HA   GLU  27           HA       GLU  27 -15.505  -3.470   1.997
  215   1HB   GLU  27          HB2       GLU  27 -14.530  -4.879   3.667
  216   2HB   GLU  27          HB1       GLU  27 -12.900  -4.576   3.069
  217   1HG   GLU  27          HG2       GLU  27 -12.866  -2.374   3.927
  218   2HG   GLU  27          HG1       GLU  27 -14.617  -2.333   4.131
  219    H    ILE  28           HN       ILE  28 -12.410  -3.491   0.395
  220    HA   ILE  28           HA       ILE  28 -11.814  -0.695   0.881
  221    HB   ILE  28           HB       ILE  28 -10.691  -2.687  -1.101
  222   1HG1  ILE  28          HG12      ILE  28 -10.520  -3.185   1.438
  223   2HG1  ILE  28          HG11      ILE  28  -9.044  -3.255   0.483
  224   1HG2  ILE  28          HG21      ILE  28  -8.684  -1.033  -0.869
  225   2HG2  ILE  28          HG22      ILE  28  -9.912   0.108  -0.323
  226   3HG2  ILE  28          HG23      ILE  28 -10.033  -0.621  -1.927
  227   1HD1  ILE  28          HD11      ILE  28  -8.864  -2.011   2.684
  228   2HD1  ILE  28          HD12      ILE  28  -9.902  -0.780   1.987
  229   3HD1  ILE  28          HD13      ILE  28  -8.332  -1.112   1.268
  230    H    LEU  29           HN       LEU  29 -12.143  -2.377  -2.241
  231    HA   LEU  29           HA       LEU  29 -12.631  -0.179  -3.834
  232   1HB   LEU  29          HB2       LEU  29 -13.957  -2.899  -4.022
  233   2HB   LEU  29          HB1       LEU  29 -13.957  -1.705  -5.318
  234    HG   LEU  29           HG       LEU  29 -11.368  -2.628  -4.056
  235   1HD1  LEU  29          HD11      LEU  29 -12.977  -3.978  -6.225
  236   2HD1  LEU  29          HD12      LEU  29 -12.315  -4.690  -4.752
  237   3HD1  LEU  29          HD13      LEU  29 -11.234  -4.208  -6.062
  238   1HD2  LEU  29          HD21      LEU  29 -11.055  -0.719  -5.451
  239   2HD2  LEU  29          HD22      LEU  29 -12.161  -1.328  -6.683
  240   3HD2  LEU  29          HD23      LEU  29 -10.591  -2.091  -6.454
  241    H    ASP  30           HN       ASP  30 -14.698  -1.465  -1.394
  242    HA   ASP  30           HA       ASP  30 -17.147  -0.195  -2.364
  243   1HB   ASP  30          HB2       ASP  30 -16.296  -1.433   0.262
  244   2HB   ASP  30          HB1       ASP  30 -17.817  -0.548   0.134
  245    H    ALA  31           HN       ALA  31 -14.773   0.480   0.210
  246    HA   ALA  31           HA       ALA  31 -15.768   2.958   1.071
  247   1HB   ALA  31          HB1       ALA  31 -12.833   2.398   0.741
  248   2HB   ALA  31          HB2       ALA  31 -13.806   1.629   1.995
  249   3HB   ALA  31          HB3       ALA  31 -13.634   3.383   1.969
  250    H    PHE  32           HN       PHE  32 -13.729   2.199  -1.714
  251    HA   PHE  32           HA       PHE  32 -13.318   4.937  -2.511
  252   1HB   PHE  32          HB2       PHE  32 -13.447   2.484  -4.291
  253   2HB   PHE  32          HB1       PHE  32 -12.657   4.009  -4.658
  254    HD1  PHE  32           HD1      PHE  32 -11.137   1.607  -4.976
  255    HD2  PHE  32           HD2      PHE  32 -11.762   3.840  -1.351
  256    HE1  PHE  32           HE1      PHE  32  -9.006   0.747  -4.064
  257    HE2  PHE  32           HE2      PHE  32  -9.644   2.975  -0.456
  258    HZ   PHE  32           HZ       PHE  32  -8.260   1.431  -1.805
  259    H    ASP  33           HN       ASP  33 -15.965   2.668  -2.890
  260    HA   ASP  33           HA       ASP  33 -17.317   4.384  -4.866
  261   1HB   ASP  33          HB2       ASP  33 -18.262   1.946  -3.316
  262   2HB   ASP  33          HB1       ASP  33 -19.209   2.769  -4.556
  263    H    LYS  34           HN       LYS  34 -16.682   4.647  -1.684
  264    HA   LYS  34           HA       LYS  34 -19.245   6.101  -1.071
  265   1HB   LYS  34          HB2       LYS  34 -17.302   4.666   0.773
  266   2HB   LYS  34          HB1       LYS  34 -18.678   5.620   1.323
  267   1HG   LYS  34          HG2       LYS  34 -20.229   4.027   0.671
  268   2HG   LYS  34          HG1       LYS  34 -19.244   3.454  -0.673
  269   1HD   LYS  34          HD2       LYS  34 -19.509   1.845   1.297
  270   2HD   LYS  34          HD1       LYS  34 -17.858   2.148   0.774
  271   1HE   LYS  34          HE2       LYS  34 -17.332   3.359   2.685
  272   2HE   LYS  34          HE1       LYS  34 -18.989   3.929   2.901
  273   1HZ   LYS  34          HZ1       LYS  34 -18.900   2.385   4.537
  274   2HZ   LYS  34          HZ2       LYS  34 -17.761   1.413   3.734
  275   3HZ   LYS  34          HZ3       LYS  34 -19.394   1.372   3.271
  276    H    MET  35           HN       MET  35 -16.020   5.928   0.344
  277    HA   MET  35           HA       MET  35 -15.807   8.618   1.122
  278   1HB   MET  35          HB2       MET  35 -14.246   7.274   2.146
  279   2HB   MET  35          HB1       MET  35 -14.005   6.318   0.700
  280   1HG   MET  35          HG2       MET  35 -12.630   8.174  -0.273
  281   2HG   MET  35          HG1       MET  35 -12.859   9.083   1.223
  282   1HE   MET  35          HE1       MET  35 -10.577   5.274   0.364
  283   2HE   MET  35          HE2       MET  35 -12.013   5.937  -0.416
  284   3HE   MET  35          HE3       MET  35 -12.181   4.977   1.058
  285    H    CYS  36           HN       CYS  36 -14.525   7.085  -1.872
  286    HA   CYS  36           HA       CYS  36 -13.783   9.749  -2.903
  287   1HB   CYS  36          HB2       CYS  36 -12.341   7.816  -3.423
  288   2HB   CYS  36          HB1       CYS  36 -13.687   7.015  -4.222
  289    H    SER  37           HN       SER  37 -16.642   8.686  -2.347
  290    HA   SER  37           HA       SER  37 -17.863   8.948  -5.034
  291   1HB   SER  37          HB2       SER  37 -18.623   7.305  -3.164
  292   2HB   SER  37          HB1       SER  37 -19.383   8.717  -2.436
  293    HG   SER  37           HG       SER  37 -19.822   8.474  -5.132
  294    H    LYS  38           HN       LYS  38 -17.645  10.668  -1.948
  295    HA   LYS  38           HA       LYS  38 -19.403  12.834  -2.804
  296   1HB   LYS  38          HB2       LYS  38 -18.637  13.930  -0.705
  297   2HB   LYS  38          HB1       LYS  38 -19.200  12.282  -0.423
  298   1HG   LYS  38          HG2       LYS  38 -16.768  11.547  -0.657
  299   2HG   LYS  38          HG1       LYS  38 -16.338  13.256  -0.586
  300   1HD   LYS  38          HD2       LYS  38 -17.679  13.369   1.581
  301   2HD   LYS  38          HD1       LYS  38 -17.721  11.606   1.537
  302   1HE   LYS  38          HE2       LYS  38 -15.834  12.435   2.913
  303   2HE   LYS  38          HE1       LYS  38 -15.265  11.529   1.510
  304   1HZ   LYS  38          HZ1       LYS  38 -14.593  13.438   0.440
  305   2HZ   LYS  38          HZ2       LYS  38 -14.210  13.799   2.055
  306   3HZ   LYS  38          HZ3       LYS  38 -15.611  14.449   1.344
  307    H    LEU  39           HN       LEU  39 -16.059  12.066  -3.146
  308    HA   LEU  39           HA       LEU  39 -14.717  14.454  -3.253
  309   1HB   LEU  39          HB2       LEU  39 -14.354  11.859  -4.407
  310   2HB   LEU  39          HB1       LEU  39 -14.108  12.991  -5.716
  311    HG   LEU  39           HG       LEU  39 -12.614  14.112  -3.596
  312   1HD1  LEU  39          HD11      LEU  39 -11.320  12.395  -2.611
  313   2HD1  LEU  39          HD12      LEU  39 -11.992  11.172  -3.688
  314   3HD1  LEU  39          HD13      LEU  39 -13.001  11.889  -2.429
  315   1HD2  LEU  39          HD21      LEU  39 -10.687  13.527  -4.935
  316   2HD2  LEU  39          HD22      LEU  39 -12.016  13.921  -6.023
  317   3HD2  LEU  39          HD23      LEU  39 -11.585  12.235  -5.735
  318    HA   PRO  40           HA       PRO  40 -16.876  17.023  -6.209
  319   1HB   PRO  40          HB2       PRO  40 -14.402  18.065  -7.375
  320   2HB   PRO  40          HB1       PRO  40 -15.571  18.905  -6.348
  321   1HG   PRO  40          HG2       PRO  40 -12.957  18.004  -5.595
  322   2HG   PRO  40          HG1       PRO  40 -14.185  18.712  -4.534
  323   1HD   PRO  40          HD2       PRO  40 -13.311  15.953  -4.643
  324   2HD   PRO  40          HD1       PRO  40 -14.500  16.677  -3.543
  325    H    LYS  41           HN       LYS  41 -17.610  16.507  -8.237
  326    HA   LYS  41           HA       LYS  41 -17.169  14.260  -9.639
  327   1HB   LYS  41          HB2       LYS  41 -18.732  16.207 -10.167
  328   2HB   LYS  41          HB1       LYS  41 -17.404  16.863 -11.123
  329   1HG   LYS  41          HG2       LYS  41 -17.324  14.783 -12.448
  330   2HG   LYS  41          HG1       LYS  41 -18.644  14.121 -11.484
  331   1HD   LYS  41          HD2       LYS  41 -19.914  14.980 -13.218
  332   2HD   LYS  41          HD1       LYS  41 -19.827  16.433 -12.226
  333   1HE   LYS  41          HE2       LYS  41 -17.918  15.764 -14.491
  334   2HE   LYS  41          HE1       LYS  41 -19.277  16.879 -14.614
  335   1HZ   LYS  41          HZ1       LYS  41 -18.229  18.078 -12.675
  336   2HZ   LYS  41          HZ2       LYS  41 -17.410  18.196 -14.160
  337   3HZ   LYS  41          HZ3       LYS  41 -16.842  17.143 -12.953
  338    H    SER  42           HN       SER  42 -15.433  17.207 -10.578
  339    HA   SER  42           HA       SER  42 -13.741  16.218 -12.522
  340   1HB   SER  42          HB2       SER  42 -13.885  18.591 -11.494
  341   2HB   SER  42          HB1       SER  42 -12.668  18.023 -10.349
  342    HG   SER  42           HG       SER  42 -12.511  18.186 -13.181
  343    H    LEU  43           HN       LEU  43 -12.695  16.474  -9.116
  344    HA   LEU  43           HA       LEU  43 -10.484  14.662  -9.614
  345   1HB   LEU  43          HB2       LEU  43 -11.601  15.919  -7.100
  346   2HB   LEU  43          HB1       LEU  43 -10.197  14.852  -7.090
  347    HG   LEU  43           HG       LEU  43 -10.266  17.211  -8.971
  348   1HD1  LEU  43          HD11      LEU  43  -9.089  18.527  -7.179
  349   2HD1  LEU  43          HD12      LEU  43  -9.551  17.275  -6.027
  350   3HD1  LEU  43          HD13      LEU  43 -10.794  18.226  -6.841
  351   1HD2  LEU  43          HD21      LEU  43  -8.426  15.639  -9.253
  352   2HD2  LEU  43          HD22      LEU  43  -8.074  15.679  -7.527
  353   3HD2  LEU  43          HD23      LEU  43  -7.790  17.107  -8.517
  354    H    SER  44           HN       SER  44 -13.719  14.019  -9.329
  355    HA   SER  44           HA       SER  44 -13.390  11.578  -7.678
  356   1HB   SER  44          HB2       SER  44 -15.715  11.449  -7.598
  357   2HB   SER  44          HB1       SER  44 -15.503  13.188  -7.753
  358    HG   SER  44           HG       SER  44 -16.806  11.574  -9.362
  359    H    GLU  45           HN       GLU  45 -13.729  12.676 -10.992
  360    HA   GLU  45           HA       GLU  45 -14.088   9.981 -12.015
  361   1HB   GLU  45          HB2       GLU  45 -13.631  11.059 -14.256
  362   2HB   GLU  45          HB1       GLU  45 -15.004  11.734 -13.382
  363   1HG   GLU  45          HG2       GLU  45 -13.813  13.670 -12.758
  364   2HG   GLU  45          HG1       GLU  45 -12.250  12.932 -13.110
  365    H    GLU  46           HN       GLU  46 -11.493  12.120 -11.203
  366    HA   GLU  46           HA       GLU  46  -9.458  10.514 -12.602
  367   1HB   GLU  46          HB2       GLU  46  -9.361  12.938 -10.798
  368   2HB   GLU  46          HB1       GLU  46  -7.894  12.092 -11.290
  369   1HG   GLU  46          HG2       GLU  46  -8.566  12.398 -13.677
  370   2HG   GLU  46          HG1       GLU  46  -9.948  13.350 -13.133
  371    H    CYS  47           HN       CYS  47 -10.881  10.796  -9.417
  372    HA   CYS  47           HA       CYS  47  -8.783   9.216  -8.107
  373   1HB   CYS  47          HB2       CYS  47  -9.796  10.676  -6.584
  374   2HB   CYS  47          HB1       CYS  47 -11.392  10.453  -7.285
  375    H    GLN  48           HN       GLN  48 -11.764   8.626  -9.805
  376    HA   GLN  48           HA       GLN  48 -11.965   5.855  -8.779
  377   1HB   GLN  48          HB2       GLN  48 -13.642   7.560 -10.635
  378   2HB   GLN  48          HB1       GLN  48 -13.898   5.819 -10.501
  379   1HG   GLN  48          HG2       GLN  48 -13.835   7.627  -8.079
  380   2HG   GLN  48          HG1       GLN  48 -15.324   7.292  -8.963
  381   1HE2  GLN  48          HE21      GLN  48 -13.159   6.062  -6.571
  382   2HE2  GLN  48          HE22      GLN  48 -13.862   4.526  -6.408
  383    H    GLU  49           HN       GLU  49 -10.808   7.743 -11.439
  384    HA   GLU  49           HA       GLU  49 -10.574   5.602 -13.332
  385   1HB   GLU  49          HB2       GLU  49 -10.517   7.904 -14.114
  386   2HB   GLU  49          HB1       GLU  49  -9.116   8.248 -13.097
  387   1HG   GLU  49          HG2       GLU  49  -7.704   6.828 -14.394
  388   2HG   GLU  49          HG1       GLU  49  -9.078   6.117 -15.239
  389    H    VAL  50           HN       VAL  50  -8.285   7.144 -11.061
  390    HA   VAL  50           HA       VAL  50  -6.109   5.399 -11.692
  391    HB   VAL  50           HB       VAL  50  -5.902   7.555 -10.389
  392   1HG1  VAL  50          HG11      VAL  50  -6.462   7.621  -8.080
  393   2HG1  VAL  50          HG12      VAL  50  -6.728   5.878  -8.016
  394   3HG1  VAL  50          HG13      VAL  50  -7.872   6.914  -8.869
  395   1HG2  VAL  50          HG21      VAL  50  -4.188   5.618 -10.495
  396   2HG2  VAL  50          HG22      VAL  50  -4.782   5.175  -8.894
  397   3HG2  VAL  50          HG23      VAL  50  -4.023   6.746  -9.145
  398    H    VAL  51           HN       VAL  51  -8.657   5.261  -9.208
  399    HA   VAL  51           HA       VAL  51  -7.954   3.065  -7.665
  400    HB   VAL  51           HB       VAL  51 -10.574   3.988  -8.854
  401   1HG1  VAL  51          HG11      VAL  51 -10.170   1.499  -7.194
  402   2HG1  VAL  51          HG12      VAL  51 -10.981   1.635  -8.752
  403   3HG1  VAL  51          HG13      VAL  51 -11.717   2.331  -7.310
  404   1HG2  VAL  51          HG21      VAL  51  -9.916   3.673  -5.929
  405   2HG2  VAL  51          HG22      VAL  51 -11.002   4.824  -6.708
  406   3HG2  VAL  51          HG23      VAL  51  -9.257   5.032  -6.835
  407    H    ASP  52           HN       ASP  52  -9.855   2.707 -10.704
  408    HA   ASP  52           HA       ASP  52  -9.609  -0.063 -11.007
  409   1HB   ASP  52          HB2       ASP  52 -10.909   1.410 -12.546
  410   2HB   ASP  52          HB1       ASP  52  -9.392   1.993 -13.233
  411    H    THR  53           HN       THR  53  -7.247   2.488 -11.666
  412    HA   THR  53           HA       THR  53  -5.279   0.603 -12.699
  413    HB   THR  53           HB       THR  53  -4.966   3.493 -12.028
  414    HG1  THR  53           HG1      THR  53  -6.357   2.559 -13.854
  415   1HG2  THR  53          HG21      THR  53  -2.883   3.379 -13.254
  416   2HG2  THR  53          HG22      THR  53  -3.181   1.691 -13.663
  417   3HG2  THR  53          HG23      THR  53  -2.837   2.146 -11.997
  418    H    TYR  54           HN       TYR  54  -6.169   1.936  -9.664
  419    HA   TYR  54           HA       TYR  54  -3.955   0.392  -8.365
  420   1HB   TYR  54          HB2       TYR  54  -4.966   3.154  -7.663
  421   2HB   TYR  54          HB1       TYR  54  -4.003   2.170  -6.565
  422    HD1  TYR  54           HD1      TYR  54  -4.006   3.372 -10.068
  423    HD2  TYR  54           HD2      TYR  54  -1.666   2.354  -6.654
  424    HE1  TYR  54           HE1      TYR  54  -2.005   4.205 -11.240
  425    HE2  TYR  54           HE2      TYR  54   0.377   3.164  -7.806
  426    HH   TYR  54           HH       TYR  54   0.730   5.016  -9.834
  427    H    GLY  55           HN       GLY  55  -5.931  -1.152  -8.403
  428   1HA   GLY  55          HA2       GLY  55  -7.503  -0.726  -5.898
  429   2HA   GLY  55          HA1       GLY  55  -8.340  -1.155  -7.390
  430    H    SER  56           HN       SER  56  -6.883  -3.128  -8.494
  431    HA   SER  56           HA       SER  56  -7.168  -5.294  -6.488
  432   1HB   SER  56          HB2       SER  56  -7.402  -6.733  -8.300
  433   2HB   SER  56          HB1       SER  56  -7.957  -5.231  -9.032
  434    HG   SER  56           HG       SER  56  -5.966  -4.969  -9.966
  435    H    SER  57           HN       SER  57  -4.670  -3.494  -8.081
  436    HA   SER  57           HA       SER  57  -2.583  -5.498  -7.475
  437   1HB   SER  57          HB2       SER  57  -2.399  -2.706  -8.658
  438   2HB   SER  57          HB1       SER  57  -1.025  -3.787  -8.420
  439    HG   SER  57           HG       SER  57  -1.719  -5.032 -10.013
  440    H    ILE  58           HN       ILE  58  -2.807  -2.002  -6.827
  441    HA   ILE  58           HA       ILE  58  -1.098  -1.530  -4.803
  442    HB   ILE  58           HB       ILE  58  -2.831   0.030  -5.615
  443   1HG1  ILE  58          HG12      ILE  58  -2.607  -0.320  -2.613
  444   2HG1  ILE  58          HG11      ILE  58  -1.647   0.752  -3.642
  445   1HG2  ILE  58          HG21      ILE  58  -4.739  -1.103  -3.627
  446   2HG2  ILE  58          HG22      ILE  58  -4.675  -1.777  -5.265
  447   3HG2  ILE  58          HG23      ILE  58  -5.071  -0.079  -5.011
  448   1HD1  ILE  58          HD11      ILE  58  -3.898   1.867  -4.268
  449   2HD1  ILE  58          HD12      ILE  58  -3.274   2.179  -2.647
  450   3HD1  ILE  58          HD13      ILE  58  -4.567   0.998  -2.884
  451    H    LEU  59           HN       LEU  59  -4.217  -3.156  -4.268
  452    HA   LEU  59           HA       LEU  59  -3.590  -3.657  -1.467
  453   1HB   LEU  59          HB2       LEU  59  -5.690  -5.262  -2.921
  454   2HB   LEU  59          HB1       LEU  59  -5.679  -4.702  -1.253
  455    HG   LEU  59           HG       LEU  59  -5.887  -2.864  -3.614
  456   1HD1  LEU  59          HD11      LEU  59  -7.794  -4.419  -3.568
  457   2HD1  LEU  59          HD12      LEU  59  -8.291  -2.772  -3.168
  458   3HD1  LEU  59          HD13      LEU  59  -8.098  -3.970  -1.887
  459   1HD2  LEU  59          HD21      LEU  59  -5.087  -1.893  -1.448
  460   2HD2  LEU  59          HD22      LEU  59  -6.581  -2.452  -0.699
  461   3HD2  LEU  59          HD23      LEU  59  -6.632  -1.229  -1.969
  462    H    SER  60           HN       SER  60  -3.470  -5.578  -4.466
  463    HA   SER  60           HA       SER  60  -2.521  -7.948  -2.939
  464   1HB   SER  60          HB2       SER  60  -4.202  -8.118  -4.817
  465   2HB   SER  60          HB1       SER  60  -2.909  -7.668  -5.925
  466    HG   SER  60           HG       SER  60  -3.069  -9.929  -4.220
  467    H    ILE  61           HN       ILE  61  -1.033  -5.252  -4.105
  468    HA   ILE  61           HA       ILE  61   1.224  -6.535  -5.422
  469    HB   ILE  61           HB       ILE  61   0.175  -4.077  -5.629
  470   1HG1  ILE  61          HG12      ILE  61   1.892  -5.094  -7.079
  471   2HG1  ILE  61          HG11      ILE  61   2.162  -3.382  -6.819
  472   1HG2  ILE  61          HG21      ILE  61   0.804  -3.357  -3.364
  473   2HG2  ILE  61          HG22      ILE  61   1.567  -2.378  -4.607
  474   3HG2  ILE  61          HG23      ILE  61   2.504  -3.604  -3.768
  475   1HD1  ILE  61          HD11      ILE  61   3.552  -5.622  -5.331
  476   2HD1  ILE  61          HD12      ILE  61   3.861  -3.900  -5.128
  477   3HD1  ILE  61          HD13      ILE  61   4.250  -4.695  -6.653
  478    H    LEU  62           HN       LEU  62   1.091  -4.636  -2.370
  479    HA   LEU  62           HA       LEU  62   3.662  -5.541  -1.512
  480   1HB   LEU  62          HB2       LEU  62   1.331  -4.518   0.113
  481   2HB   LEU  62          HB1       LEU  62   2.961  -4.758   0.744
  482    HG   LEU  62           HG       LEU  62   2.282  -2.985  -1.604
  483   1HD1  LEU  62          HD11      LEU  62   1.346  -1.898   0.276
  484   2HD1  LEU  62          HD12      LEU  62   2.933  -1.156   0.083
  485   3HD1  LEU  62          HD13      LEU  62   2.681  -2.386   1.320
  486   1HD2  LEU  62          HD21      LEU  62   4.481  -3.404  -1.988
  487   2HD2  LEU  62          HD22      LEU  62   4.827  -3.801  -0.302
  488   3HD2  LEU  62          HD23      LEU  62   4.690  -2.116  -0.803
  489    H    LEU  63           HN       LEU  63   0.819  -7.252  -1.852
  490    HA   LEU  63           HA       LEU  63   1.169  -9.031   0.429
  491   1HB   LEU  63          HB2       LEU  63  -0.577  -9.043  -2.033
  492   2HB   LEU  63          HB1       LEU  63  -0.634 -10.315  -0.819
  493    HG   LEU  63           HG       LEU  63  -2.314  -8.324  -0.667
  494   1HD1  LEU  63          HD11      LEU  63  -2.017 -10.084   1.050
  495   2HD1  LEU  63          HD12      LEU  63  -2.384  -8.515   1.764
  496   3HD1  LEU  63          HD13      LEU  63  -0.731  -9.125   1.782
  497   1HD2  LEU  63          HD21      LEU  63  -0.606  -6.517  -0.827
  498   2HD2  LEU  63          HD22      LEU  63   0.040  -7.035   0.733
  499   3HD2  LEU  63          HD23      LEU  63  -1.597  -6.406   0.623
  500    H    GLU  64           HN       GLU  64   1.524  -9.395  -3.147
  501    HA   GLU  64           HA       GLU  64   3.426 -11.652  -2.597
  502   1HB   GLU  64          HB2       GLU  64   1.260 -11.530  -4.703
  503   2HB   GLU  64          HB1       GLU  64   2.448 -12.825  -4.545
  504   1HG   GLU  64          HG2       GLU  64   1.607 -13.353  -2.296
  505   2HG   GLU  64          HG1       GLU  64   0.446 -12.030  -2.408
  506    H    GLU  65           HN       GLU  65   2.276  -9.646  -5.351
  507    HA   GLU  65           HA       GLU  65   4.480 -10.048  -7.007
  508   1HB   GLU  65          HB2       GLU  65   3.060  -7.402  -6.620
  509   2HB   GLU  65          HB1       GLU  65   3.956  -7.903  -8.052
  510   1HG   GLU  65          HG2       GLU  65   1.534  -9.352  -6.960
  511   2HG   GLU  65          HG1       GLU  65   1.475  -8.182  -8.279
  512    H    VAL  66           HN       VAL  66   4.388  -8.656  -4.007
  513    HA   VAL  66           HA       VAL  66   7.226  -7.843  -4.168
  514    HB   VAL  66           HB       VAL  66   4.836  -6.186  -3.502
  515   1HG1  VAL  66          HG11      VAL  66   6.424  -4.536  -2.410
  516   2HG1  VAL  66          HG12      VAL  66   7.536  -5.895  -2.231
  517   3HG1  VAL  66          HG13      VAL  66   5.953  -5.938  -1.452
  518   1HG2  VAL  66          HG21      VAL  66   5.893  -6.018  -5.671
  519   2HG2  VAL  66          HG22      VAL  66   7.430  -5.612  -4.906
  520   3HG2  VAL  66          HG23      VAL  66   6.062  -4.506  -4.775
  521    H    SER  67           HN       SER  67   8.250  -8.905  -2.540
  522    HA   SER  67           HA       SER  67   6.740 -10.083  -0.330
  523   1HB   SER  67          HB2       SER  67   9.583 -10.127  -1.275
  524   2HB   SER  67          HB1       SER  67   9.287 -10.530   0.411
  525    HG   SER  67           HG       SER  67   8.182 -11.742  -1.905
  526    HA   PRO  68           HA       PRO  68   7.017  -6.712   2.505
  527   1HB   PRO  68          HB2       PRO  68   7.983  -8.142   4.792
  528   2HB   PRO  68          HB1       PRO  68   6.302  -7.751   4.388
  529   1HG   PRO  68          HG2       PRO  68   7.712 -10.336   4.146
  530   2HG   PRO  68          HG1       PRO  68   5.972 -10.012   4.130
  531   1HD   PRO  68          HD2       PRO  68   7.508 -10.707   1.886
  532   2HD   PRO  68          HD1       PRO  68   5.900  -9.962   1.839
  533    H    GLU  69           HN       GLU  69   9.833  -8.914   2.589
  534    HA   GLU  69           HA       GLU  69  11.663  -7.009   3.671
  535   1HB   GLU  69          HB2       GLU  69  12.088  -9.482   3.467
  536   2HB   GLU  69          HB1       GLU  69  12.321  -9.248   1.735
  537   1HG   GLU  69          HG2       GLU  69  14.187  -7.745   2.136
  538   2HG   GLU  69          HG1       GLU  69  13.905  -7.802   3.876
  539    H    LEU  70           HN       LEU  70  10.854  -7.803   0.281
  540    HA   LEU  70           HA       LEU  70  12.700  -6.113  -0.998
  541   1HB   LEU  70          HB2       LEU  70  11.353  -7.541  -2.365
  542   2HB   LEU  70          HB1       LEU  70   9.858  -6.891  -1.699
  543    HG   LEU  70           HG       LEU  70  10.264  -4.737  -2.784
  544   1HD1  LEU  70          HD11      LEU  70  12.226  -4.655  -4.440
  545   2HD1  LEU  70          HD12      LEU  70  12.863  -6.065  -3.594
  546   3HD1  LEU  70          HD13      LEU  70  12.646  -4.545  -2.735
  547   1HD2  LEU  70          HD21      LEU  70  10.811  -6.859  -4.868
  548   2HD2  LEU  70          HD22      LEU  70   9.816  -5.408  -5.010
  549   3HD2  LEU  70          HD23      LEU  70   9.264  -6.765  -4.033
  550    H    VAL  71           HN       VAL  71   9.452  -5.342   0.263
  551    HA   VAL  71           HA       VAL  71   9.175  -2.698  -0.481
  552    HB   VAL  71           HB       VAL  71   8.635  -3.638   2.344
  553   1HG1  VAL  71          HG11      VAL  71   8.227  -1.274   2.017
  554   2HG1  VAL  71          HG12      VAL  71   6.667  -2.091   2.039
  555   3HG1  VAL  71          HG13      VAL  71   7.375  -1.582   0.505
  556   1HG2  VAL  71          HG21      VAL  71   7.771  -5.315   0.869
  557   2HG2  VAL  71          HG22      VAL  71   7.139  -4.110  -0.239
  558   3HG2  VAL  71          HG23      VAL  71   6.405  -4.319   1.353
  559    H    CYS  72           HN       CYS  72  10.791  -3.679   2.591
  560    HA   CYS  72           HA       CYS  72  11.813  -1.207   3.356
  561   1HB   CYS  72          HB2       CYS  72  13.093  -3.928   3.490
  562   2HB   CYS  72          HB1       CYS  72  13.914  -2.495   4.101
  563    H    SER  73           HN       SER  73  12.990  -3.279   0.743
  564    HA   SER  73           HA       SER  73  15.290  -1.629   0.143
  565   1HB   SER  73          HB2       SER  73  14.198  -4.062  -0.838
  566   2HB   SER  73          HB1       SER  73  14.280  -2.977  -2.222
  567    HG   SER  73           HG       SER  73  16.233  -4.324  -1.251
  568    H    MET  74           HN       MET  74  12.028  -1.902  -1.365
  569    HA   MET  74           HA       MET  74  12.295   0.277  -3.155
  570   1HB   MET  74          HB2       MET  74   9.873  -0.745  -1.638
  571   2HB   MET  74          HB1       MET  74   9.772   0.517  -2.863
  572   1HG   MET  74          HG2       MET  74  11.052  -1.210  -4.374
  573   2HG   MET  74          HG1       MET  74  10.469  -2.389  -3.200
  574   1HE   MET  74          HE1       MET  74   7.675  -1.591  -2.258
  575   2HE   MET  74          HE2       MET  74   8.257  -3.150  -2.846
  576   3HE   MET  74          HE3       MET  74   6.749  -2.486  -3.479
  577    H    LEU  75           HN       LEU  75  11.370   0.253   0.287
  578    HA   LEU  75           HA       LEU  75  10.792   3.045   0.486
  579   1HB   LEU  75          HB2       LEU  75  12.014   1.268   2.624
  580   2HB   LEU  75          HB1       LEU  75  11.181   2.796   2.894
  581    HG   LEU  75           HG       LEU  75   9.947   0.273   1.765
  582   1HD1  LEU  75          HD11      LEU  75   8.871   0.010   3.849
  583   2HD1  LEU  75          HD12      LEU  75   9.249   1.657   4.347
  584   3HD1  LEU  75          HD13      LEU  75  10.527   0.441   4.279
  585   1HD2  LEU  75          HD21      LEU  75   8.727   1.980   0.733
  586   2HD2  LEU  75          HD22      LEU  75   8.924   3.083   2.099
  587   3HD2  LEU  75          HD23      LEU  75   7.810   1.720   2.215
  588    H    HIS  76           HN       HIS  76  13.751   1.347   0.051
  589    HA   HIS  76           HA       HIS  76  15.905   2.175  -0.303
  590   1HB   HIS  76          HB2       HIS  76  14.271   4.265  -1.014
  591   2HB   HIS  76          HB1       HIS  76  15.200   5.017   0.280
  592    HD1  HIS  76           HD1      HIS  76  17.824   5.154  -0.080
  593    HD2  HIS  76           HD2      HIS  76  15.680   3.756  -3.369
  594    HE1  HIS  76           HE1      HIS  76  19.406   5.251  -2.057
  595    H    LEU  77           HN       LEU  77  14.830   1.418   2.331
  596    HA   LEU  77           HA       LEU  77  16.335   3.197   4.196
  597   1HB   LEU  77          HB2       LEU  77  14.532   0.823   4.770
  598   2HB   LEU  77          HB1       LEU  77  15.240   1.893   5.976
  599    HG   LEU  77           HG       LEU  77  13.353   2.799   3.782
  600   1HD1  LEU  77          HD11      LEU  77  11.619   2.850   5.452
  601   2HD1  LEU  77          HD12      LEU  77  12.764   2.464   6.737
  602   3HD1  LEU  77          HD13      LEU  77  12.353   1.247   5.529
  603   1HD2  LEU  77          HD21      LEU  77  13.199   4.780   5.502
  604   2HD2  LEU  77          HD22      LEU  77  14.583   4.703   4.417
  605   3HD2  LEU  77          HD23      LEU  77  14.744   4.165   6.088
  606    H    CYS  78           HN       CYS  78  17.036   0.669   2.234
  607    HA   CYS  78           HA       CYS  78  19.340  -0.121   3.888
  608   1HB   CYS  78          HB2       CYS  78  17.219  -1.610   4.385
  609   2HB   CYS  78          HB1       CYS  78  17.632  -2.374   2.851
  610    H    SER  79           HN       SER  79  18.729   1.168   1.234
  611    HA   SER  79           HA       SER  79  19.229  -0.513  -0.958
  612   1HB   SER  79          HB2       SER  79  20.434   2.243  -0.607
  613   2HB   SER  79          HB1       SER  79  20.035   1.439  -2.123
  614    HG   SER  79           HG       SER  79  18.495   3.001  -0.693
  615    H    GLY  80           HN       GLY  80  20.724  -2.161  -0.468
  616   1HA   GLY  80          HA2       GLY  80  23.376  -1.531   0.585
  617   2HA   GLY  80          HA1       GLY  80  22.837  -3.110   0.010
  618    H    LEU  81           HN       LEU  81  21.932  -2.157  -2.554
  619    HA   LEU  81           HA       LEU  81  24.481  -1.394  -3.878
  620   1HB   LEU  81          HB2       LEU  81  24.327  -3.183  -5.322
  621   2HB   LEU  81          HB1       LEU  81  23.408  -3.897  -4.007
  622    HG   LEU  81           HG       LEU  81  22.348  -2.537  -6.478
  623   1HD1  LEU  81          HD11      LEU  81  21.318  -4.746  -6.880
  624   2HD1  LEU  81          HD12      LEU  81  22.065  -5.346  -5.400
  625   3HD1  LEU  81          HD13      LEU  81  23.073  -4.853  -6.759
  626   1HD2  LEU  81          HD21      LEU  81  20.528  -1.910  -5.258
  627   2HD2  LEU  81          HD22      LEU  81  21.039  -2.864  -3.865
  628   3HD2  LEU  81          HD23      LEU  81  20.130  -3.626  -5.164
  629    H    VAL  82           HN       VAL  82  23.738  -0.739  -6.312
  630    HA   VAL  82           HA       VAL  82  21.934   1.476  -5.871
  631    HB   VAL  82           HB       VAL  82  22.146   1.653  -8.481
  632   1HG1  VAL  82          HG11      VAL  82  23.313   3.106  -6.847
  633   2HG1  VAL  82          HG12      VAL  82  24.335   2.733  -8.238
  634   3HG1  VAL  82          HG13      VAL  82  24.594   1.900  -6.705
  635   1HG2  VAL  82          HG21      VAL  82  24.487  -0.174  -7.878
  636   2HG2  VAL  82          HG22      VAL  82  23.956   0.418  -9.453
  637   3HG2  VAL  82          HG23      VAL  82  22.980  -0.762  -8.579
  638    HA   PRO  83           HA       PRO  83  18.146  -0.754  -6.407
  639   1HB   PRO  83          HB2       PRO  83  17.128   1.544  -7.990
  640   2HB   PRO  83          HB1       PRO  83  16.475   0.817  -6.512
  641   1HG   PRO  83          HG2       PRO  83  17.885   3.235  -6.610
  642   2HG   PRO  83          HG1       PRO  83  17.640   2.251  -5.160
  643   1HD   PRO  83          HD2       PRO  83  20.128   2.689  -6.651
  644   2HD   PRO  83          HD1       PRO  83  19.888   1.893  -5.075
  645    H    ARG  84           HN       ARG  84  18.047  -2.392  -7.914
  646    HA   ARG  84           HA       ARG  84  19.142  -2.054 -10.591
  647   1HB   ARG  84          HB2       ARG  84  17.509  -4.339  -9.444
  648   2HB   ARG  84          HB1       ARG  84  18.466  -4.390 -10.923
  649   1HG   ARG  84          HG2       ARG  84  19.594  -3.823  -8.166
  650   2HG   ARG  84          HG1       ARG  84  19.652  -5.394  -8.962
  651   1HD   ARG  84          HD2       ARG  84  20.770  -4.032 -10.933
  652   2HD   ARG  84          HD1       ARG  84  21.122  -2.865  -9.656
  653    HE   ARG  84           HE       ARG  84  21.970  -5.281  -8.598
  654   1HH1  ARG  84          HH21      ARG  84  22.496  -3.492 -11.498
  655   2HH1  ARG  84          HH22      ARG  84  24.109  -4.080 -11.726
  656   1HH2  ARG  84          HH11      ARG  84  24.074  -6.060  -8.880
  657   2HH2  ARG  84          HH12      ARG  84  25.002  -5.533 -10.244
  Start of MODEL   11
    1   1H    SER   1           HT1      SER   1  19.246   7.346   9.133
    2   2H    SER   1           HT2      SER   1  20.356   7.765  10.347
    3   3H    SER   1           HT3      SER   1  19.117   6.649  10.673
    4    HA   SER   1           HA       SER   1  21.168   6.150   8.601
    5   1HB   SER   1          HB2       SER   1  21.231   5.244  11.494
    6   2HB   SER   1          HB1       SER   1  22.424   4.877  10.250
    7    HG   SER   1           HG       SER   1  21.819   7.348  11.483
    8    H    ASP   2           HN       ASP   2  21.337   3.436   9.846
    9    HA   ASP   2           HA       ASP   2  19.188   2.206   8.360
   10   1HB   ASP   2          HB2       ASP   2  21.048   0.999  10.433
   11   2HB   ASP   2          HB1       ASP   2  20.048   0.094   9.296
   12    H    VAL   3           HN       VAL   3  17.794   3.853   9.924
   13    HA   VAL   3           HA       VAL   3  16.855   2.336  12.302
   14    HB   VAL   3           HB       VAL   3  16.193   5.125  11.405
   15   1HG1  VAL   3          HG11      VAL   3  14.449   4.178  12.817
   16   2HG1  VAL   3          HG12      VAL   3  15.371   5.353  13.754
   17   3HG1  VAL   3          HG13      VAL   3  15.656   3.627  13.980
   18   1HG2  VAL   3          HG21      VAL   3  18.559   4.939  11.990
   19   2HG2  VAL   3          HG22      VAL   3  18.141   4.112  13.490
   20   3HG2  VAL   3          HG23      VAL   3  17.705   5.805  13.267
   21    H    TYR   4           HN       TYR   4  15.389   4.231   9.649
   22    HA   TYR   4           HA       TYR   4  12.815   2.957   9.959
   23   1HB   TYR   4          HB2       TYR   4  14.082   4.825   7.981
   24   2HB   TYR   4          HB1       TYR   4  12.610   3.990   7.491
   25    HD1  TYR   4           HD1      TYR   4  10.957   5.669   7.542
   26    HD2  TYR   4           HD2      TYR   4  13.586   5.193  10.899
   27    HE1  TYR   4           HE1      TYR   4   9.591   7.278   8.833
   28    HE2  TYR   4           HE2      TYR   4  12.226   6.800  12.197
   29    HH   TYR   4           HH       TYR   4  10.542   8.870  11.371
   30    H    CYS   5           HN       CYS   5  15.730   1.924   8.535
   31    HA   CYS   5           HA       CYS   5  14.585   0.297   6.420
   32   1HB   CYS   5          HB2       CYS   5  17.234  -0.240   7.769
   33   2HB   CYS   5          HB1       CYS   5  16.776  -0.531   6.091
   34    H    GLU   6           HN       GLU   6  15.650  -0.331   9.764
   35    HA   GLU   6           HA       GLU   6  14.839  -3.149   9.595
   36   1HB   GLU   6          HB2       GLU   6  15.889  -1.387  11.817
   37   2HB   GLU   6          HB1       GLU   6  15.336  -3.035  12.118
   38   1HG   GLU   6          HG2       GLU   6  17.792  -2.919  11.708
   39   2HG   GLU   6          HG1       GLU   6  16.956  -3.910  10.512
   40    H    VAL   7           HN       VAL   7  13.650  -0.203  11.232
   41    HA   VAL   7           HA       VAL   7  11.517  -1.272  12.674
   42    HB   VAL   7           HB       VAL   7  11.597   1.314  11.093
   43   1HG1  VAL   7          HG11      VAL   7   9.299   0.903  11.555
   44   2HG1  VAL   7          HG12      VAL   7   9.840   1.978  12.843
   45   3HG1  VAL   7          HG13      VAL   7   9.658   0.251  13.154
   46   1HG2  VAL   7          HG21      VAL   7  13.321   0.846  12.946
   47   2HG2  VAL   7          HG22      VAL   7  11.961   0.889  14.067
   48   3HG2  VAL   7          HG23      VAL   7  12.365   2.318  13.116
   49    H    CYS   8           HN       CYS   8  11.389  -0.191   9.251
   50    HA   CYS   8           HA       CYS   8   8.702  -1.080   8.831
   51   1HB   CYS   8          HB2       CYS   8   9.036  -0.558   6.578
   52   2HB   CYS   8          HB1       CYS   8  10.243   0.455   7.360
   53    H    GLU   9           HN       GLU   9  11.829  -2.654   8.254
   54    HA   GLU   9           HA       GLU   9  11.059  -5.020   6.992
   55   1HB   GLU   9          HB2       GLU   9  13.438  -4.657   7.619
   56   2HB   GLU   9          HB1       GLU   9  13.031  -4.899   9.323
   57   1HG   GLU   9          HG2       GLU   9  13.988  -6.936   8.327
   58   2HG   GLU   9          HG1       GLU   9  12.323  -7.212   8.823
   59    H    PHE  10           HN       PHE  10  10.910  -4.468  10.526
   60    HA   PHE  10           HA       PHE  10   9.625  -7.027  11.004
   61   1HB   PHE  10          HB2       PHE  10  11.004  -5.910  12.717
   62   2HB   PHE  10          HB1       PHE  10   9.838  -4.589  12.792
   63    HD1  PHE  10           HD1      PHE  10  10.074  -8.313  13.117
   64    HD2  PHE  10           HD2      PHE  10   8.018  -4.724  14.279
   65    HE1  PHE  10           HE1      PHE  10   8.718  -9.613  14.737
   66    HE2  PHE  10           HE2      PHE  10   6.664  -6.025  15.898
   67    HZ   PHE  10           HZ       PHE  10   7.013  -8.469  16.127
   68    H    LEU  11           HN       LEU  11   8.423  -3.654  10.931
   69    HA   LEU  11           HA       LEU  11   5.715  -4.374  11.579
   70   1HB   LEU  11          HB2       LEU  11   6.748  -1.955  10.074
   71   2HB   LEU  11          HB1       LEU  11   5.144  -2.110  10.785
   72    HG   LEU  11           HG       LEU  11   7.740  -2.277  12.349
   73   1HD1  LEU  11          HD11      LEU  11   7.330  -0.033  13.070
   74   2HD1  LEU  11          HD12      LEU  11   5.724  -0.019  12.342
   75   3HD1  LEU  11          HD13      LEU  11   7.157  -0.015  11.315
   76   1HD2  LEU  11          HD21      LEU  11   5.958  -1.793  14.239
   77   2HD2  LEU  11          HD22      LEU  11   6.161  -3.436  13.643
   78   3HD2  LEU  11          HD23      LEU  11   4.814  -2.453  13.070
   79    H    VAL  12           HN       VAL  12   7.211  -3.569   8.425
   80    HA   VAL  12           HA       VAL  12   4.876  -4.041   6.884
   81    HB   VAL  12           HB       VAL  12   7.737  -4.481   5.999
   82   1HG1  VAL  12          HG11      VAL  12   5.205  -3.759   4.492
   83   2HG1  VAL  12          HG12      VAL  12   6.033  -5.313   4.428
   84   3HG1  VAL  12          HG13      VAL  12   6.815  -3.872   3.784
   85   1HG2  VAL  12          HG21      VAL  12   6.065  -1.951   5.882
   86   2HG2  VAL  12          HG22      VAL  12   7.750  -2.128   5.400
   87   3HG2  VAL  12          HG23      VAL  12   7.304  -2.248   7.099
   88    H    LYS  13           HN       LYS  13   7.247  -6.323   8.174
   89    HA   LYS  13           HA       LYS  13   6.276  -8.551   6.528
   90   1HB   LYS  13          HB2       LYS  13   8.599  -8.417   7.343
   91   2HB   LYS  13          HB1       LYS  13   8.014  -8.537   8.998
   92   1HG   LYS  13          HG2       LYS  13   6.821 -10.727   7.602
   93   2HG   LYS  13          HG1       LYS  13   8.495 -10.680   7.065
   94   1HD   LYS  13          HD2       LYS  13   8.563 -12.052   8.976
   95   2HD   LYS  13          HD1       LYS  13   9.091 -10.483   9.582
   96   1HE   LYS  13          HE2       LYS  13   6.769 -10.011  10.328
   97   2HE   LYS  13          HE1       LYS  13   6.280 -11.610   9.768
   98   1HZ   LYS  13          HZ1       LYS  13   8.567 -11.816  11.411
   99   2HZ   LYS  13          HZ2       LYS  13   7.030 -12.503  11.632
  100   3HZ   LYS  13          HZ3       LYS  13   7.362 -10.947  12.228
  101    H    GLU  14           HN       GLU  14   5.731  -7.332   9.825
  102    HA   GLU  14           HA       GLU  14   4.164  -9.626  10.670
  103   1HB   GLU  14          HB2       GLU  14   4.408  -6.787  11.700
  104   2HB   GLU  14          HB1       GLU  14   3.343  -7.974  12.450
  105   1HG   GLU  14          HG2       GLU  14   6.302  -8.442  12.003
  106   2HG   GLU  14          HG1       GLU  14   5.634  -7.809  13.507
  107    H    VAL  15           HN       VAL  15   3.180  -6.279   9.953
  108    HA   VAL  15           HA       VAL  15   0.434  -6.564   9.799
  109    HB   VAL  15           HB       VAL  15   1.773  -4.446   9.403
  110   1HG1  VAL  15          HG11      VAL  15   2.557  -3.949   7.193
  111   2HG1  VAL  15          HG12      VAL  15   1.818  -5.405   6.531
  112   3HG1  VAL  15          HG13      VAL  15   3.208  -5.534   7.607
  113   1HG2  VAL  15          HG21      VAL  15  -0.489  -5.209   7.538
  114   2HG2  VAL  15          HG22      VAL  15   0.093  -3.555   7.738
  115   3HG2  VAL  15          HG23      VAL  15  -0.619  -4.413   9.105
  116    H    THR  16           HN       THR  16   2.825  -7.478   7.342
  117    HA   THR  16           HA       THR  16   1.046  -8.256   5.290
  118    HB   THR  16           HB       THR  16   3.133 -10.203   5.357
  119    HG1  THR  16           HG1      THR  16   3.690  -8.415   7.069
  120   1HG2  THR  16          HG21      THR  16   2.447  -9.072   3.337
  121   2HG2  THR  16          HG22      THR  16   4.156  -8.694   3.630
  122   3HG2  THR  16          HG23      THR  16   2.909  -7.503   4.013
  123    H    LYS  17           HN       LYS  17   2.229 -10.069   8.130
  124    HA   LYS  17           HA       LYS  17   1.057 -12.557   7.725
  125   1HB   LYS  17          HB2       LYS  17   1.097 -10.983  10.326
  126   2HB   LYS  17          HB1       LYS  17   0.811 -12.717  10.190
  127   1HG   LYS  17          HG2       LYS  17   3.026 -13.023   9.164
  128   2HG   LYS  17          HG1       LYS  17   3.314 -11.289   9.252
  129   1HD   LYS  17          HD2       LYS  17   4.407 -12.043  11.180
  130   2HD   LYS  17          HD1       LYS  17   2.828 -11.597  11.819
  131   1HE   LYS  17          HE2       LYS  17   3.574 -13.820  12.642
  132   2HE   LYS  17          HE1       LYS  17   2.092 -13.938  11.697
  133   1HZ   LYS  17          HZ1       LYS  17   4.731 -14.263  10.419
  134   2HZ   LYS  17          HZ2       LYS  17   3.214 -14.819   9.891
  135   3HZ   LYS  17          HZ3       LYS  17   3.985 -15.568  11.207
  136    H    LEU  18           HN       LEU  18  -0.514  -9.538   8.652
  137    HA   LEU  18           HA       LEU  18  -3.159 -10.925   8.732
  138   1HB   LEU  18          HB2       LEU  18  -3.280  -7.995   9.054
  139   2HB   LEU  18          HB1       LEU  18  -3.869  -9.262  10.120
  140    HG   LEU  18           HG       LEU  18  -0.958  -8.441   9.940
  141   1HD1  LEU  18          HD11      LEU  18  -3.146  -7.621  11.860
  142   2HD1  LEU  18          HD12      LEU  18  -2.260  -6.573  10.751
  143   3HD1  LEU  18          HD13      LEU  18  -1.428  -7.318  12.119
  144   1HD2  LEU  18          HD21      LEU  18  -1.744 -10.801  10.781
  145   2HD2  LEU  18          HD22      LEU  18  -2.365  -9.917  12.176
  146   3HD2  LEU  18          HD23      LEU  18  -0.642  -9.873  11.803
  147    H    ILE  19           HN       ILE  19  -1.682  -8.094   7.131
  148    HA   ILE  19           HA       ILE  19  -3.675  -7.596   5.238
  149    HB   ILE  19           HB       ILE  19  -0.809  -7.084   5.603
  150   1HG1  ILE  19          HG12      ILE  19  -2.851  -5.349   4.225
  151   2HG1  ILE  19          HG11      ILE  19  -2.733  -5.481   5.979
  152   1HG2  ILE  19          HG21      ILE  19  -0.452  -6.288   3.236
  153   2HG2  ILE  19          HG22      ILE  19  -1.882  -7.219   2.787
  154   3HG2  ILE  19          HG23      ILE  19  -0.463  -8.037   3.445
  155   1HD1  ILE  19          HD11      ILE  19  -0.088  -5.016   5.244
  156   2HD1  ILE  19          HD12      ILE  19  -1.224  -3.794   5.824
  157   3HD1  ILE  19          HD13      ILE  19  -1.003  -4.034   4.095
  158    H    ASP  20           HN       ASP  20  -1.490 -10.255   5.547
  159    HA   ASP  20           HA       ASP  20  -1.151 -11.233   2.976
  160   1HB   ASP  20          HB2       ASP  20  -0.231 -12.446   4.856
  161   2HB   ASP  20          HB1       ASP  20  -1.838 -12.766   5.508
  162    H    ASN  21           HN       ASN  21  -3.941 -12.100   5.097
  163    HA   ASN  21           HA       ASN  21  -5.768 -11.839   2.837
  164   1HB   ASN  21          HB2       ASN  21  -5.400 -14.551   4.122
  165   2HB   ASN  21          HB1       ASN  21  -6.559 -14.142   2.855
  166   1HD2  ASN  21          HD21      ASN  21  -5.576 -13.392   0.723
  167   2HD2  ASN  21          HD22      ASN  21  -4.063 -14.014   0.271
  168    H    ASN  22           HN       ASN  22  -5.686 -10.492   5.299
  169    HA   ASN  22           HA       ASN  22  -7.913 -11.687   6.887
  170   1HB   ASN  22          HB2       ASN  22  -6.187  -9.242   7.384
  171   2HB   ASN  22          HB1       ASN  22  -7.437  -9.841   8.475
  172   1HD2  ASN  22          HD21      ASN  22  -5.129 -11.849   6.588
  173   2HD2  ASN  22          HD22      ASN  22  -4.342 -12.489   7.960
  174    H    LYS  23           HN       LYS  23  -7.010  -8.521   5.538
  175    HA   LYS  23           HA       LYS  23  -9.880  -7.815   5.253
  176   1HB   LYS  23          HB2       LYS  23  -9.075  -5.566   4.788
  177   2HB   LYS  23          HB1       LYS  23  -8.288  -6.173   6.240
  178   1HG   LYS  23          HG2       LYS  23  -6.366  -5.477   5.190
  179   2HG   LYS  23          HG1       LYS  23  -6.493  -7.027   4.364
  180   1HD   LYS  23          HD2       LYS  23  -8.043  -5.633   2.697
  181   2HD   LYS  23          HD1       LYS  23  -7.145  -4.270   3.357
  182   1HE   LYS  23          HE2       LYS  23  -5.023  -5.661   2.846
  183   2HE   LYS  23          HE1       LYS  23  -6.078  -6.648   1.835
  184   1HZ   LYS  23          HZ1       LYS  23  -5.545  -3.744   1.584
  185   2HZ   LYS  23          HZ2       LYS  23  -6.774  -4.547   0.729
  186   3HZ   LYS  23          HZ3       LYS  23  -5.146  -4.964   0.477
  187    H    THR  24           HN       THR  24 -10.858  -8.282   3.353
  188    HA   THR  24           HA       THR  24  -9.215  -9.032   1.027
  189    HB   THR  24           HB       THR  24 -11.533  -9.472   0.016
  190    HG1  THR  24           HG1      THR  24 -13.181  -9.586   1.612
  191   1HG2  THR  24          HG21      THR  24 -10.834 -10.890   2.605
  192   2HG2  THR  24          HG22      THR  24 -10.067 -11.213   1.050
  193   3HG2  THR  24          HG23      THR  24 -11.784 -11.550   1.273
  194    H    GLU  25           HN       GLU  25 -10.684  -8.218  -1.122
  195    HA   GLU  25           HA       GLU  25 -10.085  -5.324  -1.171
  196   1HB   GLU  25          HB2       GLU  25 -11.087  -6.908  -3.531
  197   2HB   GLU  25          HB1       GLU  25 -10.011  -5.511  -3.506
  198   1HG   GLU  25          HG2       GLU  25  -8.553  -7.319  -3.930
  199   2HG   GLU  25          HG1       GLU  25  -8.378  -7.050  -2.195
  200    H    LYS  26           HN       LYS  26 -12.663  -6.761  -0.025
  201    HA   LYS  26           HA       LYS  26 -14.749  -5.485  -1.660
  202   1HB   LYS  26          HB2       LYS  26 -15.219  -6.703   1.060
  203   2HB   LYS  26          HB1       LYS  26 -16.284  -6.675  -0.345
  204   1HG   LYS  26          HG2       LYS  26 -13.742  -8.289  -0.054
  205   2HG   LYS  26          HG1       LYS  26 -15.389  -8.913  -0.068
  206   1HD   LYS  26          HD2       LYS  26 -15.650  -7.880  -2.373
  207   2HD   LYS  26          HD1       LYS  26 -13.911  -7.582  -2.350
  208   1HE   LYS  26          HE2       LYS  26 -13.449  -9.938  -2.095
  209   2HE   LYS  26          HE1       LYS  26 -15.168 -10.297  -1.927
  210   1HZ   LYS  26          HZ1       LYS  26 -13.706 -10.198  -4.268
  211   2HZ   LYS  26          HZ2       LYS  26 -14.690  -8.814  -4.291
  212   3HZ   LYS  26          HZ3       LYS  26 -15.388 -10.354  -4.117
  213    H    GLU  27           HN       GLU  27 -13.429  -5.188   1.640
  214    HA   GLU  27           HA       GLU  27 -14.955  -2.780   2.143
  215   1HB   GLU  27          HB2       GLU  27 -13.805  -2.666   4.251
  216   2HB   GLU  27          HB1       GLU  27 -14.146  -4.367   3.944
  217   1HG   GLU  27          HG2       GLU  27 -11.817  -4.559   2.973
  218   2HG   GLU  27          HG1       GLU  27 -11.509  -2.927   3.567
  219    H    ILE  28           HN       ILE  28 -12.173  -3.438   0.338
  220    HA   ILE  28           HA       ILE  28 -10.868  -0.848   0.790
  221    HB   ILE  28           HB       ILE  28 -10.412  -3.010  -1.287
  222   1HG1  ILE  28          HG12      ILE  28  -9.866  -3.789   0.958
  223   2HG1  ILE  28          HG11      ILE  28  -8.385  -3.508   0.065
  224   1HG2  ILE  28          HG21      ILE  28  -9.577  -1.037  -2.246
  225   2HG2  ILE  28          HG22      ILE  28  -8.165  -1.756  -1.476
  226   3HG2  ILE  28          HG23      ILE  28  -9.004  -0.415  -0.699
  227   1HD1  ILE  28          HD11      ILE  28  -8.551  -1.098   1.177
  228   2HD1  ILE  28          HD12      ILE  28  -7.862  -2.459   2.056
  229   3HD1  ILE  28          HD13      ILE  28  -9.527  -1.969   2.359
  230    H    LEU  29           HN       LEU  29 -11.932  -2.367  -2.264
  231    HA   LEU  29           HA       LEU  29 -12.194  -0.045  -3.769
  232   1HB   LEU  29          HB2       LEU  29 -14.021  -2.465  -3.857
  233   2HB   LEU  29          HB1       LEU  29 -13.860  -1.269  -5.140
  234    HG   LEU  29           HG       LEU  29 -11.440  -2.747  -4.088
  235   1HD1  LEU  29          HD11      LEU  29 -11.784  -4.280  -6.095
  236   2HD1  LEU  29          HD12      LEU  29 -13.438  -3.667  -6.163
  237   3HD1  LEU  29          HD13      LEU  29 -12.878  -4.539  -4.735
  238   1HD2  LEU  29          HD21      LEU  29 -10.886  -0.881  -5.498
  239   2HD2  LEU  29          HD22      LEU  29 -12.137  -1.303  -6.667
  240   3HD2  LEU  29          HD23      LEU  29 -10.711  -2.322  -6.497
  241    H    ASP  30           HN       ASP  30 -14.293  -1.224  -1.237
  242    HA   ASP  30           HA       ASP  30 -16.508   0.562  -1.848
  243   1HB   ASP  30          HB2       ASP  30 -15.710  -0.907   0.686
  244   2HB   ASP  30          HB1       ASP  30 -17.195   0.032   0.525
  245    H    ALA  31           HN       ALA  31 -13.799   0.595   0.472
  246    HA   ALA  31           HA       ALA  31 -14.244   3.037   1.747
  247   1HB   ALA  31          HB1       ALA  31 -11.859   3.198   2.075
  248   2HB   ALA  31          HB2       ALA  31 -11.556   2.101   0.724
  249   3HB   ALA  31          HB3       ALA  31 -12.320   1.499   2.195
  250    H    PHE  32           HN       PHE  32 -12.465   2.558  -1.329
  251    HA   PHE  32           HA       PHE  32 -12.019   5.266  -1.925
  252   1HB   PHE  32          HB2       PHE  32 -12.602   2.903  -3.727
  253   2HB   PHE  32          HB1       PHE  32 -12.262   4.507  -4.375
  254    HD1  PHE  32           HD1      PHE  32 -10.064   5.602  -3.940
  255    HD2  PHE  32           HD2      PHE  32 -10.867   1.561  -2.720
  256    HE1  PHE  32           HE1      PHE  32  -7.636   5.209  -3.631
  257    HE2  PHE  32           HE2      PHE  32  -8.442   1.170  -2.416
  258    HZ   PHE  32           HZ       PHE  32  -6.826   2.993  -2.870
  259    H    ASP  33           HN       ASP  33 -14.993   3.347  -2.347
  260    HA   ASP  33           HA       ASP  33 -16.438   5.411  -3.722
  261   1HB   ASP  33          HB2       ASP  33 -17.677   3.410  -1.818
  262   2HB   ASP  33          HB1       ASP  33 -18.404   4.144  -3.249
  263    H    LYS  34           HN       LYS  34 -15.164   5.294  -0.627
  264    HA   LYS  34           HA       LYS  34 -17.198   7.196   0.487
  265   1HB   LYS  34          HB2       LYS  34 -14.928   5.799   1.946
  266   2HB   LYS  34          HB1       LYS  34 -16.286   6.670   2.666
  267   1HG   LYS  34          HG2       LYS  34 -17.862   5.029   1.778
  268   2HG   LYS  34          HG1       LYS  34 -16.551   4.191   0.951
  269   1HD   LYS  34          HD2       LYS  34 -15.506   4.070   3.399
  270   2HD   LYS  34          HD1       LYS  34 -17.180   4.302   3.893
  271   1HE   LYS  34          HE2       LYS  34 -16.342   2.145   1.935
  272   2HE   LYS  34          HE1       LYS  34 -16.429   1.884   3.674
  273   1HZ   LYS  34          HZ1       LYS  34 -18.484   1.233   2.614
  274   2HZ   LYS  34          HZ2       LYS  34 -18.661   2.780   1.932
  275   3HZ   LYS  34          HZ3       LYS  34 -18.753   2.575   3.616
  276    H    MET  35           HN       MET  35 -13.641   6.871   0.937
  277    HA   MET  35           HA       MET  35 -13.239   9.626   1.488
  278   1HB   MET  35          HB2       MET  35 -11.174   7.956   0.037
  279   2HB   MET  35          HB1       MET  35 -10.904   9.274   1.165
  280   1HG   MET  35          HG2       MET  35 -11.294   7.949   3.032
  281   2HG   MET  35          HG1       MET  35 -12.370   6.854   2.171
  282   1HE   MET  35          HE1       MET  35 -10.234   5.796  -0.534
  283   2HE   MET  35          HE2       MET  35 -11.798   5.697   0.261
  284   3HE   MET  35          HE3       MET  35 -10.647   4.384   0.455
  285    H    CYS  36           HN       CYS  36 -12.829   7.865  -1.577
  286    HA   CYS  36           HA       CYS  36 -12.234  10.176  -3.161
  287   1HB   CYS  36          HB2       CYS  36 -12.079   7.544  -3.612
  288   2HB   CYS  36          HB1       CYS  36 -13.667   7.816  -4.343
  289    H    SER  37           HN       SER  37 -14.943   9.573  -1.426
  290    HA   SER  37           HA       SER  37 -16.921  10.495  -3.413
  291   1HB   SER  37          HB2       SER  37 -18.545   9.867  -1.876
  292   2HB   SER  37          HB1       SER  37 -17.235   8.793  -1.403
  293    HG   SER  37           HG       SER  37 -18.183  11.132  -0.182
  294    H    LYS  38           HN       LYS  38 -15.402  11.642  -0.403
  295    HA   LYS  38           HA       LYS  38 -16.685  14.295  -0.718
  296   1HB   LYS  38          HB2       LYS  38 -15.756  14.777   1.478
  297   2HB   LYS  38          HB1       LYS  38 -16.532  13.193   1.522
  298   1HG   LYS  38          HG2       LYS  38 -14.245  12.192   1.020
  299   2HG   LYS  38          HG1       LYS  38 -13.572  13.793   1.326
  300   1HD   LYS  38          HD2       LYS  38 -14.803  13.720   3.570
  301   2HD   LYS  38          HD1       LYS  38 -15.053  12.003   3.257
  302   1HE   LYS  38          HE2       LYS  38 -12.645  11.643   3.086
  303   2HE   LYS  38          HE1       LYS  38 -12.346  13.370   3.280
  304   1HZ   LYS  38          HZ1       LYS  38 -12.595  11.469   5.278
  305   2HZ   LYS  38          HZ2       LYS  38 -13.992  12.431   5.374
  306   3HZ   LYS  38          HZ3       LYS  38 -12.455  13.149   5.466
  307    H    LEU  39           HN       LEU  39 -14.459  13.241  -2.568
  308    HA   LEU  39           HA       LEU  39 -12.480  15.452  -2.071
  309   1HB   LEU  39          HB2       LEU  39 -10.904  13.792  -2.286
  310   2HB   LEU  39          HB1       LEU  39 -12.182  12.619  -2.527
  311    HG   LEU  39           HG       LEU  39 -11.177  14.327  -4.781
  312   1HD1  LEU  39          HD11      LEU  39  -9.192  13.223  -4.241
  313   2HD1  LEU  39          HD12      LEU  39  -9.933  12.093  -5.376
  314   3HD1  LEU  39          HD13      LEU  39 -10.033  11.794  -3.641
  315   1HD2  LEU  39          HD21      LEU  39 -13.399  12.740  -4.584
  316   2HD2  LEU  39          HD22      LEU  39 -12.213  11.599  -5.191
  317   3HD2  LEU  39          HD23      LEU  39 -12.540  13.088  -6.072
  318    HA   PRO  40           HA       PRO  40 -14.190  17.679  -5.404
  319   1HB   PRO  40          HB2       PRO  40 -11.719  17.688  -7.012
  320   2HB   PRO  40          HB1       PRO  40 -12.587  19.046  -6.285
  321   1HG   PRO  40          HG2       PRO  40 -10.173  17.865  -5.319
  322   2HG   PRO  40          HG1       PRO  40 -11.157  19.078  -4.489
  323   1HD   PRO  40          HD2       PRO  40 -10.804  16.321  -3.756
  324   2HD   PRO  40          HD1       PRO  40 -11.845  17.512  -2.959
  325    H    LYS  41           HN       LYS  41 -15.384  17.131  -7.159
  326    HA   LYS  41           HA       LYS  41 -15.642  14.528  -8.103
  327   1HB   LYS  41          HB2       LYS  41 -17.277  16.348  -8.505
  328   2HB   LYS  41          HB1       LYS  41 -16.165  17.066  -9.667
  329   1HG   LYS  41          HG2       LYS  41 -16.283  15.096 -11.074
  330   2HG   LYS  41          HG1       LYS  41 -17.294  14.268  -9.887
  331   1HD   LYS  41          HD2       LYS  41 -19.177  15.535 -10.386
  332   2HD   LYS  41          HD1       LYS  41 -18.236  16.946 -10.868
  333   1HE   LYS  41          HE2       LYS  41 -17.598  15.868 -12.948
  334   2HE   LYS  41          HE1       LYS  41 -18.413  14.379 -12.467
  335   1HZ   LYS  41          HZ1       LYS  41 -20.039  16.776 -12.374
  336   2HZ   LYS  41          HZ2       LYS  41 -20.425  15.221 -12.940
  337   3HZ   LYS  41          HZ3       LYS  41 -19.558  16.297 -13.928
  338    H    SER  42           HN       SER  42 -13.897  17.164  -9.720
  339    HA   SER  42           HA       SER  42 -12.852  15.754 -11.909
  340   1HB   SER  42          HB2       SER  42 -11.603  17.896 -10.176
  341   2HB   SER  42          HB1       SER  42 -10.836  17.298 -11.644
  342    HG   SER  42           HG       SER  42 -12.400  19.223 -11.664
  343    H    LEU  43           HN       LEU  43 -11.677  15.959  -8.594
  344    HA   LEU  43           HA       LEU  43  -9.447  14.142  -9.052
  345   1HB   LEU  43          HB2       LEU  43 -10.674  15.527  -6.691
  346   2HB   LEU  43          HB1       LEU  43  -9.595  14.170  -6.399
  347    HG   LEU  43           HG       LEU  43  -8.592  16.541  -6.402
  348   1HD1  LEU  43          HD11      LEU  43  -7.340  14.432  -8.165
  349   2HD1  LEU  43          HD12      LEU  43  -7.284  14.463  -6.402
  350   3HD1  LEU  43          HD13      LEU  43  -6.499  15.738  -7.333
  351   1HD2  LEU  43          HD21      LEU  43  -8.132  17.614  -8.422
  352   2HD2  LEU  43          HD22      LEU  43  -9.781  17.052  -8.650
  353   3HD2  LEU  43          HD23      LEU  43  -8.442  16.172  -9.384
  354    H    SER  44           HN       SER  44 -12.783  13.667  -8.819
  355    HA   SER  44           HA       SER  44 -12.587  11.130  -7.311
  356   1HB   SER  44          HB2       SER  44 -14.981  11.043  -7.433
  357   2HB   SER  44          HB1       SER  44 -14.569  12.709  -7.042
  358    HG   SER  44           HG       SER  44 -16.048  12.712  -8.719
  359    H    GLU  45           HN       GLU  45 -12.857  12.378 -10.548
  360    HA   GLU  45           HA       GLU  45 -13.351   9.745 -11.685
  361   1HB   GLU  45          HB2       GLU  45 -12.868  10.929 -13.875
  362   2HB   GLU  45          HB1       GLU  45 -14.205  11.611 -12.948
  363   1HG   GLU  45          HG2       GLU  45 -12.869  13.424 -12.169
  364   2HG   GLU  45          HG1       GLU  45 -11.380  12.654 -12.716
  365    H    GLU  46           HN       GLU  46 -10.661  11.700 -10.735
  366    HA   GLU  46           HA       GLU  46  -8.705  10.138 -12.292
  367   1HB   GLU  46          HB2       GLU  46  -8.501  12.427 -10.334
  368   2HB   GLU  46          HB1       GLU  46  -7.066  11.566 -10.886
  369   1HG   GLU  46          HG2       GLU  46  -7.739  12.043 -13.246
  370   2HG   GLU  46          HG1       GLU  46  -9.079  13.010 -12.632
  371    H    CYS  47           HN       CYS  47  -9.697  10.438  -8.855
  372    HA   CYS  47           HA       CYS  47  -7.668   8.561  -7.976
  373   1HB   CYS  47          HB2       CYS  47  -8.254   9.550  -6.013
  374   2HB   CYS  47          HB1       CYS  47  -9.721  10.184  -6.722
  375    H    GLN  48           HN       GLN  48 -10.740   8.254  -9.480
  376    HA   GLN  48           HA       GLN  48 -11.122   5.469  -8.569
  377   1HB   GLN  48          HB2       GLN  48 -12.697   7.423 -10.245
  378   2HB   GLN  48          HB1       GLN  48 -13.074   5.700 -10.315
  379   1HG   GLN  48          HG2       GLN  48 -12.870   7.195  -7.695
  380   2HG   GLN  48          HG1       GLN  48 -14.383   7.080  -8.594
  381   1HE2  GLN  48          HE21      GLN  48 -14.325   4.452  -9.539
  382   2HE2  GLN  48          HE22      GLN  48 -14.293   3.368  -8.234
  383    H    GLU  49           HN       GLU  49  -9.860   7.334 -11.220
  384    HA   GLU  49           HA       GLU  49  -9.899   5.266 -13.179
  385   1HB   GLU  49          HB2       GLU  49  -9.448   7.764 -13.548
  386   2HB   GLU  49          HB1       GLU  49  -7.807   7.441 -12.997
  387   1HG   GLU  49          HG2       GLU  49  -9.130   5.931 -15.263
  388   2HG   GLU  49          HG1       GLU  49  -8.124   7.356 -15.506
  389    H    VAL  50           HN       VAL  50  -7.341   6.383 -10.944
  390    HA   VAL  50           HA       VAL  50  -5.492   4.328 -11.697
  391    HB   VAL  50           HB       VAL  50  -5.606   5.699  -9.007
  392   1HG1  VAL  50          HG11      VAL  50  -3.084   5.349  -9.283
  393   2HG1  VAL  50          HG12      VAL  50  -3.474   4.295 -10.646
  394   3HG1  VAL  50          HG13      VAL  50  -4.047   3.896  -9.025
  395   1HG2  VAL  50          HG21      VAL  50  -4.594   6.639 -11.697
  396   2HG2  VAL  50          HG22      VAL  50  -3.917   7.264 -10.192
  397   3HG2  VAL  50          HG23      VAL  50  -5.629   7.497 -10.553
  398    H    VAL  51           HN       VAL  51  -7.890   4.539  -9.048
  399    HA   VAL  51           HA       VAL  51  -7.333   2.224  -7.591
  400    HB   VAL  51           HB       VAL  51  -9.956   3.443  -8.498
  401   1HG1  VAL  51          HG11      VAL  51 -10.539   1.135  -8.182
  402   2HG1  VAL  51          HG12      VAL  51 -11.027   1.988  -6.718
  403   3HG1  VAL  51          HG13      VAL  51  -9.552   1.026  -6.724
  404   1HG2  VAL  51          HG21      VAL  51  -8.962   3.211  -5.663
  405   2HG2  VAL  51          HG22      VAL  51  -9.995   4.446  -6.385
  406   3HG2  VAL  51          HG23      VAL  51  -8.266   4.433  -6.726
  407    H    ASP  52           HN       ASP  52  -9.302   2.338 -10.595
  408    HA   ASP  52           HA       ASP  52  -9.633  -0.455 -10.901
  409   1HB   ASP  52          HB2       ASP  52  -9.226   1.661 -13.045
  410   2HB   ASP  52          HB1       ASP  52  -9.827   0.029 -13.342
  411    H    THR  53           HN       THR  53  -6.922   1.683 -11.668
  412    HA   THR  53           HA       THR  53  -5.342  -0.483 -12.813
  413    HB   THR  53           HB       THR  53  -4.565   2.327 -12.171
  414    HG1  THR  53           HG1      THR  53  -4.722   1.475 -14.752
  415   1HG2  THR  53          HG21      THR  53  -2.592   1.914 -13.524
  416   2HG2  THR  53          HG22      THR  53  -3.145   0.278 -13.877
  417   3HG2  THR  53          HG23      THR  53  -2.645   0.703 -12.244
  418    H    TYR  54           HN       TYR  54  -5.830   0.933  -9.718
  419    HA   TYR  54           HA       TYR  54  -3.764  -0.914  -8.573
  420   1HB   TYR  54          HB2       TYR  54  -4.360   1.942  -7.779
  421   2HB   TYR  54          HB1       TYR  54  -3.458   0.823  -6.766
  422    HD1  TYR  54           HD1      TYR  54  -3.537   2.047 -10.263
  423    HD2  TYR  54           HD2      TYR  54  -1.125   0.768  -6.991
  424    HE1  TYR  54           HE1      TYR  54  -1.531   2.653 -11.558
  425    HE2  TYR  54           HE2      TYR  54   0.923   1.344  -8.270
  426    HH   TYR  54           HH       TYR  54   0.953   3.305 -10.891
  427    H    GLY  55           HN       GLY  55  -5.867  -2.225  -8.433
  428   1HA   GLY  55          HA2       GLY  55  -7.223  -1.605  -5.847
  429   2HA   GLY  55          HA1       GLY  55  -8.201  -1.965  -7.272
  430    H    SER  56           HN       SER  56  -7.240  -4.107  -8.429
  431    HA   SER  56           HA       SER  56  -7.495  -6.191  -6.360
  432   1HB   SER  56          HB2       SER  56  -8.038  -7.623  -8.102
  433   2HB   SER  56          HB1       SER  56  -8.477  -6.084  -8.835
  434    HG   SER  56           HG       SER  56  -6.404  -6.048  -9.794
  435    H    SER  57           HN       SER  57  -4.969  -4.641  -8.102
  436    HA   SER  57           HA       SER  57  -3.044  -6.854  -7.666
  437   1HB   SER  57          HB2       SER  57  -2.760  -4.133  -8.971
  438   2HB   SER  57          HB1       SER  57  -1.419  -5.259  -8.757
  439    HG   SER  57           HG       SER  57  -2.865  -6.804  -9.876
  440    H    ILE  58           HN       ILE  58  -2.794  -3.343  -7.112
  441    HA   ILE  58           HA       ILE  58  -0.884  -3.010  -5.265
  442    HB   ILE  58           HB       ILE  58  -2.517  -1.284  -5.924
  443   1HG1  ILE  58          HG12      ILE  58  -2.024  -1.647  -2.953
  444   2HG1  ILE  58          HG11      ILE  58  -1.088  -0.665  -4.088
  445   1HG2  ILE  58          HG21      ILE  58  -4.690  -1.164  -5.110
  446   2HG2  ILE  58          HG22      ILE  58  -4.333  -2.205  -3.748
  447   3HG2  ILE  58          HG23      ILE  58  -4.489  -2.897  -5.372
  448   1HD1  ILE  58          HD11      ILE  58  -2.465   0.897  -2.929
  449   2HD1  ILE  58          HD12      ILE  58  -3.876  -0.160  -3.026
  450   3HD1  ILE  58          HD13      ILE  58  -3.281   0.651  -4.473
  451    H    LEU  59           HN       LEU  59  -4.057  -4.342  -4.429
  452    HA   LEU  59           HA       LEU  59  -3.215  -4.874  -1.680
  453   1HB   LEU  59          HB2       LEU  59  -5.596  -6.282  -2.883
  454   2HB   LEU  59          HB1       LEU  59  -5.368  -5.686  -1.241
  455    HG   LEU  59           HG       LEU  59  -5.617  -3.874  -3.615
  456   1HD1  LEU  59          HD11      LEU  59  -7.644  -5.214  -3.458
  457   2HD1  LEU  59          HD12      LEU  59  -7.971  -3.558  -2.944
  458   3HD1  LEU  59          HD13      LEU  59  -7.770  -4.832  -1.741
  459   1HD2  LEU  59          HD21      LEU  59  -5.935  -2.128  -2.039
  460   2HD2  LEU  59          HD22      LEU  59  -4.601  -3.071  -1.389
  461   3HD2  LEU  59          HD23      LEU  59  -6.221  -3.268  -0.729
  462    H    SER  60           HN       SER  60  -3.910  -6.910  -4.551
  463    HA   SER  60           HA       SER  60  -2.987  -9.330  -3.190
  464   1HB   SER  60          HB2       SER  60  -3.497  -8.948  -6.142
  465   2HB   SER  60          HB1       SER  60  -3.503 -10.463  -5.242
  466    HG   SER  60           HG       SER  60  -5.615  -9.746  -5.507
  467    H    ILE  61           HN       ILE  61  -1.241  -6.817  -4.387
  468    HA   ILE  61           HA       ILE  61   0.892  -8.493  -5.608
  469    HB   ILE  61           HB       ILE  61  -0.179  -6.241  -6.476
  470   1HG1  ILE  61          HG12      ILE  61   1.680  -7.588  -7.518
  471   2HG1  ILE  61          HG11      ILE  61   1.711  -5.873  -7.874
  472   1HG2  ILE  61          HG21      ILE  61   2.062  -5.160  -4.763
  473   2HG2  ILE  61          HG22      ILE  61   0.337  -4.905  -4.514
  474   3HG2  ILE  61          HG23      ILE  61   1.121  -4.260  -5.945
  475   1HD1  ILE  61          HD11      ILE  61   3.948  -6.798  -7.315
  476   2HD1  ILE  61          HD12      ILE  61   3.351  -7.209  -5.709
  477   3HD1  ILE  61          HD13      ILE  61   3.446  -5.520  -6.209
  478    H    LEU  62           HN       LEU  62   0.716  -5.902  -3.153
  479    HA   LEU  62           HA       LEU  62   3.332  -6.302  -2.147
  480   1HB   LEU  62          HB2       LEU  62   0.891  -5.283  -0.701
  481   2HB   LEU  62          HB1       LEU  62   2.551  -5.128  -0.123
  482    HG   LEU  62           HG       LEU  62   1.553  -4.064  -2.768
  483   1HD1  LEU  62          HD11      LEU  62   2.146  -2.600  -0.186
  484   2HD1  LEU  62          HD12      LEU  62   0.544  -2.855  -0.878
  485   3HD1  LEU  62          HD13      LEU  62   1.715  -1.837  -1.716
  486   1HD2  LEU  62          HD21      LEU  62   3.817  -2.694  -2.332
  487   2HD2  LEU  62          HD22      LEU  62   3.782  -4.240  -3.176
  488   3HD2  LEU  62          HD23      LEU  62   4.226  -4.180  -1.468
  489    H    LEU  63           HN       LEU  63   1.038  -8.614  -2.236
  490    HA   LEU  63           HA       LEU  63   1.591  -9.713   0.467
  491   1HB   LEU  63          HB2       LEU  63  -0.049 -11.203  -1.550
  492   2HB   LEU  63          HB1       LEU  63  -0.273 -11.062   0.192
  493    HG   LEU  63           HG       LEU  63  -0.989  -9.079  -1.970
  494   1HD1  LEU  63          HD11      LEU  63  -2.626 -10.821  -1.439
  495   2HD1  LEU  63          HD12      LEU  63  -3.215  -9.260  -0.870
  496   3HD1  LEU  63          HD13      LEU  63  -2.534 -10.415   0.273
  497   1HD2  LEU  63          HD21      LEU  63  -0.320  -8.539   0.891
  498   2HD2  LEU  63          HD22      LEU  63  -1.817  -7.819   0.317
  499   3HD2  LEU  63          HD23      LEU  63  -0.302  -7.451  -0.496
  500    H    GLU  64           HN       GLU  64   1.887 -10.801  -2.959
  501    HA   GLU  64           HA       GLU  64   4.033 -12.690  -2.020
  502   1HB   GLU  64          HB2       GLU  64   1.872 -13.164  -4.079
  503   2HB   GLU  64          HB1       GLU  64   3.196 -14.279  -3.738
  504   1HG   GLU  64          HG2       GLU  64   1.227 -13.327  -1.639
  505   2HG   GLU  64          HG1       GLU  64   1.045 -14.836  -2.534
  506    H    GLU  65           HN       GLU  65   2.715 -11.337  -5.085
  507    HA   GLU  65           HA       GLU  65   5.017 -11.756  -6.628
  508   1HB   GLU  65          HB2       GLU  65   3.322  -9.251  -6.774
  509   2HB   GLU  65          HB1       GLU  65   4.240  -9.991  -8.085
  510   1HG   GLU  65          HG2       GLU  65   1.867 -11.226  -6.660
  511   2HG   GLU  65          HG1       GLU  65   1.856 -10.552  -8.290
  512    H    VAL  66           HN       VAL  66   4.609  -9.909  -3.921
  513    HA   VAL  66           HA       VAL  66   7.283  -8.645  -4.198
  514    HB   VAL  66           HB       VAL  66   4.594  -7.435  -3.761
  515   1HG1  VAL  66          HG11      VAL  66   5.575  -6.747  -1.720
  516   2HG1  VAL  66          HG12      VAL  66   5.728  -5.382  -2.824
  517   3HG1  VAL  66          HG13      VAL  66   7.123  -6.412  -2.497
  518   1HG2  VAL  66          HG21      VAL  66   5.495  -5.687  -5.186
  519   2HG2  VAL  66          HG22      VAL  66   5.702  -7.285  -5.908
  520   3HG2  VAL  66          HG23      VAL  66   7.074  -6.471  -5.158
  521    H    SER  67           HN       SER  67   8.457  -8.897  -2.310
  522    HA   SER  67           HA       SER  67   7.159 -10.269  -0.039
  523   1HB   SER  67          HB2       SER  67   9.765 -10.268  -1.143
  524   2HB   SER  67          HB1       SER  67   9.941  -9.520   0.440
  525    HG   SER  67           HG       SER  67   8.505 -11.923  -0.029
  526    HA   PRO  68           HA       PRO  68   6.516  -6.680   2.421
  527   1HB   PRO  68          HB2       PRO  68   7.821  -7.479   4.842
  528   2HB   PRO  68          HB1       PRO  68   6.106  -7.651   4.436
  529   1HG   PRO  68          HG2       PRO  68   8.190  -9.731   4.504
  530   2HG   PRO  68          HG1       PRO  68   6.432  -9.925   4.420
  531   1HD   PRO  68          HD2       PRO  68   8.259 -10.359   2.292
  532   2HD   PRO  68          HD1       PRO  68   6.493 -10.241   2.152
  533    H    GLU  69           HN       GLU  69   9.807  -8.002   2.916
  534    HA   GLU  69           HA       GLU  69  11.056  -5.557   3.640
  535   1HB   GLU  69          HB2       GLU  69  12.237  -7.631   3.971
  536   2HB   GLU  69          HB1       GLU  69  12.140  -8.026   2.259
  537   1HG   GLU  69          HG2       GLU  69  14.391  -7.138   3.022
  538   2HG   GLU  69          HG1       GLU  69  13.667  -6.258   1.678
  539    H    LEU  70           HN       LEU  70  10.527  -7.013   0.427
  540    HA   LEU  70           HA       LEU  70  12.007  -5.191  -1.116
  541   1HB   LEU  70          HB2       LEU  70  11.026  -7.109  -2.182
  542   2HB   LEU  70          HB1       LEU  70   9.404  -6.631  -1.688
  543    HG   LEU  70           HG       LEU  70   9.466  -4.695  -3.155
  544   1HD1  LEU  70          HD11      LEU  70  12.350  -5.527  -3.525
  545   2HD1  LEU  70          HD12      LEU  70  11.712  -3.950  -3.069
  546   3HD1  LEU  70          HD13      LEU  70  11.525  -4.527  -4.721
  547   1HD2  LEU  70          HD21      LEU  70  10.607  -6.963  -4.799
  548   2HD2  LEU  70          HD22      LEU  70   9.329  -5.826  -5.229
  549   3HD2  LEU  70          HD23      LEU  70   9.019  -7.095  -4.047
  550    H    VAL  71           HN       VAL  71   8.580  -4.951  -0.098
  551    HA   VAL  71           HA       VAL  71   7.863  -2.542  -1.257
  552    HB   VAL  71           HB       VAL  71   7.224  -2.993   1.658
  553   1HG1  VAL  71          HG11      VAL  71   6.310  -1.068   0.230
  554   2HG1  VAL  71          HG12      VAL  71   5.120  -2.048   1.078
  555   3HG1  VAL  71          HG13      VAL  71   5.398  -2.291  -0.647
  556   1HG2  VAL  71          HG21      VAL  71   5.416  -4.571   0.757
  557   2HG2  VAL  71          HG22      VAL  71   7.061  -5.191   0.808
  558   3HG2  VAL  71          HG23      VAL  71   6.381  -4.651  -0.717
  559    H    CYS  72           HN       CYS  72   9.580  -2.884   1.880
  560    HA   CYS  72           HA       CYS  72   9.942  -0.154   2.441
  561   1HB   CYS  72          HB2       CYS  72  11.912  -2.415   2.818
  562   2HB   CYS  72          HB1       CYS  72  12.076  -0.816   3.536
  563    H    SER  73           HN       SER  73  11.598  -2.196   0.089
  564    HA   SER  73           HA       SER  73  13.583  -0.207  -0.621
  565   1HB   SER  73          HB2       SER  73  13.059  -2.909  -1.302
  566   2HB   SER  73          HB1       SER  73  12.987  -2.017  -2.817
  567    HG   SER  73           HG       SER  73  15.108  -2.535  -2.444
  568    H    MET  74           HN       MET  74  10.617  -1.357  -2.330
  569    HA   MET  74           HA       MET  74  10.541   0.621  -4.330
  570   1HB   MET  74          HB2       MET  74   8.134  -0.416  -2.794
  571   2HB   MET  74          HB1       MET  74   8.124   0.275  -4.415
  572   1HG   MET  74          HG2       MET  74   9.836  -1.628  -4.966
  573   2HG   MET  74          HG1       MET  74   9.197  -2.383  -3.506
  574   1HE   MET  74          HE1       MET  74   5.743  -3.506  -4.233
  575   2HE   MET  74          HE2       MET  74   6.299  -2.204  -3.174
  576   3HE   MET  74          HE3       MET  74   7.254  -3.678  -3.323
  577    H    LEU  75           HN       LEU  75   9.286   0.771  -1.010
  578    HA   LEU  75           HA       LEU  75   8.305   3.465  -1.180
  579   1HB   LEU  75          HB2       LEU  75   9.302   1.974   1.270
  580   2HB   LEU  75          HB1       LEU  75   8.257   3.393   1.275
  581    HG   LEU  75           HG       LEU  75   7.420   0.910  -0.222
  582   1HD1  LEU  75          HD11      LEU  75   6.079   0.451   1.999
  583   2HD1  LEU  75          HD12      LEU  75   7.390   1.359   2.754
  584   3HD1  LEU  75          HD13      LEU  75   7.741  -0.112   1.854
  585   1HD2  LEU  75          HD21      LEU  75   5.930   3.165   1.157
  586   2HD2  LEU  75          HD22      LEU  75   5.161   1.795   0.356
  587   3HD2  LEU  75          HD23      LEU  75   6.115   2.941  -0.584
  588    H    HIS  76           HN       HIS  76  11.485   2.105  -0.644
  589    HA   HIS  76           HA       HIS  76  13.564   3.151  -0.547
  590   1HB   HIS  76          HB2       HIS  76  11.985   4.762  -2.182
  591   2HB   HIS  76          HB1       HIS  76  12.575   5.913  -0.986
  592    HD1  HIS  76           HD1      HIS  76  15.258   6.049  -0.745
  593    HD2  HIS  76           HD2      HIS  76  13.844   3.960  -4.063
  594    HE1  HIS  76           HE1      HIS  76  17.218   5.825  -2.336
  595    H    LEU  77           HN       LEU  77  12.003   2.792   1.834
  596    HA   LEU  77           HA       LEU  77  12.117   5.210   3.448
  597   1HB   LEU  77          HB2       LEU  77  11.843   2.283   4.199
  598   2HB   LEU  77          HB1       LEU  77  11.753   3.600   5.361
  599    HG   LEU  77           HG       LEU  77   9.953   3.494   2.931
  600   1HD1  LEU  77          HD11      LEU  77   9.599   2.214   5.654
  601   2HD1  LEU  77          HD12      LEU  77   9.455   1.454   4.069
  602   3HD1  LEU  77          HD13      LEU  77   8.231   2.602   4.609
  603   1HD2  LEU  77          HD21      LEU  77   9.920   5.658   3.954
  604   2HD2  LEU  77          HD22      LEU  77   9.922   4.975   5.579
  605   3HD2  LEU  77          HD23      LEU  77   8.489   4.838   4.567
  606    H    CYS  78           HN       CYS  78  14.449   3.003   2.356
  607    HA   CYS  78           HA       CYS  78  16.308   3.647   4.625
  608   1HB   CYS  78          HB2       CYS  78  15.775   1.202   3.861
  609   2HB   CYS  78          HB1       CYS  78  16.862   1.560   2.520
  610    H    SER  79           HN       SER  79  15.792   5.631   2.608
  611    HA   SER  79           HA       SER  79  17.775   5.575   0.530
  612   1HB   SER  79          HB2       SER  79  17.233   7.870   0.168
  613   2HB   SER  79          HB1       SER  79  15.733   7.114   0.701
  614    HG   SER  79           HG       SER  79  15.896   8.836   1.997
  615    H    GLY  80           HN       GLY  80  19.782   4.982   1.458
  616   1HA   GLY  80          HA2       GLY  80  20.884   6.530   3.700
  617   2HA   GLY  80          HA1       GLY  80  21.705   5.231   2.831
  618    H    LEU  81           HN       LEU  81  21.265   6.323   0.209
  619    HA   LEU  81           HA       LEU  81  23.039   8.723   0.258
  620   1HB   LEU  81          HB2       LEU  81  23.676   7.792  -2.098
  621   2HB   LEU  81          HB1       LEU  81  24.380   7.031  -0.675
  622    HG   LEU  81           HG       LEU  81  22.701   5.276  -0.728
  623   1HD1  LEU  81          HD11      LEU  81  21.256   5.201  -2.900
  624   2HD1  LEU  81          HD12      LEU  81  21.571   6.933  -2.991
  625   3HD1  LEU  81          HD13      LEU  81  20.730   6.259  -1.595
  626   1HD2  LEU  81          HD21      LEU  81  23.341   4.270  -2.956
  627   2HD2  LEU  81          HD22      LEU  81  24.699   4.847  -1.992
  628   3HD2  LEU  81          HD23      LEU  81  24.112   5.806  -3.349
  629    H    VAL  82           HN       VAL  82  22.803   9.570  -2.278
  630    HA   VAL  82           HA       VAL  82  20.015  10.394  -2.333
  631    HB   VAL  82           HB       VAL  82  20.756  11.583  -4.507
  632   1HG1  VAL  82          HG11      VAL  82  21.799  13.387  -3.201
  633   2HG1  VAL  82          HG12      VAL  82  22.060  12.272  -1.858
  634   3HG1  VAL  82          HG13      VAL  82  20.417  12.701  -2.343
  635   1HG2  VAL  82          HG21      VAL  82  23.464  10.868  -3.324
  636   2HG2  VAL  82          HG22      VAL  82  23.176  11.886  -4.734
  637   3HG2  VAL  82          HG23      VAL  82  22.802  10.165  -4.800
  638    HA   PRO  83           HA       PRO  83  18.768   6.913  -4.801
  639   1HB   PRO  83          HB2       PRO  83  16.710   8.619  -6.061
  640   2HB   PRO  83          HB1       PRO  83  16.509   7.164  -5.070
  641   1HG   PRO  83          HG2       PRO  83  16.019   9.800  -4.209
  642   2HG   PRO  83          HG1       PRO  83  16.207   8.384  -3.168
  643   1HD   PRO  83          HD2       PRO  83  18.066  10.629  -3.523
  644   2HD   PRO  83          HD1       PRO  83  18.104   9.307  -2.325
  645    H    ARG  84           HN       ARG  84  19.308   6.262  -6.965
  646    HA   ARG  84           HA       ARG  84  20.730   8.249  -8.587
  647   1HB   ARG  84          HB2       ARG  84  20.196   5.284  -8.863
  648   2HB   ARG  84          HB1       ARG  84  20.912   6.203 -10.182
  649   1HG   ARG  84          HG2       ARG  84  22.780   5.369  -9.009
  650   2HG   ARG  84          HG1       ARG  84  22.635   7.020  -8.421
  651   1HD   ARG  84          HD2       ARG  84  23.005   5.384  -6.588
  652   2HD   ARG  84          HD1       ARG  84  21.477   6.244  -6.419
  653    HE   ARG  84           HE       ARG  84  20.797   3.946  -7.814
  654   1HH1  ARG  84          HH21      ARG  84  22.470   4.707  -4.899
  655   2HH1  ARG  84          HH22      ARG  84  22.004   3.247  -4.092
  656   1HH2  ARG  84          HH11      ARG  84  20.179   2.033  -6.779
  657   2HH2  ARG  84          HH12      ARG  84  20.707   1.733  -5.156
  Start of MODEL   12
    1   1H    SER   1           HT1      SER   1  22.681   6.776   6.033
    2   2H    SER   1           HT2      SER   1  21.488   5.842   5.264
    3   3H    SER   1           HT3      SER   1  23.133   5.505   5.004
    4    HA   SER   1           HA       SER   1  23.409   4.472   7.000
    5   1HB   SER   1          HB2       SER   1  22.096   4.986   8.977
    6   2HB   SER   1          HB1       SER   1  22.624   6.501   8.251
    7    HG   SER   1           HG       SER   1  20.084   5.262   8.163
    8    H    ASP   2           HN       ASP   2  21.011   3.544   8.511
    9    HA   ASP   2           HA       ASP   2  19.130   2.398   6.653
   10   1HB   ASP   2          HB2       ASP   2  19.917   0.009   6.958
   11   2HB   ASP   2          HB1       ASP   2  20.958   1.001   5.935
   12    H    VAL   3           HN       VAL   3  18.414   3.671   8.818
   13    HA   VAL   3           HA       VAL   3  18.185   1.819  11.112
   14    HB   VAL   3           HB       VAL   3  17.311   4.673  10.772
   15   1HG1  VAL   3          HG11      VAL   3  15.895   3.731  12.432
   16   2HG1  VAL   3          HG12      VAL   3  17.194   4.509  13.335
   17   3HG1  VAL   3          HG13      VAL   3  17.206   2.762  13.102
   18   1HG2  VAL   3          HG21      VAL   3  19.228   5.193  12.201
   19   2HG2  VAL   3          HG22      VAL   3  19.774   4.309  10.776
   20   3HG2  VAL   3          HG23      VAL   3  19.620   3.478  12.325
   21    H    TYR   4           HN       TYR   4  16.057   3.656   8.914
   22    HA   TYR   4           HA       TYR   4  13.651   2.433  10.000
   23   1HB   TYR   4          HB2       TYR   4  14.309   4.288   7.736
   24   2HB   TYR   4          HB1       TYR   4  12.768   3.440   7.668
   25    HD1  TYR   4           HD1      TYR   4  14.588   4.607  10.712
   26    HD2  TYR   4           HD2      TYR   4  11.209   5.171   8.125
   27    HE1  TYR   4           HE1      TYR   4  13.627   6.218  12.325
   28    HE2  TYR   4           HE2      TYR   4  10.243   6.785   9.736
   29    HH   TYR   4           HH       TYR   4  11.457   8.390  11.680
   30    H    CYS   5           HN       CYS   5  15.589   1.930   7.039
   31    HA   CYS   5           HA       CYS   5  14.043   0.051   5.695
   32   1HB   CYS   5          HB2       CYS   5  17.010   0.320   6.086
   33   2HB   CYS   5          HB1       CYS   5  16.377  -1.058   5.187
   34    H    GLU   6           HN       GLU   6  15.857  -0.408   8.678
   35    HA   GLU   6           HA       GLU   6  15.357  -3.307   8.711
   36   1HB   GLU   6          HB2       GLU   6  16.440  -1.458  10.860
   37   2HB   GLU   6          HB1       GLU   6  16.439  -3.221  10.927
   38   1HG   GLU   6          HG2       GLU   6  17.790  -1.629   8.731
   39   2HG   GLU   6          HG1       GLU   6  18.628  -2.222  10.166
   40    H    VAL   7           HN       VAL   7  14.327  -0.498  10.683
   41    HA   VAL   7           HA       VAL   7  12.473  -1.855  12.323
   42    HB   VAL   7           HB       VAL   7  12.262   0.963  11.217
   43   1HG1  VAL   7          HG11      VAL   7  10.974   1.315  13.371
   44   2HG1  VAL   7          HG12      VAL   7  10.949  -0.438  13.559
   45   3HG1  VAL   7          HG13      VAL   7  10.153   0.311  12.176
   46   1HG2  VAL   7          HG21      VAL   7  13.542   1.672  13.089
   47   2HG2  VAL   7          HG22      VAL   7  14.399   0.252  12.489
   48   3HG2  VAL   7          HG23      VAL   7  13.360   0.118  13.907
   49    H    CYS   8           HN       CYS   8  11.767  -0.069   9.294
   50    HA   CYS   8           HA       CYS   8   9.057  -0.756   9.071
   51   1HB   CYS   8          HB2       CYS   8   9.270  -0.315   6.692
   52   2HB   CYS   8          HB1       CYS   8  10.285   0.828   7.569
   53    H    GLU   9           HN       GLU   9  11.833  -2.521   7.678
   54    HA   GLU   9           HA       GLU   9  10.582  -4.661   6.435
   55   1HB   GLU   9          HB2       GLU   9  13.045  -4.619   6.540
   56   2HB   GLU   9          HB1       GLU   9  12.996  -4.952   8.279
   57   1HG   GLU   9          HG2       GLU   9  12.099  -7.134   7.924
   58   2HG   GLU   9          HG1       GLU   9  11.748  -6.793   6.230
   59    H    PHE  10           HN       PHE  10  10.914  -4.242   9.939
   60    HA   PHE  10           HA       PHE  10   9.682  -6.824  10.516
   61   1HB   PHE  10          HB2       PHE  10  11.259  -5.842  12.109
   62   2HB   PHE  10          HB1       PHE  10  10.224  -4.425  12.289
   63    HD1  PHE  10           HD1      PHE  10  10.412  -8.098  12.847
   64    HD2  PHE  10           HD2      PHE  10   8.317  -4.453  13.724
   65    HE1  PHE  10           HE1      PHE  10   9.115  -9.267  14.608
   66    HE2  PHE  10           HE2      PHE  10   7.020  -5.621  15.485
   67    HZ   PHE  10           HZ       PHE  10   7.419  -8.028  15.928
   68    H    LEU  11           HN       LEU  11   8.575  -3.516  10.122
   69    HA   LEU  11           HA       LEU  11   5.924  -4.091  11.231
   70   1HB   LEU  11          HB2       LEU  11   7.014  -1.725   9.686
   71   2HB   LEU  11          HB1       LEU  11   5.389  -1.799  10.362
   72    HG   LEU  11           HG       LEU  11   7.931  -2.118  11.983
   73   1HD1  LEU  11          HD11      LEU  11   6.143   0.273  11.485
   74   2HD1  LEU  11          HD12      LEU  11   7.877   0.140  11.187
   75   3HD1  LEU  11          HD13      LEU  11   7.267   0.184  12.841
   76   1HD2  LEU  11          HD21      LEU  11   6.084  -1.463  13.804
   77   2HD2  LEU  11          HD22      LEU  11   6.299  -3.133  13.297
   78   3HD2  LEU  11          HD23      LEU  11   4.986  -2.170  12.617
   79    H    VAL  12           HN       VAL  12   7.295  -3.586   7.973
   80    HA   VAL  12           HA       VAL  12   4.793  -3.870   6.614
   81    HB   VAL  12           HB       VAL  12   7.486  -4.644   5.480
   82   1HG1  VAL  12          HG11      VAL  12   6.474  -3.986   3.371
   83   2HG1  VAL  12          HG12      VAL  12   5.026  -3.418   4.201
   84   3HG1  VAL  12          HG13      VAL  12   5.406  -5.139   4.171
   85   1HG2  VAL  12          HG21      VAL  12   7.867  -2.476   6.396
   86   2HG2  VAL  12          HG22      VAL  12   6.250  -1.924   5.969
   87   3HG2  VAL  12          HG23      VAL  12   7.456  -2.178   4.709
   88    H    LYS  13           HN       LYS  13   7.082  -6.259   7.862
   89    HA   LYS  13           HA       LYS  13   5.828  -8.438   6.369
   90   1HB   LYS  13          HB2       LYS  13   7.444  -9.848   7.278
   91   2HB   LYS  13          HB1       LYS  13   8.269  -8.306   7.147
   92   1HG   LYS  13          HG2       LYS  13   8.800  -8.444   9.318
   93   2HG   LYS  13          HG1       LYS  13   7.116  -8.304   9.740
   94   1HD   LYS  13          HD2       LYS  13   8.365 -10.967   9.026
   95   2HD   LYS  13          HD1       LYS  13   8.423 -10.322  10.661
   96   1HE   LYS  13          HE2       LYS  13   5.945 -10.115  10.630
   97   2HE   LYS  13          HE1       LYS  13   5.931 -10.906   9.054
   98   1HZ   LYS  13          HZ1       LYS  13   6.627 -12.890   9.941
   99   2HZ   LYS  13          HZ2       LYS  13   5.636 -12.305  11.192
  100   3HZ   LYS  13          HZ3       LYS  13   7.326 -12.172  11.310
  101    H    GLU  14           HN       GLU  14   5.476  -7.020   9.564
  102    HA   GLU  14           HA       GLU  14   3.825  -9.174  10.623
  103   1HB   GLU  14          HB2       GLU  14   5.129  -7.491  12.018
  104   2HB   GLU  14          HB1       GLU  14   3.921  -6.292  11.562
  105   1HG   GLU  14          HG2       GLU  14   3.159  -8.929  12.834
  106   2HG   GLU  14          HG1       GLU  14   3.539  -7.499  13.792
  107    H    VAL  15           HN       VAL  15   3.034  -5.816   9.688
  108    HA   VAL  15           HA       VAL  15   0.259  -5.938   9.734
  109    HB   VAL  15           HB       VAL  15   1.655  -3.930   9.068
  110   1HG1  VAL  15          HG11      VAL  15   2.968  -5.266   7.347
  111   2HG1  VAL  15          HG12      VAL  15   2.386  -3.694   6.799
  112   3HG1  VAL  15          HG13      VAL  15   1.549  -5.167   6.305
  113   1HG2  VAL  15          HG21      VAL  15  -0.756  -4.805   7.463
  114   2HG2  VAL  15          HG22      VAL  15  -0.045  -3.204   7.259
  115   3HG2  VAL  15          HG23      VAL  15  -0.696  -3.688   8.825
  116    H    THR  16           HN       THR  16   2.467  -7.184   7.275
  117    HA   THR  16           HA       THR  16   0.584  -8.060   5.371
  118    HB   THR  16           HB       THR  16   2.669 -10.039   5.601
  119    HG1  THR  16           HG1      THR  16   3.952  -7.655   5.582
  120   1HG2  THR  16          HG21      THR  16   1.850  -9.200   3.470
  121   2HG2  THR  16          HG22      THR  16   3.565  -8.780   3.610
  122   3HG2  THR  16          HG23      THR  16   2.328  -7.551   3.897
  123    H    LYS  17           HN       LYS  17   1.830  -9.754   8.273
  124    HA   LYS  17           HA       LYS  17   0.535 -12.203   8.020
  125   1HB   LYS  17          HB2       LYS  17   1.020 -10.499  10.476
  126   2HB   LYS  17          HB1       LYS  17   0.292 -12.096  10.589
  127   1HG   LYS  17          HG2       LYS  17   2.848 -11.786   9.027
  128   2HG   LYS  17          HG1       LYS  17   2.926 -11.801  10.787
  129   1HD   LYS  17          HD2       LYS  17   1.973 -13.982  10.917
  130   2HD   LYS  17          HD1       LYS  17   1.467 -13.947   9.229
  131   1HE   LYS  17          HE2       LYS  17   3.515 -15.326   9.585
  132   2HE   LYS  17          HE1       LYS  17   3.793 -13.972   8.490
  133   1HZ   LYS  17          HZ1       LYS  17   4.727 -12.713  10.306
  134   2HZ   LYS  17          HZ2       LYS  17   5.550 -14.192  10.152
  135   3HZ   LYS  17          HZ3       LYS  17   4.411 -13.974  11.394
  136    H    LEU  18           HN       LEU  18  -0.869  -9.102   8.992
  137    HA   LEU  18           HA       LEU  18  -3.546 -10.386   9.281
  138   1HB   LEU  18          HB2       LEU  18  -3.990  -8.673  10.726
  139   2HB   LEU  18          HB1       LEU  18  -2.273  -8.311  10.631
  140    HG   LEU  18           HG       LEU  18  -2.831  -6.822   8.626
  141   1HD1  LEU  18          HD11      LEU  18  -5.400  -7.999   8.988
  142   2HD1  LEU  18          HD12      LEU  18  -4.956  -6.720   7.863
  143   3HD1  LEU  18          HD13      LEU  18  -5.571  -6.306   9.460
  144   1HD2  LEU  18          HD21      LEU  18  -4.027  -6.118  11.324
  145   2HD2  LEU  18          HD22      LEU  18  -3.519  -4.968  10.086
  146   3HD2  LEU  18          HD23      LEU  18  -2.321  -5.979  10.895
  147    H    ILE  19           HN       ILE  19  -1.811  -8.156   7.158
  148    HA   ILE  19           HA       ILE  19  -4.118  -7.556   5.513
  149    HB   ILE  19           HB       ILE  19  -1.285  -6.913   5.686
  150   1HG1  ILE  19          HG12      ILE  19  -3.352  -5.401   4.125
  151   2HG1  ILE  19          HG11      ILE  19  -3.324  -5.380   5.884
  152   1HG2  ILE  19          HG21      ILE  19  -0.966  -8.109   3.622
  153   2HG2  ILE  19          HG22      ILE  19  -0.928  -6.381   3.281
  154   3HG2  ILE  19          HG23      ILE  19  -2.371  -7.320   2.902
  155   1HD1  ILE  19          HD11      ILE  19  -0.655  -4.886   5.122
  156   2HD1  ILE  19          HD12      ILE  19  -1.834  -3.709   5.717
  157   3HD1  ILE  19          HD13      ILE  19  -1.651  -3.964   3.988
  158    H    ASP  20           HN       ASP  20  -2.069 -10.241   5.905
  159    HA   ASP  20           HA       ASP  20  -1.683 -11.372   3.424
  160   1HB   ASP  20          HB2       ASP  20  -1.095 -12.439   5.611
  161   2HB   ASP  20          HB1       ASP  20  -2.791 -12.878   5.818
  162    H    ASN  21           HN       ASN  21  -4.681 -11.920   5.358
  163    HA   ASN  21           HA       ASN  21  -6.320 -11.637   2.962
  164   1HB   ASN  21          HB2       ASN  21  -5.920 -14.334   4.262
  165   2HB   ASN  21          HB1       ASN  21  -7.291 -13.966   3.209
  166   1HD2  ASN  21          HD21      ASN  21  -3.746 -14.328   3.264
  167   2HD2  ASN  21          HD22      ASN  21  -3.567 -14.467   1.582
  168    H    ASN  22           HN       ASN  22  -6.055 -10.734   5.862
  169    HA   ASN  22           HA       ASN  22  -8.476 -11.683   7.145
  170   1HB   ASN  22          HB2       ASN  22  -6.912  -9.141   7.661
  171   2HB   ASN  22          HB1       ASN  22  -8.044  -9.921   8.769
  172   1HD2  ASN  22          HD21      ASN  22  -5.526 -11.496   6.707
  173   2HD2  ASN  22          HD22      ASN  22  -4.679 -12.172   8.016
  174    H    LYS  23           HN       LYS  23  -7.518  -8.833   5.269
  175    HA   LYS  23           HA       LYS  23 -10.395  -8.046   5.037
  176   1HB   LYS  23          HB2       LYS  23  -9.673  -5.872   4.878
  177   2HB   LYS  23          HB1       LYS  23  -8.184  -6.496   5.572
  178   1HG   LYS  23          HG2       LYS  23  -8.768  -6.069   2.622
  179   2HG   LYS  23          HG1       LYS  23  -7.671  -5.125   3.623
  180   1HD   LYS  23          HD2       LYS  23  -6.984  -7.979   3.758
  181   2HD   LYS  23          HD1       LYS  23  -6.994  -7.411   2.090
  182   1HE   LYS  23          HE2       LYS  23  -5.586  -5.959   4.327
  183   2HE   LYS  23          HE1       LYS  23  -4.795  -7.166   3.313
  184   1HZ   LYS  23          HZ1       LYS  23  -5.624  -4.462   2.672
  185   2HZ   LYS  23          HZ2       LYS  23  -5.931  -5.622   1.468
  186   3HZ   LYS  23          HZ3       LYS  23  -4.349  -5.386   2.040
  187    H    THR  24           HN       THR  24 -11.021  -7.385   2.746
  188    HA   THR  24           HA       THR  24  -9.624  -9.044   0.674
  189    HB   THR  24           HB       THR  24 -11.951  -9.447  -0.274
  190    HG1  THR  24           HG1      THR  24 -12.984  -7.821   0.953
  191   1HG2  THR  24          HG21      THR  24 -12.370 -11.332   1.194
  192   2HG2  THR  24          HG22      THR  24 -11.460 -10.570   2.498
  193   3HG2  THR  24          HG23      THR  24 -10.624 -11.128   1.049
  194    H    GLU  25           HN       GLU  25 -10.969  -8.288  -1.559
  195    HA   GLU  25           HA       GLU  25 -10.166  -5.462  -1.786
  196   1HB   GLU  25          HB2       GLU  25 -11.413  -7.127  -3.979
  197   2HB   GLU  25          HB1       GLU  25 -10.309  -5.759  -4.130
  198   1HG   GLU  25          HG2       GLU  25  -8.612  -7.233  -2.843
  199   2HG   GLU  25          HG1       GLU  25  -9.691  -8.574  -3.226
  200    H    LYS  26           HN       LYS  26 -12.914  -6.828  -0.676
  201    HA   LYS  26           HA       LYS  26 -14.831  -5.142  -2.156
  202   1HB   LYS  26          HB2       LYS  26 -15.066  -7.077   0.161
  203   2HB   LYS  26          HB1       LYS  26 -16.419  -6.073  -0.359
  204   1HG   LYS  26          HG2       LYS  26 -16.608  -7.146  -2.429
  205   2HG   LYS  26          HG1       LYS  26 -14.939  -7.711  -2.413
  206   1HD   LYS  26          HD2       LYS  26 -16.856  -8.723  -0.314
  207   2HD   LYS  26          HD1       LYS  26 -16.908  -9.409  -1.936
  208   1HE   LYS  26          HE2       LYS  26 -14.276  -9.169  -0.482
  209   2HE   LYS  26          HE1       LYS  26 -15.356 -10.527  -0.162
  210   1HZ   LYS  26          HZ1       LYS  26 -13.706 -10.014  -2.442
  211   2HZ   LYS  26          HZ2       LYS  26 -15.314 -10.344  -2.877
  212   3HZ   LYS  26          HZ3       LYS  26 -14.438 -11.459  -1.941
  213    H    GLU  27           HN       GLU  27 -13.197  -5.300   0.957
  214    HA   GLU  27           HA       GLU  27 -14.571  -3.005   2.071
  215   1HB   GLU  27          HB2       GLU  27 -11.939  -4.287   2.867
  216   2HB   GLU  27          HB1       GLU  27 -12.837  -3.114   3.830
  217   1HG   GLU  27          HG2       GLU  27 -13.965  -5.785   2.943
  218   2HG   GLU  27          HG1       GLU  27 -13.224  -5.502   4.518
  219    H    ILE  28           HN       ILE  28 -11.998  -3.441  -0.166
  220    HA   ILE  28           HA       ILE  28 -10.781  -0.809   0.366
  221    HB   ILE  28           HB       ILE  28 -10.261  -2.801  -1.855
  222   1HG1  ILE  28          HG12      ILE  28  -9.782  -3.880   0.255
  223   2HG1  ILE  28          HG11      ILE  28  -8.249  -3.404  -0.462
  224   1HG2  ILE  28          HG21      ILE  28  -8.814  -0.360  -0.839
  225   2HG2  ILE  28          HG22      ILE  28  -9.461  -0.645  -2.454
  226   3HG2  ILE  28          HG23      ILE  28  -8.060  -1.550  -1.896
  227   1HD1  ILE  28          HD11      ILE  28  -8.006  -2.697   1.748
  228   2HD1  ILE  28          HD12      ILE  28  -9.693  -2.205   1.880
  229   3HD1  ILE  28          HD13      ILE  28  -8.558  -1.224   0.953
  230    H    LEU  29           HN       LEU  29 -11.782  -2.270  -2.721
  231    HA   LEU  29           HA       LEU  29 -12.127   0.066  -4.154
  232   1HB   LEU  29          HB2       LEU  29 -14.006  -2.307  -4.350
  233   2HB   LEU  29          HB1       LEU  29 -13.647  -1.140  -5.621
  234    HG   LEU  29           HG       LEU  29 -11.581  -2.961  -4.345
  235   1HD1  LEU  29          HD11      LEU  29 -11.687  -4.070  -6.652
  236   2HD1  LEU  29          HD12      LEU  29 -13.214  -3.213  -6.875
  237   3HD1  LEU  29          HD13      LEU  29 -13.043  -4.385  -5.568
  238   1HD2  LEU  29          HD21      LEU  29 -10.429  -1.095  -5.233
  239   2HD2  LEU  29          HD22      LEU  29 -11.535  -0.945  -6.599
  240   3HD2  LEU  29          HD23      LEU  29 -10.369  -2.269  -6.548
  241    H    ASP  30           HN       ASP  30 -14.279  -1.259  -1.708
  242    HA   ASP  30           HA       ASP  30 -16.453   0.586  -2.302
  243   1HB   ASP  30          HB2       ASP  30 -15.814  -1.014   0.201
  244   2HB   ASP  30          HB1       ASP  30 -17.315  -0.129  -0.071
  245    H    ALA  31           HN       ALA  31 -13.876   0.437   0.174
  246    HA   ALA  31           HA       ALA  31 -14.374   2.793   1.576
  247   1HB   ALA  31          HB1       ALA  31 -12.072   2.867   2.131
  248   2HB   ALA  31          HB2       ALA  31 -11.608   2.034   0.642
  249   3HB   ALA  31          HB3       ALA  31 -12.455   1.161   1.918
  250    H    PHE  32           HN       PHE  32 -12.350   2.580  -1.386
  251    HA   PHE  32           HA       PHE  32 -11.961   5.345  -1.720
  252   1HB   PHE  32          HB2       PHE  32 -12.290   3.128  -3.757
  253   2HB   PHE  32          HB1       PHE  32 -11.914   4.785  -4.225
  254    HD1  PHE  32           HD1      PHE  32  -9.836   5.896  -3.267
  255    HD2  PHE  32           HD2      PHE  32 -10.604   1.686  -2.881
  256    HE1  PHE  32           HE1      PHE  32  -7.445   5.509  -2.736
  257    HE2  PHE  32           HE2      PHE  32  -8.209   1.304  -2.356
  258    HZ   PHE  32           HZ       PHE  32  -6.635   3.206  -2.280
  259    H    ASP  33           HN       ASP  33 -14.810   3.368  -2.422
  260    HA   ASP  33           HA       ASP  33 -16.217   5.480  -3.823
  261   1HB   ASP  33          HB2       ASP  33 -16.748   2.939  -3.819
  262   2HB   ASP  33          HB1       ASP  33 -17.562   3.249  -2.285
  263    H    LYS  34           HN       LYS  34 -15.199   5.179  -0.681
  264    HA   LYS  34           HA       LYS  34 -17.462   6.801   0.442
  265   1HB   LYS  34          HB2       LYS  34 -15.232   5.346   1.911
  266   2HB   LYS  34          HB1       LYS  34 -16.621   6.152   2.645
  267   1HG   LYS  34          HG2       LYS  34 -18.152   4.580   1.587
  268   2HG   LYS  34          HG1       LYS  34 -16.819   3.827   0.718
  269   1HD   LYS  34          HD2       LYS  34 -15.848   3.539   3.220
  270   2HD   LYS  34          HD1       LYS  34 -17.563   3.612   3.619
  271   1HE   LYS  34          HE2       LYS  34 -16.381   1.723   1.564
  272   2HE   LYS  34          HE1       LYS  34 -16.706   1.285   3.238
  273   1HZ   LYS  34          HZ1       LYS  34 -18.918   2.551   1.882
  274   2HZ   LYS  34          HZ2       LYS  34 -18.894   1.167   2.867
  275   3HZ   LYS  34          HZ3       LYS  34 -18.472   1.052   1.225
  276    H    MET  35           HN       MET  35 -13.933   6.589   1.073
  277    HA   MET  35           HA       MET  35 -13.749   9.326   1.914
  278   1HB   MET  35          HB2       MET  35 -11.386   7.875   0.717
  279   2HB   MET  35          HB1       MET  35 -11.412   9.043   2.028
  280   1HG   MET  35          HG2       MET  35 -12.005   7.462   3.616
  281   2HG   MET  35          HG1       MET  35 -12.875   6.460   2.462
  282   1HE   MET  35          HE1       MET  35 -11.948   5.613   0.522
  283   2HE   MET  35          HE2       MET  35 -10.825   4.284   0.759
  284   3HE   MET  35          HE3       MET  35 -10.263   5.790   0.035
  285    H    CYS  36           HN       CYS  36 -12.873   7.739  -1.155
  286    HA   CYS  36           HA       CYS  36 -12.242  10.280  -2.420
  287   1HB   CYS  36          HB2       CYS  36 -12.030   7.445  -3.039
  288   2HB   CYS  36          HB1       CYS  36 -12.714   8.307  -4.424
  289    H    SER  37           HN       SER  37 -14.992   9.552  -1.203
  290    HA   SER  37           HA       SER  37 -16.779   9.881  -3.531
  291   1HB   SER  37          HB2       SER  37 -17.225   8.470  -1.374
  292   2HB   SER  37          HB1       SER  37 -17.664  10.010  -0.650
  293    HG   SER  37           HG       SER  37 -19.259  10.250  -2.163
  294    H    LYS  38           HN       LYS  38 -16.029  11.632  -0.509
  295    HA   LYS  38           HA       LYS  38 -17.483  14.009  -1.207
  296   1HB   LYS  38          HB2       LYS  38 -16.157  15.061   0.616
  297   2HB   LYS  38          HB1       LYS  38 -16.843  13.515   1.115
  298   1HG   LYS  38          HG2       LYS  38 -14.585  12.496   0.332
  299   2HG   LYS  38          HG1       LYS  38 -13.983  14.150   0.382
  300   1HD   LYS  38          HD2       LYS  38 -14.844  14.272   2.768
  301   2HD   LYS  38          HD1       LYS  38 -15.129  12.533   2.669
  302   1HE   LYS  38          HE2       LYS  38 -12.929  12.988   3.675
  303   2HE   LYS  38          HE1       LYS  38 -12.744  12.176   2.120
  304   1HZ   LYS  38          HZ1       LYS  38 -11.407  14.350   2.730
  305   2HZ   LYS  38          HZ2       LYS  38 -12.806  15.097   2.119
  306   3HZ   LYS  38          HZ3       LYS  38 -11.913  14.028   1.145
  307    H    LEU  39           HN       LEU  39 -14.402  12.752  -2.127
  308    HA   LEU  39           HA       LEU  39 -12.932  15.043  -2.739
  309   1HB   LEU  39          HB2       LEU  39 -12.842  12.262  -3.492
  310   2HB   LEU  39          HB1       LEU  39 -12.694  13.182  -4.971
  311    HG   LEU  39           HG       LEU  39 -10.904  14.531  -3.368
  312   1HD1  LEU  39          HD11      LEU  39 -10.378  11.661  -2.658
  313   2HD1  LEU  39          HD12      LEU  39 -11.405  12.655  -1.625
  314   3HD1  LEU  39          HD13      LEU  39  -9.734  13.128  -1.923
  315   1HD2  LEU  39          HD21      LEU  39  -9.161  13.287  -4.576
  316   2HD2  LEU  39          HD22      LEU  39 -10.509  13.689  -5.633
  317   3HD2  LEU  39          HD23      LEU  39 -10.345  12.052  -5.011
  318    HA   PRO  40           HA       PRO  40 -15.535  17.151  -5.700
  319   1HB   PRO  40          HB2       PRO  40 -13.264  18.027  -7.309
  320   2HB   PRO  40          HB1       PRO  40 -14.279  18.996  -6.233
  321   1HG   PRO  40          HG2       PRO  40 -11.568  18.102  -5.768
  322   2HG   PRO  40          HG1       PRO  40 -12.588  19.067  -4.689
  323   1HD   PRO  40          HD2       PRO  40 -11.814  16.329  -4.348
  324   2HD   PRO  40          HD1       PRO  40 -12.917  17.261  -3.324
  325    H    LYS  41           HN       LYS  41 -16.519  16.263  -7.493
  326    HA   LYS  41           HA       LYS  41 -16.055  13.818  -8.585
  327   1HB   LYS  41          HB2       LYS  41 -17.945  15.359  -9.144
  328   2HB   LYS  41          HB1       LYS  41 -16.859  16.197 -10.251
  329   1HG   LYS  41          HG2       LYS  41 -16.546  14.205 -11.565
  330   2HG   LYS  41          HG1       LYS  41 -17.456  13.238 -10.405
  331   1HD   LYS  41          HD2       LYS  41 -19.508  14.059 -11.103
  332   2HD   LYS  41          HD1       LYS  41 -18.853  15.637 -11.539
  333   1HE   LYS  41          HE2       LYS  41 -17.811  14.682 -13.534
  334   2HE   LYS  41          HE1       LYS  41 -18.401  13.078 -13.099
  335   1HZ   LYS  41          HZ1       LYS  41 -20.424  13.542 -13.873
  336   2HZ   LYS  41          HZ2       LYS  41 -19.716  14.879 -14.645
  337   3HZ   LYS  41          HZ3       LYS  41 -20.466  15.068 -13.134
  338    H    SER  42           HN       SER  42 -14.541  16.790  -9.717
  339    HA   SER  42           HA       SER  42 -13.155  15.835 -11.961
  340   1HB   SER  42          HB2       SER  42 -12.251  17.817  -9.858
  341   2HB   SER  42          HB1       SER  42 -11.473  17.607 -11.425
  342    HG   SER  42           HG       SER  42 -13.096  18.599 -12.367
  343    H    LEU  43           HN       LEU  43 -11.736  16.169  -8.699
  344    HA   LEU  43           HA       LEU  43  -9.556  14.366  -9.404
  345   1HB   LEU  43          HB2       LEU  43 -10.375  15.659  -6.798
  346   2HB   LEU  43          HB1       LEU  43  -8.929  14.669  -6.986
  347    HG   LEU  43           HG       LEU  43  -8.348  17.023  -7.147
  348   1HD1  LEU  43          HD11      LEU  43  -7.381  15.182  -8.773
  349   2HD1  LEU  43          HD12      LEU  43  -6.961  16.879  -8.992
  350   3HD1  LEU  43          HD13      LEU  43  -8.197  16.143 -10.009
  351   1HD2  LEU  43          HD21      LEU  43  -9.985  17.333  -9.645
  352   2HD2  LEU  43          HD22      LEU  43  -9.380  18.571  -8.549
  353   3HD2  LEU  43          HD23      LEU  43 -10.750  17.570  -8.070
  354    H    SER  44           HN       SER  44 -12.749  13.823  -8.491
  355    HA   SER  44           HA       SER  44 -12.199  11.475  -6.805
  356   1HB   SER  44          HB2       SER  44 -14.471  11.460  -6.384
  357   2HB   SER  44          HB1       SER  44 -14.384  13.110  -6.985
  358    HG   SER  44           HG       SER  44 -15.125  10.748  -8.357
  359    H    GLU  45           HN       GLU  45 -12.620  12.394 -10.080
  360    HA   GLU  45           HA       GLU  45 -13.092   9.681 -11.044
  361   1HB   GLU  45          HB2       GLU  45 -12.585  12.328 -12.411
  362   2HB   GLU  45          HB1       GLU  45 -12.703  10.814 -13.309
  363   1HG   GLU  45          HG2       GLU  45 -14.955  10.434 -12.479
  364   2HG   GLU  45          HG1       GLU  45 -14.843  11.845 -11.426
  365    H    GLU  46           HN       GLU  46 -10.459  11.936 -10.585
  366    HA   GLU  46           HA       GLU  46  -8.517  10.286 -12.037
  367   1HB   GLU  46          HB2       GLU  46  -8.106  12.667 -10.202
  368   2HB   GLU  46          HB1       GLU  46  -6.878  11.944 -11.241
  369   1HG   GLU  46          HG2       GLU  46  -8.343  12.426 -13.216
  370   2HG   GLU  46          HG1       GLU  46  -9.446  13.283 -12.137
  371    H    CYS  47           HN       CYS  47  -9.534  10.758  -8.676
  372    HA   CYS  47           HA       CYS  47  -7.273   9.264  -7.605
  373   1HB   CYS  47          HB2       CYS  47  -8.190   9.628  -5.492
  374   2HB   CYS  47          HB1       CYS  47  -8.801  11.009  -6.392
  375    H    GLN  48           HN       GLN  48 -10.449   8.517  -8.817
  376    HA   GLN  48           HA       GLN  48 -10.405   5.765  -7.776
  377   1HB   GLN  48          HB2       GLN  48 -12.286   7.365  -9.527
  378   2HB   GLN  48          HB1       GLN  48 -12.463   5.618  -9.357
  379   1HG   GLN  48          HG2       GLN  48 -12.282   7.437  -6.950
  380   2HG   GLN  48          HG1       GLN  48 -13.822   7.089  -7.738
  381   1HE2  GLN  48          HE21      GLN  48 -14.228   6.055  -5.476
  382   2HE2  GLN  48          HE22      GLN  48 -13.760   4.435  -5.281
  383    H    GLU  49           HN       GLU  49  -9.307   7.610 -10.428
  384    HA   GLU  49           HA       GLU  49  -9.290   5.569 -12.427
  385   1HB   GLU  49          HB2       GLU  49  -9.022   7.949 -12.997
  386   2HB   GLU  49          HB1       GLU  49  -7.499   7.994 -12.108
  387   1HG   GLU  49          HG2       GLU  49  -6.488   6.413 -13.632
  388   2HG   GLU  49          HG1       GLU  49  -8.029   6.150 -14.449
  389    H    VAL  50           HN       VAL  50  -6.804   6.759 -10.152
  390    HA   VAL  50           HA       VAL  50  -4.840   4.812 -10.928
  391    HB   VAL  50           HB       VAL  50  -5.091   6.179  -8.238
  392   1HG1  VAL  50          HG11      VAL  50  -2.882   4.737  -9.729
  393   2HG1  VAL  50          HG12      VAL  50  -3.496   4.431  -8.100
  394   3HG1  VAL  50          HG13      VAL  50  -2.535   5.874  -8.421
  395   1HG2  VAL  50          HG21      VAL  50  -5.061   7.937  -9.843
  396   2HG2  VAL  50          HG22      VAL  50  -3.923   7.074 -10.883
  397   3HG2  VAL  50          HG23      VAL  50  -3.377   7.754  -9.349
  398    H    VAL  51           HN       VAL  51  -7.358   4.855  -8.400
  399    HA   VAL  51           HA       VAL  51  -6.727   2.521  -6.960
  400    HB   VAL  51           HB       VAL  51  -9.412   3.579  -7.935
  401   1HG1  VAL  51          HG11      VAL  51 -10.364   2.133  -6.089
  402   2HG1  VAL  51          HG12      VAL  51  -8.806   1.316  -6.020
  403   3HG1  VAL  51          HG13      VAL  51  -9.775   1.242  -7.491
  404   1HG2  VAL  51          HG21      VAL  51  -9.573   4.598  -5.805
  405   2HG2  VAL  51          HG22      VAL  51  -7.895   4.863  -6.275
  406   3HG2  VAL  51          HG23      VAL  51  -8.297   3.588  -5.128
  407    H    ASP  52           HN       ASP  52  -8.528   2.731 -10.058
  408    HA   ASP  52           HA       ASP  52  -8.827  -0.059 -10.483
  409   1HB   ASP  52          HB2       ASP  52  -8.325   2.152 -12.509
  410   2HB   ASP  52          HB1       ASP  52  -8.876   0.526 -12.914
  411    H    THR  53           HN       THR  53  -6.116   2.142 -10.967
  412    HA   THR  53           HA       THR  53  -4.417   0.065 -12.111
  413    HB   THR  53           HB       THR  53  -3.748   2.850 -11.254
  414    HG1  THR  53           HG1      THR  53  -4.680   3.278 -13.057
  415   1HG2  THR  53          HG21      THR  53  -1.664   2.527 -12.485
  416   2HG2  THR  53          HG22      THR  53  -2.147   0.885 -12.902
  417   3HG2  THR  53          HG23      THR  53  -1.788   1.299 -11.228
  418    H    TYR  54           HN       TYR  54  -5.226   1.258  -9.009
  419    HA   TYR  54           HA       TYR  54  -3.202  -0.580  -7.784
  420   1HB   TYR  54          HB2       TYR  54  -3.999   2.190  -6.867
  421   2HB   TYR  54          HB1       TYR  54  -3.145   1.037  -5.845
  422    HD1  TYR  54           HD1      TYR  54  -2.972   2.514  -9.236
  423    HD2  TYR  54           HD2      TYR  54  -0.798   1.053  -5.876
  424    HE1  TYR  54           HE1      TYR  54  -0.884   3.274 -10.307
  425    HE2  TYR  54           HE2      TYR  54   1.330   1.785  -6.925
  426    HH   TYR  54           HH       TYR  54   1.331   3.433 -10.099
  427    H    GLY  55           HN       GLY  55  -5.312  -1.904  -8.038
  428   1HA   GLY  55          HA2       GLY  55  -6.903  -1.603  -5.528
  429   2HA   GLY  55          HA1       GLY  55  -7.735  -1.833  -7.068
  430    H    SER  56           HN       SER  56  -6.758  -3.838  -8.345
  431    HA   SER  56           HA       SER  56  -7.019  -6.104  -6.486
  432   1HB   SER  56          HB2       SER  56  -8.146  -6.586  -8.458
  433   2HB   SER  56          HB1       SER  56  -6.960  -5.758  -9.463
  434    HG   SER  56           HG       SER  56  -6.722  -8.266  -8.158
  435    H    SER  57           HN       SER  57  -4.414  -4.323  -7.869
  436    HA   SER  57           HA       SER  57  -2.503  -6.579  -7.581
  437   1HB   SER  57          HB2       SER  57  -2.114  -3.703  -8.475
  438   2HB   SER  57          HB1       SER  57  -0.800  -4.870  -8.309
  439    HG   SER  57           HG       SER  57  -1.545  -5.961 -10.001
  440    H    ILE  58           HN       ILE  58  -2.334  -3.173  -6.565
  441    HA   ILE  58           HA       ILE  58  -0.607  -3.089  -4.519
  442    HB   ILE  58           HB       ILE  58  -2.178  -1.287  -5.132
  443   1HG1  ILE  58          HG12      ILE  58  -1.974  -1.983  -2.190
  444   2HG1  ILE  58          HG11      ILE  58  -0.926  -0.894  -3.113
  445   1HG2  ILE  58          HG21      ILE  58  -4.185  -2.405  -3.241
  446   2HG2  ILE  58          HG22      ILE  58  -4.194  -2.942  -4.929
  447   3HG2  ILE  58          HG23      ILE  58  -4.414  -1.242  -4.530
  448   1HD1  ILE  58          HD11      ILE  58  -3.090   0.471  -3.579
  449   2HD1  ILE  58          HD12      ILE  58  -2.402   0.569  -1.955
  450   3HD1  ILE  58          HD13      ILE  58  -3.799  -0.470  -2.262
  451    H    LEU  59           HN       LEU  59  -3.848  -4.476  -4.151
  452    HA   LEU  59           HA       LEU  59  -3.290  -5.348  -1.419
  453   1HB   LEU  59          HB2       LEU  59  -5.511  -6.505  -3.120
  454   2HB   LEU  59          HB1       LEU  59  -5.463  -6.292  -1.371
  455    HG   LEU  59           HG       LEU  59  -5.481  -4.024  -3.332
  456   1HD1  LEU  59          HD11      LEU  59  -7.858  -3.756  -2.736
  457   2HD1  LEU  59          HD12      LEU  59  -7.763  -5.256  -1.809
  458   3HD1  LEU  59          HD13      LEU  59  -7.540  -5.284  -3.562
  459   1HD2  LEU  59          HD21      LEU  59  -5.913  -4.174  -0.345
  460   2HD2  LEU  59          HD22      LEU  59  -6.160  -2.719  -1.309
  461   3HD2  LEU  59          HD23      LEU  59  -4.550  -3.413  -1.164
  462    H    SER  60           HN       SER  60  -3.621  -6.968  -4.585
  463    HA   SER  60           HA       SER  60  -2.855  -9.568  -3.497
  464   1HB   SER  60          HB2       SER  60  -4.419  -9.158  -5.468
  465   2HB   SER  60          HB1       SER  60  -2.975  -8.795  -6.409
  466    HG   SER  60           HG       SER  60  -2.241 -10.929  -5.465
  467    H    ILE  61           HN       ILE  61  -1.011  -6.914  -4.099
  468    HA   ILE  61           HA       ILE  61   1.248  -8.400  -5.324
  469    HB   ILE  61           HB       ILE  61   0.290  -5.969  -5.859
  470   1HG1  ILE  61          HG12      ILE  61   2.145  -7.193  -7.025
  471   2HG1  ILE  61          HG11      ILE  61   2.331  -5.448  -7.002
  472   1HG2  ILE  61          HG21      ILE  61   0.740  -5.027  -3.661
  473   2HG2  ILE  61          HG22      ILE  61   1.659  -4.202  -4.910
  474   3HG2  ILE  61          HG23      ILE  61   2.460  -5.363  -3.862
  475   1HD1  ILE  61          HD11      ILE  61   3.906  -5.587  -5.154
  476   2HD1  ILE  61          HD12      ILE  61   4.441  -6.663  -6.453
  477   3HD1  ILE  61          HD13      ILE  61   3.648  -7.330  -5.027
  478    H    LEU  62           HN       LEU  62   1.011  -6.149  -2.493
  479    HA   LEU  62           HA       LEU  62   3.397  -6.885  -1.281
  480   1HB   LEU  62          HB2       LEU  62   0.791  -5.897  -0.177
  481   2HB   LEU  62          HB1       LEU  62   2.086  -6.352   0.921
  482    HG   LEU  62           HG       LEU  62   3.562  -4.812  -0.671
  483   1HD1  LEU  62          HD11      LEU  62   2.408  -3.834  -2.302
  484   2HD1  LEU  62          HD12      LEU  62   1.787  -2.753  -1.064
  485   3HD1  LEU  62          HD13      LEU  62   0.848  -4.154  -1.554
  486   1HD2  LEU  62          HD21      LEU  62   3.354  -4.351   1.663
  487   2HD2  LEU  62          HD22      LEU  62   1.667  -3.865   1.482
  488   3HD2  LEU  62          HD23      LEU  62   2.952  -2.853   0.823
  489    H    LEU  63           HN       LEU  63   1.049  -9.066  -2.026
  490    HA   LEU  63           HA       LEU  63   1.331 -10.687   0.427
  491   1HB   LEU  63          HB2       LEU  63  -0.048 -11.657  -2.057
  492   2HB   LEU  63          HB1       LEU  63  -0.454 -11.955  -0.366
  493    HG   LEU  63           HG       LEU  63  -1.000  -9.506  -2.044
  494   1HD1  LEU  63          HD11      LEU  63  -2.649 -11.342  -2.013
  495   2HD1  LEU  63          HD12      LEU  63  -3.298  -9.895  -1.241
  496   3HD1  LEU  63          HD13      LEU  63  -2.729 -11.240  -0.255
  497   1HD2  LEU  63          HD21      LEU  63  -0.653  -9.658   0.932
  498   2HD2  LEU  63          HD22      LEU  63  -2.009  -8.714   0.325
  499   3HD2  LEU  63          HD23      LEU  63  -0.374  -8.304  -0.163
  500    H    GLU  64           HN       GLU  64   1.873 -11.213  -3.095
  501    HA   GLU  64           HA       GLU  64   4.026 -13.187  -2.353
  502   1HB   GLU  64          HB2       GLU  64   1.937 -13.385  -4.528
  503   2HB   GLU  64          HB1       GLU  64   3.263 -14.524  -4.294
  504   1HG   GLU  64          HG2       GLU  64   1.216 -13.881  -2.155
  505   2HG   GLU  64          HG1       GLU  64   1.080 -15.256  -3.251
  506    H    GLU  65           HN       GLU  65   2.741 -11.475  -5.235
  507    HA   GLU  65           HA       GLU  65   4.919 -11.672  -6.897
  508   1HB   GLU  65          HB2       GLU  65   3.470  -9.052  -6.556
  509   2HB   GLU  65          HB1       GLU  65   4.190  -9.698  -8.028
  510   1HG   GLU  65          HG2       GLU  65   1.776 -10.788  -6.559
  511   2HG   GLU  65          HG1       GLU  65   1.789 -10.018  -8.145
  512    H    VAL  66           HN       VAL  66   4.837 -10.090  -3.933
  513    HA   VAL  66           HA       VAL  66   7.677  -9.279  -4.247
  514    HB   VAL  66           HB       VAL  66   6.017  -7.392  -4.883
  515   1HG1  VAL  66          HG11      VAL  66   4.910  -6.235  -3.154
  516   2HG1  VAL  66          HG12      VAL  66   5.807  -7.089  -1.900
  517   3HG1  VAL  66          HG13      VAL  66   4.598  -7.939  -2.850
  518   1HG2  VAL  66          HG21      VAL  66   8.207  -6.640  -4.622
  519   2HG2  VAL  66          HG22      VAL  66   8.317  -7.216  -2.957
  520   3HG2  VAL  66          HG23      VAL  66   7.415  -5.751  -3.327
  521    H    SER  67           HN       SER  67   8.706  -8.941  -2.135
  522    HA   SER  67           HA       SER  67   7.291 -10.387   0.047
  523   1HB   SER  67          HB2       SER  67   9.404 -11.328   0.010
  524   2HB   SER  67          HB1       SER  67  10.139  -9.881  -0.674
  525    HG   SER  67           HG       SER  67  10.605  -9.260   1.272
  526    HA   PRO  68           HA       PRO  68   6.415  -6.634   2.196
  527   1HB   PRO  68          HB2       PRO  68   7.272  -7.449   4.818
  528   2HB   PRO  68          HB1       PRO  68   5.624  -7.477   4.169
  529   1HG   PRO  68          HG2       PRO  68   7.450  -9.736   4.605
  530   2HG   PRO  68          HG1       PRO  68   5.725  -9.770   4.214
  531   1HD   PRO  68          HD2       PRO  68   7.853 -10.436   2.449
  532   2HD   PRO  68          HD1       PRO  68   6.153 -10.175   2.001
  533    H    GLU  69           HN       GLU  69   9.593  -8.084   2.421
  534    HA   GLU  69           HA       GLU  69  10.800  -5.696   3.624
  535   1HB   GLU  69          HB2       GLU  69  11.811  -7.845   4.131
  536   2HB   GLU  69          HB1       GLU  69  12.035  -8.194   2.419
  537   1HG   GLU  69          HG2       GLU  69  13.652  -6.432   2.186
  538   2HG   GLU  69          HG1       GLU  69  13.275  -5.795   3.787
  539    H    LEU  70           HN       LEU  70  11.001  -7.258   0.385
  540    HA   LEU  70           HA       LEU  70  12.585  -5.285  -0.862
  541   1HB   LEU  70          HB2       LEU  70  12.096  -7.242  -2.128
  542   2HB   LEU  70          HB1       LEU  70  10.366  -7.084  -1.857
  543    HG   LEU  70           HG       LEU  70  10.314  -5.076  -3.307
  544   1HD1  LEU  70          HD11      LEU  70  13.277  -5.674  -3.589
  545   2HD1  LEU  70          HD12      LEU  70  12.547  -4.214  -2.936
  546   3HD1  LEU  70          HD13      LEU  70  12.390  -4.579  -4.648
  547   1HD2  LEU  70          HD21      LEU  70  11.827  -7.172  -4.869
  548   2HD2  LEU  70          HD22      LEU  70  10.392  -6.258  -5.330
  549   3HD2  LEU  70          HD23      LEU  70  10.261  -7.579  -4.169
  550    H    VAL  71           HN       VAL  71   9.191  -5.342  -0.015
  551    HA   VAL  71           HA       VAL  71   8.253  -3.088  -1.436
  552    HB   VAL  71           HB       VAL  71   7.507  -4.207   1.274
  553   1HG1  VAL  71          HG11      VAL  71   5.317  -2.933   0.772
  554   2HG1  VAL  71          HG12      VAL  71   6.285  -1.982  -0.355
  555   3HG1  VAL  71          HG13      VAL  71   6.690  -1.999   1.362
  556   1HG2  VAL  71          HG21      VAL  71   5.891  -4.383  -1.264
  557   2HG2  VAL  71          HG22      VAL  71   5.896  -5.464   0.130
  558   3HG2  VAL  71          HG23      VAL  71   7.242  -5.487  -1.009
  559    H    CYS  72           HN       CYS  72   9.208  -3.111   2.023
  560    HA   CYS  72           HA       CYS  72   9.289  -0.350   2.437
  561   1HB   CYS  72          HB2       CYS  72   9.747  -1.950   4.252
  562   2HB   CYS  72          HB1       CYS  72  11.312  -2.335   3.525
  563    H    SER  73           HN       SER  73  11.293  -2.223   0.382
  564    HA   SER  73           HA       SER  73  13.383  -0.146   0.182
  565   1HB   SER  73          HB2       SER  73  13.228  -2.332  -1.843
  566   2HB   SER  73          HB1       SER  73  14.623  -1.720  -0.965
  567    HG   SER  73           HG       SER  73  14.266  -3.624  -0.019
  568    H    MET  74           HN       MET  74  11.047  -1.700  -2.101
  569    HA   MET  74           HA       MET  74  11.289   0.167  -4.195
  570   1HB   MET  74          HB2       MET  74   8.858  -1.331  -3.170
  571   2HB   MET  74          HB1       MET  74   8.812  -0.340  -4.627
  572   1HG   MET  74          HG2       MET  74  10.872  -1.757  -5.378
  573   2HG   MET  74          HG1       MET  74  10.351  -2.882  -4.127
  574   1HE   MET  74          HE1       MET  74   7.071  -4.204  -5.028
  575   2HE   MET  74          HE2       MET  74   6.896  -2.558  -4.418
  576   3HE   MET  74          HE3       MET  74   8.155  -3.603  -3.763
  577    H    LEU  75           HN       LEU  75   9.359   0.383  -1.217
  578    HA   LEU  75           HA       LEU  75   8.074   2.871  -1.850
  579   1HB   LEU  75          HB2       LEU  75   8.813   1.761   0.878
  580   2HB   LEU  75          HB1       LEU  75   7.636   3.034   0.568
  581    HG   LEU  75           HG       LEU  75   7.434   0.193  -0.482
  582   1HD1  LEU  75          HD11      LEU  75   7.121   0.225   1.932
  583   2HD1  LEU  75          HD12      LEU  75   5.546   0.038   1.160
  584   3HD1  LEU  75          HD13      LEU  75   6.031   1.605   1.805
  585   1HD2  LEU  75          HD21      LEU  75   6.211   1.503  -2.001
  586   2HD2  LEU  75          HD22      LEU  75   5.739   2.672  -0.769
  587   3HD2  LEU  75          HD23      LEU  75   4.980   1.081  -0.814
  588    H    HIS  76           HN       HIS  76  11.320   2.126  -1.017
  589    HA   HIS  76           HA       HIS  76  13.123   3.455  -0.310
  590   1HB   HIS  76          HB2       HIS  76  13.507   5.342  -1.765
  591   2HB   HIS  76          HB1       HIS  76  12.747   4.062  -2.709
  592    HD1  HIS  76           HD1      HIS  76  12.066   7.442  -1.215
  593    HD2  HIS  76           HD2      HIS  76  10.109   4.618  -3.563
  594    HE1  HIS  76           HE1      HIS  76   9.990   8.580  -2.117
  595    H    LEU  77           HN       LEU  77  11.000   3.624   1.572
  596    HA   LEU  77           HA       LEU  77  10.543   6.448   2.187
  597   1HB   LEU  77          HB2       LEU  77   9.254   5.677   4.030
  598   2HB   LEU  77          HB1       LEU  77   8.958   4.526   2.733
  599    HG   LEU  77           HG       LEU  77  11.141   3.356   3.953
  600   1HD1  LEU  77          HD11      LEU  77   9.499   4.703   6.124
  601   2HD1  LEU  77          HD12      LEU  77  11.218   4.931   5.807
  602   3HD1  LEU  77          HD13      LEU  77  10.631   3.382   6.408
  603   1HD2  LEU  77          HD21      LEU  77   9.431   1.887   5.116
  604   2HD2  LEU  77          HD22      LEU  77   9.164   2.105   3.386
  605   3HD2  LEU  77          HD23      LEU  77   8.190   3.004   4.549
  606    H    CYS  78           HN       CYS  78  12.995   4.126   2.828
  607    HA   CYS  78           HA       CYS  78  14.002   5.035   5.327
  608   1HB   CYS  78          HB2       CYS  78  15.469   3.906   2.924
  609   2HB   CYS  78          HB1       CYS  78  16.208   4.161   4.505
  610    H    SER  79           HN       SER  79  15.868   5.685   2.392
  611    HA   SER  79           HA       SER  79  16.908   8.154   3.415
  612   1HB   SER  79          HB2       SER  79  16.815   7.004   0.615
  613   2HB   SER  79          HB1       SER  79  17.657   8.498   1.019
  614    HG   SER  79           HG       SER  79  18.604   6.094   1.202
  615    H    GLY  80           HN       GLY  80  16.657  10.129   1.632
  616   1HA   GLY  80          HA2       GLY  80  13.826  10.917   1.902
  617   2HA   GLY  80          HA1       GLY  80  15.147  11.953   1.358
  618    H    LEU  81           HN       LEU  81  16.141  10.094  -0.603
  619    HA   LEU  81           HA       LEU  81  13.946  10.049  -2.614
  620   1HB   LEU  81          HB2       LEU  81  15.890  10.489  -4.282
  621   2HB   LEU  81          HB1       LEU  81  15.256  11.856  -3.380
  622    HG   LEU  81           HG       LEU  81  17.769  11.748  -3.471
  623   1HD1  LEU  81          HD11      LEU  81  17.307  11.451  -0.569
  624   2HD1  LEU  81          HD12      LEU  81  16.167  12.535  -1.363
  625   3HD1  LEU  81          HD13      LEU  81  17.897  12.828  -1.492
  626   1HD2  LEU  81          HD21      LEU  81  18.996  10.069  -2.313
  627   2HD2  LEU  81          HD22      LEU  81  17.800   9.187  -3.259
  628   3HD2  LEU  81          HD23      LEU  81  17.553   9.433  -1.530
  629    H    VAL  82           HN       VAL  82  15.103   8.701  -4.602
  630    HA   VAL  82           HA       VAL  82  15.584   6.107  -3.356
  631    HB   VAL  82           HB       VAL  82  15.916   5.416  -5.855
  632   1HG1  VAL  82          HG11      VAL  82  13.275   6.433  -4.768
  633   2HG1  VAL  82          HG12      VAL  82  13.952   4.817  -4.557
  634   3HG1  VAL  82          HG13      VAL  82  13.442   5.358  -6.158
  635   1HG2  VAL  82          HG21      VAL  82  14.484   8.073  -6.187
  636   2HG2  VAL  82          HG22      VAL  82  14.945   6.947  -7.465
  637   3HG2  VAL  82          HG23      VAL  82  16.187   7.827  -6.573
  638    HA   PRO  83           HA       PRO  83  19.961   6.804  -3.064
  639   1HB   PRO  83          HB2       PRO  83  20.376   3.934  -3.675
  640   2HB   PRO  83          HB1       PRO  83  20.842   4.857  -2.235
  641   1HG   PRO  83          HG2       PRO  83  18.689   3.060  -2.366
  642   2HG   PRO  83          HG1       PRO  83  18.922   4.302  -1.128
  643   1HD   PRO  83          HD2       PRO  83  16.920   4.240  -3.275
  644   2HD   PRO  83          HD1       PRO  83  17.044   5.342  -1.879
  645    H    ARG  84           HN       ARG  84  21.331   7.529  -4.713
  646    HA   ARG  84           HA       ARG  84  20.665   6.947  -7.481
  647   1HB   ARG  84          HB2       ARG  84  22.863   8.514  -6.118
  648   2HB   ARG  84          HB1       ARG  84  22.925   8.215  -7.852
  649   1HG   ARG  84          HG2       ARG  84  21.837  10.293  -7.711
  650   2HG   ARG  84          HG1       ARG  84  20.496   9.168  -7.885
  651   1HD   ARG  84          HD2       ARG  84  20.059  10.802  -6.091
  652   2HD   ARG  84          HD1       ARG  84  20.176   9.169  -5.438
  653    HE   ARG  84           HE       ARG  84  22.754  10.137  -5.210
  654   1HH1  ARG  84          HH21      ARG  84  19.602  11.208  -4.313
  655   2HH1  ARG  84          HH22      ARG  84  20.147  12.065  -2.909
  656   1HH2  ARG  84          HH11      ARG  84  23.485  11.252  -3.383
  657   2HH2  ARG  84          HH12      ARG  84  22.345  12.090  -2.383
  Start of MODEL   13
    1   1H    SER   1           HT1      SER   1  23.581   5.274   6.850
    2   2H    SER   1           HT2      SER   1  24.661   4.360   7.791
    3   3H    SER   1           HT3      SER   1  24.427   6.011   8.121
    4    HA   SER   1           HA       SER   1  23.268   4.551   9.712
    5   1HB   SER   1          HB2       SER   1  22.438   6.824   9.285
    6   2HB   SER   1          HB1       SER   1  21.530   6.245   7.890
    7    HG   SER   1           HG       SER   1  21.132   4.927  10.307
    8    H    ASP   2           HN       ASP   2  21.521   3.033  10.022
    9    HA   ASP   2           HA       ASP   2  20.011   1.933   7.836
   10   1HB   ASP   2          HB2       ASP   2  21.137  -0.309   7.786
   11   2HB   ASP   2          HB1       ASP   2  22.142   0.987   7.135
   12    H    VAL   3           HN       VAL   3  19.335   2.810  10.398
   13    HA   VAL   3           HA       VAL   3  19.039   0.461  12.139
   14    HB   VAL   3           HB       VAL   3  18.040   3.280  12.415
   15   1HG1  VAL   3          HG11      VAL   3  17.968   0.903  14.277
   16   2HG1  VAL   3          HG12      VAL   3  16.606   1.872  13.715
   17   3HG1  VAL   3          HG13      VAL   3  17.773   2.562  14.843
   18   1HG2  VAL   3          HG21      VAL   3  20.512   3.021  12.470
   19   2HG2  VAL   3          HG22      VAL   3  20.335   1.842  13.770
   20   3HG2  VAL   3          HG23      VAL   3  19.863   3.521  14.032
   21    H    TYR   4           HN       TYR   4  16.799   2.774  10.569
   22    HA   TYR   4           HA       TYR   4  14.430   1.351  11.189
   23   1HB   TYR   4          HB2       TYR   4  14.630   2.784   8.559
   24   2HB   TYR   4          HB1       TYR   4  13.336   2.817   9.755
   25    HD1  TYR   4           HD1      TYR   4  15.006   5.113   8.307
   26    HD2  TYR   4           HD2      TYR   4  15.085   3.341  12.221
   27    HE1  TYR   4           HE1      TYR   4  15.940   7.207   9.232
   28    HE2  TYR   4           HE2      TYR   4  16.026   5.437  13.147
   29    HH   TYR   4           HH       TYR   4  17.499   7.483  11.946
   30    H    CYS   5           HN       CYS   5  16.672   0.985   8.456
   31    HA   CYS   5           HA       CYS   5  15.252  -0.680   6.758
   32   1HB   CYS   5          HB2       CYS   5  18.109  -0.379   7.435
   33   2HB   CYS   5          HB1       CYS   5  17.719  -1.988   6.841
   34    H    GLU   6           HN       GLU   6  16.836  -1.659   9.801
   35    HA   GLU   6           HA       GLU   6  16.042  -4.436   9.561
   36   1HB   GLU   6          HB2       GLU   6  16.944  -2.783  11.936
   37   2HB   GLU   6          HB1       GLU   6  16.662  -4.522  12.000
   38   1HG   GLU   6          HG2       GLU   6  18.365  -4.910  10.303
   39   2HG   GLU   6          HG1       GLU   6  18.593  -3.174  10.091
   40    H    VAL   7           HN       VAL   7  14.693  -1.608  11.260
   41    HA   VAL   7           HA       VAL   7  12.522  -3.145  12.444
   42    HB   VAL   7           HB       VAL   7  12.525  -0.151  12.025
   43   1HG1  VAL   7          HG11      VAL   7  11.355  -0.220  14.219
   44   2HG1  VAL   7          HG12      VAL   7  11.466  -1.981  14.202
   45   3HG1  VAL   7          HG13      VAL   7  10.501  -1.146  12.984
   46   1HG2  VAL   7          HG21      VAL   7  13.712  -0.131  14.305
   47   2HG2  VAL   7          HG22      VAL   7  14.706  -0.540  12.905
   48   3HG2  VAL   7          HG23      VAL   7  14.128  -1.814  13.979
   49    H    CYS   8           HN       CYS   8  12.489  -0.536  10.005
   50    HA   CYS   8           HA       CYS   8   9.895  -0.695   9.091
   51   1HB   CYS   8          HB2       CYS   8  11.301   0.951   8.126
   52   2HB   CYS   8          HB1       CYS   8  12.478  -0.246   7.594
   53    H    GLU   9           HN       GLU   9  12.460  -3.037   8.496
   54    HA   GLU   9           HA       GLU   9  10.863  -4.472   6.475
   55   1HB   GLU   9          HB2       GLU   9  13.441  -5.312   7.862
   56   2HB   GLU   9          HB1       GLU   9  12.622  -6.238   6.612
   57   1HG   GLU   9          HG2       GLU   9  13.034  -4.643   4.943
   58   2HG   GLU   9          HG1       GLU   9  13.342  -3.355   6.104
   59    H    PHE  10           HN       PHE  10  11.477  -4.718   9.928
   60    HA   PHE  10           HA       PHE  10  10.271  -7.343  10.212
   61   1HB   PHE  10          HB2       PHE  10  11.863  -6.531  11.872
   62   2HB   PHE  10          HB1       PHE  10  10.815  -5.163  12.247
   63    HD1  PHE  10           HD1      PHE  10  10.639  -8.907  11.991
   64    HD2  PHE  10           HD2      PHE  10   9.372  -5.374  14.082
   65    HE1  PHE  10           HE1      PHE  10   9.407 -10.312  13.623
   66    HE2  PHE  10           HE2      PHE  10   8.141  -6.780  15.712
   67    HZ   PHE  10           HZ       PHE  10   8.159  -9.248  15.482
   68    H    LEU  11           HN       LEU  11   9.030  -4.061  10.159
   69    HA   LEU  11           HA       LEU  11   6.468  -4.811  11.368
   70   1HB   LEU  11          HB2       LEU  11   7.124  -2.304   9.800
   71   2HB   LEU  11          HB1       LEU  11   5.805  -2.531  10.946
   72    HG   LEU  11           HG       LEU  11   8.753  -2.680  11.639
   73   1HD1  LEU  11          HD11      LEU  11   8.235  -0.540  12.871
   74   2HD1  LEU  11          HD12      LEU  11   6.669  -0.516  12.059
   75   3HD1  LEU  11          HD13      LEU  11   8.154  -0.393  11.116
   76   1HD2  LEU  11          HD21      LEU  11   7.660  -2.450  14.007
   77   2HD2  LEU  11          HD22      LEU  11   7.632  -4.026  13.222
   78   3HD2  LEU  11          HD23      LEU  11   6.190  -3.011  13.209
   79    H    VAL  12           HN       VAL  12   7.467  -3.791   8.077
   80    HA   VAL  12           HA       VAL  12   4.955  -4.216   6.852
   81    HB   VAL  12           HB       VAL  12   6.869  -3.069   5.794
   82   1HG1  VAL  12          HG11      VAL  12   8.746  -4.233   4.957
   83   2HG1  VAL  12          HG12      VAL  12   7.971  -5.799   5.179
   84   3HG1  VAL  12          HG13      VAL  12   8.507  -4.876   6.581
   85   1HG2  VAL  12          HG21      VAL  12   6.351  -3.737   3.578
   86   2HG2  VAL  12          HG22      VAL  12   4.907  -4.130   4.510
   87   3HG2  VAL  12          HG23      VAL  12   6.046  -5.400   4.071
   88    H    LYS  13           HN       LYS  13   7.416  -6.501   7.815
   89    HA   LYS  13           HA       LYS  13   6.250  -8.735   6.277
   90   1HB   LYS  13          HB2       LYS  13   8.663  -8.609   6.706
   91   2HB   LYS  13          HB1       LYS  13   8.360  -8.678   8.438
   92   1HG   LYS  13          HG2       LYS  13   6.974 -10.916   7.299
   93   2HG   LYS  13          HG1       LYS  13   8.555 -10.881   6.532
   94   1HD   LYS  13          HD2       LYS  13   8.878 -12.199   8.463
   95   2HD   LYS  13          HD1       LYS  13   9.510 -10.618   8.920
   96   1HE   LYS  13          HE2       LYS  13   7.420 -10.073  10.064
   97   2HE   LYS  13          HE1       LYS  13   6.700 -11.591   9.527
   98   1HZ   LYS  13          HZ1       LYS  13   8.565 -12.725  10.721
   99   2HZ   LYS  13          HZ2       LYS  13   7.451 -11.925  11.723
  100   3HZ   LYS  13          HZ3       LYS  13   8.965 -11.224  11.401
  101    H    GLU  14           HN       GLU  14   6.244  -7.578   9.647
  102    HA   GLU  14           HA       GLU  14   4.779  -9.889  10.637
  103   1HB   GLU  14          HB2       GLU  14   6.186  -8.346  12.069
  104   2HB   GLU  14          HB1       GLU  14   4.931  -7.122  11.871
  105   1HG   GLU  14          HG2       GLU  14   3.277  -8.587  12.902
  106   2HG   GLU  14          HG1       GLU  14   4.456  -9.895  13.004
  107    H    VAL  15           HN       VAL  15   3.841  -6.501  10.045
  108    HA   VAL  15           HA       VAL  15   1.080  -6.744  10.435
  109    HB   VAL  15           HB       VAL  15   2.399  -4.625   9.872
  110   1HG1  VAL  15          HG11      VAL  15   3.390  -5.687   7.771
  111   2HG1  VAL  15          HG12      VAL  15   2.747  -4.056   7.577
  112   3HG1  VAL  15          HG13      VAL  15   1.817  -5.444   7.015
  113   1HG2  VAL  15          HG21      VAL  15  -0.252  -5.325   8.598
  114   2HG2  VAL  15          HG22      VAL  15   0.416  -3.696   8.496
  115   3HG2  VAL  15          HG23      VAL  15   0.046  -4.401  10.070
  116    H    THR  16           HN       THR  16   3.009  -7.506   7.557
  117    HA   THR  16           HA       THR  16   0.929  -8.215   5.798
  118    HB   THR  16           HB       THR  16   2.926 -10.072   5.232
  119    HG1  THR  16           HG1      THR  16   4.339  -7.857   6.044
  120   1HG2  THR  16          HG21      THR  16   2.853  -7.122   4.530
  121   2HG2  THR  16          HG22      THR  16   1.988  -8.411   3.674
  122   3HG2  THR  16          HG23      THR  16   3.759  -8.365   3.660
  123    H    LYS  17           HN       LYS  17   2.575 -10.203   8.277
  124    HA   LYS  17           HA       LYS  17   1.368 -12.672   7.796
  125   1HB   LYS  17          HB2       LYS  17   2.050 -11.335  10.426
  126   2HB   LYS  17          HB1       LYS  17   1.444 -12.986  10.334
  127   1HG   LYS  17          HG2       LYS  17   3.309 -13.637   8.906
  128   2HG   LYS  17          HG1       LYS  17   3.889 -11.973   8.859
  129   1HD   LYS  17          HD2       LYS  17   5.198 -13.208  10.498
  130   2HD   LYS  17          HD1       LYS  17   4.178 -12.044  11.340
  131   1HE   LYS  17          HE2       LYS  17   3.138 -14.834  10.903
  132   2HE   LYS  17          HE1       LYS  17   4.306 -14.543  12.191
  133   1HZ   LYS  17          HZ1       LYS  17   2.512 -13.982  13.370
  134   2HZ   LYS  17          HZ2       LYS  17   1.541 -13.743  11.996
  135   3HZ   LYS  17          HZ3       LYS  17   2.585 -12.511  12.527
  136    H    LEU  18           HN       LEU  18  -0.037  -9.821   9.376
  137    HA   LEU  18           HA       LEU  18  -2.608 -11.283   9.747
  138   1HB   LEU  18          HB2       LEU  18  -2.949  -9.846  11.482
  139   2HB   LEU  18          HB1       LEU  18  -1.278  -9.350  11.252
  140    HG   LEU  18           HG       LEU  18  -2.153  -7.618   9.589
  141   1HD1  LEU  18          HD11      LEU  18  -4.359  -7.546   9.087
  142   2HD1  LEU  18          HD12      LEU  18  -4.805  -7.457  10.788
  143   3HD1  LEU  18          HD13      LEU  18  -4.592  -9.027  10.013
  144   1HD2  LEU  18          HD21      LEU  18  -3.063  -7.434  12.476
  145   2HD2  LEU  18          HD22      LEU  18  -2.775  -6.071  11.395
  146   3HD2  LEU  18          HD23      LEU  18  -1.431  -7.100  11.894
  147    H    ILE  19           HN       ILE  19  -1.245  -8.608   7.866
  148    HA   ILE  19           HA       ILE  19  -3.723  -7.895   6.560
  149    HB   ILE  19           HB       ILE  19  -0.889  -7.176   6.527
  150   1HG1  ILE  19          HG12      ILE  19  -3.202  -5.505   5.579
  151   2HG1  ILE  19          HG11      ILE  19  -2.865  -5.772   7.290
  152   1HG2  ILE  19          HG21      ILE  19  -2.339  -7.141   3.881
  153   2HG2  ILE  19          HG22      ILE  19  -0.807  -7.933   4.254
  154   3HG2  ILE  19          HG23      ILE  19  -0.904  -6.176   4.226
  155   1HD1  ILE  19          HD11      ILE  19  -1.477  -3.985   7.127
  156   2HD1  ILE  19          HD12      ILE  19  -1.482  -4.036   5.369
  157   3HD1  ILE  19          HD13      ILE  19  -0.360  -5.056   6.273
  158    H    ASP  20           HN       ASP  20  -1.423 -10.420   6.201
  159    HA   ASP  20           HA       ASP  20  -1.280 -11.094   3.565
  160   1HB   ASP  20          HB2       ASP  20  -0.349 -12.512   5.329
  161   2HB   ASP  20          HB1       ASP  20  -1.969 -12.998   5.830
  162    H    ASN  21           HN       ASN  21  -4.092 -11.983   5.642
  163    HA   ASN  21           HA       ASN  21  -5.888 -11.626   3.357
  164   1HB   ASN  21          HB2       ASN  21  -5.611 -14.354   4.636
  165   2HB   ASN  21          HB1       ASN  21  -6.769 -13.905   3.379
  166   1HD2  ASN  21          HD21      ASN  21  -5.617 -12.908   1.321
  167   2HD2  ASN  21          HD22      ASN  21  -4.197 -13.691   0.821
  168    H    ASN  22           HN       ASN  22  -6.358 -10.030   5.210
  169    HA   ASN  22           HA       ASN  22  -8.369 -11.252   7.078
  170   1HB   ASN  22          HB2       ASN  22  -6.438  -8.959   7.495
  171   2HB   ASN  22          HB1       ASN  22  -7.844  -9.218   8.531
  172   1HD2  ASN  22          HD21      ASN  22  -5.702 -11.689   7.038
  173   2HD2  ASN  22          HD22      ASN  22  -5.206 -12.370   8.513
  174    H    LYS  23           HN       LYS  23  -7.444  -8.334   5.280
  175    HA   LYS  23           HA       LYS  23 -10.355  -7.657   5.002
  176   1HB   LYS  23          HB2       LYS  23  -9.760  -5.340   4.866
  177   2HB   LYS  23          HB1       LYS  23  -8.938  -5.997   6.274
  178   1HG   LYS  23          HG2       LYS  23  -7.114  -4.939   5.355
  179   2HG   LYS  23          HG1       LYS  23  -6.999  -6.422   4.415
  180   1HD   LYS  23          HD2       LYS  23  -8.680  -5.121   2.792
  181   2HD   LYS  23          HD1       LYS  23  -8.002  -3.707   3.590
  182   1HE   LYS  23          HE2       LYS  23  -6.390  -5.862   2.191
  183   2HE   LYS  23          HE1       LYS  23  -6.740  -4.261   1.541
  184   1HZ   LYS  23          HZ1       LYS  23  -5.705  -3.964   4.124
  185   2HZ   LYS  23          HZ2       LYS  23  -5.020  -3.466   2.651
  186   3HZ   LYS  23          HZ3       LYS  23  -4.677  -5.010   3.272
  187    H    THR  24           HN       THR  24 -11.055  -8.211   3.018
  188    HA   THR  24           HA       THR  24  -9.135  -8.596   0.833
  189    HB   THR  24           HB       THR  24 -11.234  -9.243  -0.443
  190    HG1  THR  24           HG1      THR  24 -12.801  -9.647   1.613
  191   1HG2  THR  24          HG21      THR  24  -9.765 -10.851   0.813
  192   2HG2  THR  24          HG22      THR  24 -11.451 -11.362   0.724
  193   3HG2  THR  24          HG23      THR  24 -10.823 -10.651   2.210
  194    H    GLU  25           HN       GLU  25 -10.302  -7.776  -1.423
  195    HA   GLU  25           HA       GLU  25 -10.047  -4.856  -1.257
  196   1HB   GLU  25          HB2       GLU  25 -10.694  -6.497  -3.714
  197   2HB   GLU  25          HB1       GLU  25  -9.954  -4.899  -3.644
  198   1HG   GLU  25          HG2       GLU  25  -8.129  -6.359  -4.024
  199   2HG   GLU  25          HG1       GLU  25  -8.066  -6.039  -2.291
  200    H    LYS  26           HN       LYS  26 -12.559  -6.588  -0.385
  201    HA   LYS  26           HA       LYS  26 -14.650  -5.389  -2.072
  202   1HB   LYS  26          HB2       LYS  26 -14.942  -6.894   0.547
  203   2HB   LYS  26          HB1       LYS  26 -16.204  -6.592  -0.646
  204   1HG   LYS  26          HG2       LYS  26 -13.688  -8.194  -1.202
  205   2HG   LYS  26          HG1       LYS  26 -15.228  -8.912  -0.745
  206   1HD   LYS  26          HD2       LYS  26 -15.743  -8.954  -2.970
  207   2HD   LYS  26          HD1       LYS  26 -15.923  -7.206  -2.875
  208   1HE   LYS  26          HE2       LYS  26 -13.573  -6.899  -3.494
  209   2HE   LYS  26          HE1       LYS  26 -13.322  -8.644  -3.490
  210   1HZ   LYS  26          HZ1       LYS  26 -14.072  -8.746  -5.554
  211   2HZ   LYS  26          HZ2       LYS  26 -14.237  -7.056  -5.583
  212   3HZ   LYS  26          HZ3       LYS  26 -15.542  -8.031  -5.101
  213    H    GLU  27           HN       GLU  27 -13.493  -5.165   1.282
  214    HA   GLU  27           HA       GLU  27 -15.243  -2.973   1.940
  215   1HB   GLU  27          HB2       GLU  27 -12.674  -3.864   3.280
  216   2HB   GLU  27          HB1       GLU  27 -13.872  -2.774   3.979
  217   1HG   GLU  27          HG2       GLU  27 -15.572  -4.665   3.617
  218   2HG   GLU  27          HG1       GLU  27 -14.179  -5.711   3.335
  219    H    ILE  28           HN       ILE  28 -12.374  -3.212   0.128
  220    HA   ILE  28           HA       ILE  28 -11.448  -0.479   0.689
  221    HB   ILE  28           HB       ILE  28 -10.583  -2.510  -1.383
  222   1HG1  ILE  28          HG12      ILE  28 -10.172  -3.295   0.906
  223   2HG1  ILE  28          HG11      ILE  28  -8.653  -2.868   0.130
  224   1HG2  ILE  28          HG21      ILE  28  -8.509  -1.001  -1.347
  225   2HG2  ILE  28          HG22      ILE  28  -9.538   0.193  -0.563
  226   3HG2  ILE  28          HG23      ILE  28  -9.934  -0.391  -2.179
  227   1HD1  ILE  28          HD11      ILE  28  -9.094  -0.513   1.263
  228   2HD1  ILE  28          HD12      ILE  28  -8.397  -1.836   2.188
  229   3HD1  ILE  28          HD13      ILE  28 -10.113  -1.467   2.338
  230    H    LEU  29           HN       LEU  29 -12.089  -2.080  -2.433
  231    HA   LEU  29           HA       LEU  29 -12.517   0.168  -3.974
  232   1HB   LEU  29          HB2       LEU  29 -14.096  -2.414  -4.133
  233   2HB   LEU  29          HB1       LEU  29 -13.964  -1.223  -5.424
  234    HG   LEU  29           HG       LEU  29 -11.524  -2.509  -4.175
  235   1HD1  LEU  29          HD11      LEU  29 -12.748  -4.371  -5.015
  236   2HD1  LEU  29          HD12      LEU  29 -11.570  -3.975  -6.267
  237   3HD1  LEU  29          HD13      LEU  29 -13.254  -3.486  -6.455
  238   1HD2  LEU  29          HD21      LEU  29 -10.643  -1.944  -6.541
  239   2HD2  LEU  29          HD22      LEU  29 -10.908  -0.591  -5.447
  240   3HD2  LEU  29          HD23      LEU  29 -12.084  -0.945  -6.712
  241    H    ASP  30           HN       ASP  30 -14.643  -1.138  -1.534
  242    HA   ASP  30           HA       ASP  30 -16.967   0.413  -2.351
  243   1HB   ASP  30          HB2       ASP  30 -17.069  -1.639  -0.878
  244   2HB   ASP  30          HB1       ASP  30 -16.318  -0.686   0.403
  245    H    ALA  31           HN       ALA  31 -14.537   0.732   0.251
  246    HA   ALA  31           HA       ALA  31 -15.289   3.193   1.328
  247   1HB   ALA  31          HB1       ALA  31 -13.271   1.624   1.882
  248   2HB   ALA  31          HB2       ALA  31 -13.131   3.354   2.192
  249   3HB   ALA  31          HB3       ALA  31 -12.384   2.649   0.752
  250    H    PHE  32           HN       PHE  32 -13.641   2.546  -1.726
  251    HA   PHE  32           HA       PHE  32 -13.073   5.317  -2.280
  252   1HB   PHE  32          HB2       PHE  32 -13.214   2.825  -3.975
  253   2HB   PHE  32          HB1       PHE  32 -13.019   4.406  -4.728
  254    HD1  PHE  32           HD1      PHE  32 -11.018   5.810  -4.212
  255    HD2  PHE  32           HD2      PHE  32 -11.411   1.798  -2.728
  256    HE1  PHE  32           HE1      PHE  32  -8.599   5.769  -3.682
  257    HE2  PHE  32           HE2      PHE  32  -8.990   1.757  -2.208
  258    HZ   PHE  32           HZ       PHE  32  -7.586   3.742  -2.681
  259    H    ASP  33           HN       ASP  33 -15.820   3.201  -2.750
  260    HA   ASP  33           HA       ASP  33 -17.313   5.040  -4.422
  261   1HB   ASP  33          HB2       ASP  33 -17.799   2.555  -4.150
  262   2HB   ASP  33          HB1       ASP  33 -18.439   2.933  -2.550
  263    H    LYS  34           HN       LYS  34 -16.198   5.227  -1.319
  264    HA   LYS  34           HA       LYS  34 -18.454   6.992  -0.393
  265   1HB   LYS  34          HB2       LYS  34 -16.323   5.669   1.321
  266   2HB   LYS  34          HB1       LYS  34 -17.794   6.475   1.873
  267   1HG   LYS  34          HG2       LYS  34 -19.173   4.736   0.860
  268   2HG   LYS  34          HG1       LYS  34 -17.744   3.971   0.169
  269   1HD   LYS  34          HD2       LYS  34 -16.962   3.990   2.760
  270   2HD   LYS  34          HD1       LYS  34 -18.706   3.982   3.010
  271   1HE   LYS  34          HE2       LYS  34 -17.215   1.997   1.275
  272   2HE   LYS  34          HE1       LYS  34 -17.700   1.697   2.938
  273   1HZ   LYS  34          HZ1       LYS  34 -20.018   2.223   2.212
  274   2HZ   LYS  34          HZ2       LYS  34 -19.372   0.799   1.548
  275   3HZ   LYS  34          HZ3       LYS  34 -19.462   2.212   0.610
  276    H    MET  35           HN       MET  35 -15.041   6.609   0.491
  277    HA   MET  35           HA       MET  35 -14.586   9.360   1.039
  278   1HB   MET  35          HB2       MET  35 -12.786   8.364   1.983
  279   2HB   MET  35          HB1       MET  35 -13.183   6.879   1.142
  280   1HG   MET  35          HG2       MET  35 -11.911   7.845  -0.871
  281   2HG   MET  35          HG1       MET  35 -11.341   9.093   0.236
  282   1HE   MET  35          HE1       MET  35 -11.803   5.009   1.245
  283   2HE   MET  35          HE2       MET  35 -10.601   4.662   0.003
  284   3HE   MET  35          HE3       MET  35 -12.038   5.589  -0.405
  285    H    CYS  36           HN       CYS  36 -14.061   7.486  -1.919
  286    HA   CYS  36           HA       CYS  36 -13.053   9.912  -3.284
  287   1HB   CYS  36          HB2       CYS  36 -12.926   7.042  -3.700
  288   2HB   CYS  36          HB1       CYS  36 -13.508   7.823  -5.170
  289    H    SER  37           HN       SER  37 -15.868   9.266  -2.157
  290    HA   SER  37           HA       SER  37 -17.515   9.655  -4.597
  291   1HB   SER  37          HB2       SER  37 -17.955   8.147  -2.380
  292   2HB   SER  37          HB1       SER  37 -18.795   9.617  -1.906
  293    HG   SER  37           HG       SER  37 -20.131   9.410  -3.609
  294    H    LYS  38           HN       LYS  38 -17.078  11.164  -1.383
  295    HA   LYS  38           HA       LYS  38 -18.513  13.550  -2.114
  296   1HB   LYS  38          HB2       LYS  38 -17.254  14.508  -0.040
  297   2HB   LYS  38          HB1       LYS  38 -18.433  13.227   0.205
  298   1HG   LYS  38          HG2       LYS  38 -16.451  12.715   1.502
  299   2HG   LYS  38          HG1       LYS  38 -16.557  11.555   0.185
  300   1HD   LYS  38          HD2       LYS  38 -14.762  12.494  -0.967
  301   2HD   LYS  38          HD1       LYS  38 -14.968  14.079  -0.231
  302   1HE   LYS  38          HE2       LYS  38 -14.049  13.310   1.853
  303   2HE   LYS  38          HE1       LYS  38 -14.078  11.632   1.315
  304   1HZ   LYS  38          HZ1       LYS  38 -11.909  12.203   0.924
  305   2HZ   LYS  38          HZ2       LYS  38 -12.277  13.811   0.518
  306   3HZ   LYS  38          HZ3       LYS  38 -12.595  12.560  -0.586
  307    H    LEU  39           HN       LEU  39 -15.458  12.418  -2.981
  308    HA   LEU  39           HA       LEU  39 -13.894  14.761  -3.051
  309   1HB   LEU  39          HB2       LEU  39 -13.737  12.117  -4.187
  310   2HB   LEU  39          HB1       LEU  39 -13.473  13.231  -5.506
  311    HG   LEU  39           HG       LEU  39 -11.831  14.272  -3.462
  312   1HD1  LEU  39          HD11      LEU  39 -10.696  12.551  -2.389
  313   2HD1  LEU  39          HD12      LEU  39 -11.240  11.330  -3.539
  314   3HD1  LEU  39          HD13      LEU  39 -12.363  11.975  -2.337
  315   1HD2  LEU  39          HD21      LEU  39 -11.326  14.045  -5.893
  316   2HD2  LEU  39          HD22      LEU  39 -11.047  12.323  -5.642
  317   3HD2  LEU  39          HD23      LEU  39  -9.994  13.507  -4.870
  318    HA   PRO  40           HA       PRO  40 -16.062  17.354  -5.973
  319   1HB   PRO  40          HB2       PRO  40 -13.586  18.082  -7.378
  320   2HB   PRO  40          HB1       PRO  40 -14.620  19.101  -6.367
  321   1HG   PRO  40          HG2       PRO  40 -12.052  18.057  -5.671
  322   2HG   PRO  40          HG1       PRO  40 -13.173  18.913  -4.600
  323   1HD   PRO  40          HD2       PRO  40 -12.494  16.095  -4.574
  324   2HD   PRO  40          HD1       PRO  40 -13.566  16.968  -3.465
  325    H    LYS  41           HN       LYS  41 -17.056  16.658  -7.832
  326    HA   LYS  41           HA       LYS  41 -16.772  14.293  -9.108
  327   1HB   LYS  41          HB2       LYS  41 -18.479  16.050  -9.608
  328   2HB   LYS  41          HB1       LYS  41 -17.276  16.848 -10.622
  329   1HG   LYS  41          HG2       LYS  41 -17.115  14.937 -12.067
  330   2HG   LYS  41          HG1       LYS  41 -18.131  13.973 -10.995
  331   1HD   LYS  41          HD2       LYS  41 -20.089  15.013 -11.671
  332   2HD   LYS  41          HD1       LYS  41 -19.294  16.556 -11.979
  333   1HE   LYS  41          HE2       LYS  41 -18.283  15.655 -14.018
  334   2HE   LYS  41          HE1       LYS  41 -19.026  14.086 -13.714
  335   1HZ   LYS  41          HZ1       LYS  41 -20.132  16.168 -15.109
  336   2HZ   LYS  41          HZ2       LYS  41 -20.939  16.195 -13.614
  337   3HZ   LYS  41          HZ3       LYS  41 -20.942  14.783 -14.559
  338    H    SER  42           HN       SER  42 -14.981  17.183 -10.080
  339    HA   SER  42           HA       SER  42 -13.607  16.133 -12.302
  340   1HB   SER  42          HB2       SER  42 -12.505  18.044 -10.227
  341   2HB   SER  42          HB1       SER  42 -11.935  17.865 -11.885
  342    HG   SER  42           HG       SER  42 -13.435  19.233 -12.404
  343    H    LEU  43           HN       LEU  43 -12.237  16.450  -9.024
  344    HA   LEU  43           HA       LEU  43 -10.100  14.586  -9.661
  345   1HB   LEU  43          HB2       LEU  43 -10.978  15.970  -7.124
  346   2HB   LEU  43          HB1       LEU  43  -9.596  14.875  -7.177
  347    HG   LEU  43           HG       LEU  43  -9.783  17.152  -9.145
  348   1HD1  LEU  43          HD11      LEU  43  -8.413  18.500  -7.508
  349   2HD1  LEU  43          HD12      LEU  43  -8.832  17.311  -6.275
  350   3HD1  LEU  43          HD13      LEU  43 -10.098  18.275  -7.036
  351   1HD2  LEU  43          HD21      LEU  43  -8.003  15.547  -9.536
  352   2HD2  LEU  43          HD22      LEU  43  -7.508  15.615  -7.847
  353   3HD2  LEU  43          HD23      LEU  43  -7.275  17.015  -8.890
  354    H    SER  44           HN       SER  44 -13.310  14.052  -8.967
  355    HA   SER  44           HA       SER  44 -12.884  11.685  -7.254
  356   1HB   SER  44          HB2       SER  44 -15.211  11.589  -7.051
  357   2HB   SER  44          HB1       SER  44 -14.984  13.314  -7.312
  358    HG   SER  44           HG       SER  44 -15.509  11.383  -9.331
  359    H    GLU  45           HN       GLU  45 -13.300  12.649 -10.545
  360    HA   GLU  45           HA       GLU  45 -13.785   9.959 -11.530
  361   1HB   GLU  45          HB2       GLU  45 -13.162  12.588 -12.886
  362   2HB   GLU  45          HB1       GLU  45 -13.366  11.082 -13.780
  363   1HG   GLU  45          HG2       GLU  45 -15.631  10.823 -12.910
  364   2HG   GLU  45          HG1       GLU  45 -15.435  12.258 -11.902
  365    H    GLU  46           HN       GLU  46 -11.097  12.126 -11.005
  366    HA   GLU  46           HA       GLU  46  -9.190  10.454 -12.470
  367   1HB   GLU  46          HB2       GLU  46  -8.782  12.807 -10.601
  368   2HB   GLU  46          HB1       GLU  46  -7.506  12.038 -11.545
  369   1HG   GLU  46          HG2       GLU  46  -8.771  12.557 -13.626
  370   2HG   GLU  46          HG1       GLU  46  -9.978  13.401 -12.654
  371    H    CYS  47           HN       CYS  47 -10.323  10.757  -9.148
  372    HA   CYS  47           HA       CYS  47  -8.066   9.259  -8.055
  373   1HB   CYS  47          HB2       CYS  47  -9.041   9.542  -5.960
  374   2HB   CYS  47          HB1       CYS  47  -9.631  10.949  -6.829
  375    H    GLN  48           HN       GLN  48 -11.211   8.504  -9.372
  376    HA   GLN  48           HA       GLN  48 -11.137   5.727  -8.393
  377   1HB   GLN  48          HB2       GLN  48 -13.034   7.365 -10.081
  378   2HB   GLN  48          HB1       GLN  48 -13.174   5.607 -10.043
  379   1HG   GLN  48          HG2       GLN  48 -13.064   7.245  -7.505
  380   2HG   GLN  48          HG1       GLN  48 -14.585   6.927  -8.338
  381   1HE2  GLN  48          HE21      GLN  48 -15.069   5.689  -6.231
  382   2HE2  GLN  48          HE22      GLN  48 -14.536   4.081  -6.125
  383    H    GLU  49           HN       GLU  49 -10.084   7.644 -11.033
  384    HA   GLU  49           HA       GLU  49  -9.998   5.607 -13.028
  385   1HB   GLU  49          HB2       GLU  49  -9.825   8.063 -13.486
  386   2HB   GLU  49          HB1       GLU  49  -8.226   8.048 -12.745
  387   1HG   GLU  49          HG2       GLU  49  -7.958   7.869 -15.142
  388   2HG   GLU  49          HG1       GLU  49  -7.536   6.319 -14.422
  389    H    VAL  50           HN       VAL  50  -7.523   6.930 -10.813
  390    HA   VAL  50           HA       VAL  50  -5.491   5.070 -11.578
  391    HB   VAL  50           HB       VAL  50  -5.788   6.394  -8.875
  392   1HG1  VAL  50          HG11      VAL  50  -4.112   4.690  -8.841
  393   2HG1  VAL  50          HG12      VAL  50  -3.244   6.211  -9.042
  394   3HG1  VAL  50          HG13      VAL  50  -3.501   5.151 -10.432
  395   1HG2  VAL  50          HG21      VAL  50  -4.174   8.073  -9.993
  396   2HG2  VAL  50          HG22      VAL  50  -5.874   8.177 -10.448
  397   3HG2  VAL  50          HG23      VAL  50  -4.718   7.389 -11.525
  398    H    VAL  51           HN       VAL  51  -7.950   4.975  -8.981
  399    HA   VAL  51           HA       VAL  51  -7.191   2.676  -7.571
  400    HB   VAL  51           HB       VAL  51  -9.938   3.585  -8.512
  401   1HG1  VAL  51          HG11      VAL  51 -10.790   2.070  -6.663
  402   2HG1  VAL  51          HG12      VAL  51  -9.194   1.325  -6.642
  403   3HG1  VAL  51          HG13      VAL  51 -10.190   1.233  -8.094
  404   1HG2  VAL  51          HG21      VAL  51  -8.449   4.910  -6.830
  405   2HG2  VAL  51          HG22      VAL  51  -8.839   3.614  -5.701
  406   3HG2  VAL  51          HG23      VAL  51 -10.129   4.599  -6.394
  407    H    ASP  52           HN       ASP  52  -9.177   2.685 -10.573
  408    HA   ASP  52           HA       ASP  52  -9.237  -0.102 -10.983
  409   1HB   ASP  52          HB2       ASP  52  -8.950   2.102 -13.056
  410   2HB   ASP  52          HB1       ASP  52  -9.412   0.437 -13.413
  411    H    THR  53           HN       THR  53  -6.693   2.268 -11.564
  412    HA   THR  53           HA       THR  53  -4.895   0.279 -12.727
  413    HB   THR  53           HB       THR  53  -4.396   3.135 -12.008
  414    HG1  THR  53           HG1      THR  53  -5.399   1.809 -14.201
  415   1HG2  THR  53          HG21      THR  53  -2.358   2.931 -13.309
  416   2HG2  THR  53          HG22      THR  53  -2.756   1.264 -13.723
  417   3HG2  THR  53          HG23      THR  53  -2.339   1.683 -12.065
  418    H    TYR  54           HN       TYR  54  -5.607   1.580  -9.623
  419    HA   TYR  54           HA       TYR  54  -3.414  -0.089  -8.443
  420   1HB   TYR  54          HB2       TYR  54  -4.288   2.688  -7.629
  421   2HB   TYR  54          HB1       TYR  54  -3.325   1.633  -6.596
  422    HD1  TYR  54           HD1      TYR  54  -3.406   2.914 -10.072
  423    HD2  TYR  54           HD2      TYR  54  -0.985   1.748  -6.765
  424    HE1  TYR  54           HE1      TYR  54  -1.422   3.703 -11.299
  425    HE2  TYR  54           HE2      TYR  54   1.046   2.510  -7.977
  426    HH   TYR  54           HH       TYR  54   1.548   2.808 -10.710
  427    H    GLY  55           HN       GLY  55  -5.218  -1.657  -8.278
  428   1HA   GLY  55          HA2       GLY  55  -6.751  -1.227  -5.774
  429   2HA   GLY  55          HA1       GLY  55  -7.659  -1.657  -7.230
  430    H    SER  56           HN       SER  56  -7.526  -3.829  -7.999
  431    HA   SER  56           HA       SER  56  -7.142  -5.840  -6.100
  432   1HB   SER  56          HB2       SER  56  -8.249  -6.525  -8.059
  433   2HB   SER  56          HB1       SER  56  -6.998  -5.866  -9.110
  434    HG   SER  56           HG       SER  56  -7.146  -8.290  -7.803
  435    H    SER  57           HN       SER  57  -4.689  -4.011  -7.700
  436    HA   SER  57           HA       SER  57  -2.604  -6.055  -7.130
  437   1HB   SER  57          HB2       SER  57  -2.496  -3.357  -8.507
  438   2HB   SER  57          HB1       SER  57  -1.051  -4.292  -8.105
  439    HG   SER  57           HG       SER  57  -2.833  -4.618 -10.125
  440    H    ILE  58           HN       ILE  58  -2.359  -2.540  -6.706
  441    HA   ILE  58           HA       ILE  58  -0.701  -2.172  -4.649
  442    HB   ILE  58           HB       ILE  58  -2.185  -0.424  -5.591
  443   1HG1  ILE  58          HG12      ILE  58  -1.963  -0.643  -2.582
  444   2HG1  ILE  58          HG11      ILE  58  -0.944   0.300  -3.677
  445   1HG2  ILE  58          HG21      ILE  58  -4.262  -1.894  -5.190
  446   2HG2  ILE  58          HG22      ILE  58  -4.414  -0.157  -4.958
  447   3HG2  ILE  58          HG23      ILE  58  -4.231  -1.206  -3.565
  448   1HD1  ILE  58          HD11      ILE  58  -3.796   0.835  -2.819
  449   2HD1  ILE  58          HD12      ILE  58  -3.128   1.576  -4.275
  450   3HD1  ILE  58          HD13      ILE  58  -2.397   1.910  -2.702
  451    H    LEU  59           HN       LEU  59  -4.021  -3.304  -4.121
  452    HA   LEU  59           HA       LEU  59  -3.580  -3.672  -1.275
  453   1HB   LEU  59          HB2       LEU  59  -5.741  -5.156  -2.782
  454   2HB   LEU  59          HB1       LEU  59  -5.767  -4.556  -1.126
  455    HG   LEU  59           HG       LEU  59  -5.681  -2.754  -3.530
  456   1HD1  LEU  59          HD11      LEU  59  -7.707  -4.073  -3.652
  457   2HD1  LEU  59          HD12      LEU  59  -8.102  -2.426  -3.155
  458   3HD1  LEU  59          HD13      LEU  59  -8.058  -3.720  -1.959
  459   1HD2  LEU  59          HD21      LEU  59  -4.945  -1.855  -1.273
  460   2HD2  LEU  59          HD22      LEU  59  -6.584  -2.167  -0.706
  461   3HD2  LEU  59          HD23      LEU  59  -6.299  -1.005  -2.004
  462    H    SER  60           HN       SER  60  -3.899  -5.999  -4.006
  463    HA   SER  60           HA       SER  60  -3.038  -8.207  -2.276
  464   1HB   SER  60          HB2       SER  60  -4.686  -8.346  -4.241
  465   2HB   SER  60          HB1       SER  60  -3.265  -8.295  -5.282
  466    HG   SER  60           HG       SER  60  -2.691 -10.237  -4.608
  467    H    ILE  61           HN       ILE  61  -1.304  -5.782  -3.678
  468    HA   ILE  61           HA       ILE  61   0.846  -7.336  -4.839
  469    HB   ILE  61           HB       ILE  61   0.050  -4.792  -5.153
  470   1HG1  ILE  61          HG12      ILE  61   1.686  -6.066  -6.529
  471   2HG1  ILE  61          HG11      ILE  61   2.033  -4.354  -6.400
  472   1HG2  ILE  61          HG21      ILE  61   0.696  -3.982  -2.985
  473   2HG2  ILE  61          HG22      ILE  61   1.674  -3.222  -4.225
  474   3HG2  ILE  61          HG23      ILE  61   2.366  -4.497  -3.236
  475   1HD1  ILE  61          HD11      ILE  61   3.305  -6.453  -4.637
  476   2HD1  ILE  61          HD12      ILE  61   3.749  -4.751  -4.766
  477   3HD1  ILE  61          HD13      ILE  61   4.033  -5.845  -6.122
  478    H    LEU  62           HN       LEU  62   0.941  -5.273  -1.899
  479    HA   LEU  62           HA       LEU  62   3.352  -6.167  -0.862
  480   1HB   LEU  62          HB2       LEU  62   0.893  -5.569   0.764
  481   2HB   LEU  62          HB1       LEU  62   2.563  -5.516   1.334
  482    HG   LEU  62           HG       LEU  62   1.460  -3.846  -0.925
  483   1HD1  LEU  62          HD11      LEU  62   2.172  -3.048   1.905
  484   2HD1  LEU  62          HD12      LEU  62   0.532  -3.197   1.273
  485   3HD1  LEU  62          HD13      LEU  62   1.613  -1.957   0.637
  486   1HD2  LEU  62          HD21      LEU  62   3.697  -2.572  -0.330
  487   2HD2  LEU  62          HD22      LEU  62   3.719  -3.963  -1.415
  488   3HD2  LEU  62          HD23      LEU  62   4.174  -4.154   0.283
  489    H    LEU  63           HN       LEU  63   0.584  -8.106  -1.266
  490    HA   LEU  63           HA       LEU  63   1.201  -9.969   0.868
  491   1HB   LEU  63          HB2       LEU  63  -0.675  -9.992  -1.490
  492   2HB   LEU  63          HB1       LEU  63  -0.572 -11.322  -0.335
  493    HG   LEU  63           HG       LEU  63  -0.972  -9.646   1.498
  494   1HD1  LEU  63          HD11      LEU  63  -2.234  -7.538   0.565
  495   2HD1  LEU  63          HD12      LEU  63  -1.226  -7.823  -0.854
  496   3HD1  LEU  63          HD13      LEU  63  -0.480  -7.539   0.719
  497   1HD2  LEU  63          HD21      LEU  63  -3.193  -9.767  -0.553
  498   2HD2  LEU  63          HD22      LEU  63  -3.372  -9.620   1.194
  499   3HD2  LEU  63          HD23      LEU  63  -2.755 -11.116   0.494
  500    H    GLU  64           HN       GLU  64   1.348 -10.269  -2.737
  501    HA   GLU  64           HA       GLU  64   3.394 -12.446  -2.315
  502   1HB   GLU  64          HB2       GLU  64   1.135 -12.361  -4.321
  503   2HB   GLU  64          HB1       GLU  64   2.370 -13.618  -4.228
  504   1HG   GLU  64          HG2       GLU  64   0.534 -12.900  -1.925
  505   2HG   GLU  64          HG1       GLU  64   0.209 -14.209  -3.061
  506    H    GLU  65           HN       GLU  65   2.025 -10.472  -4.983
  507    HA   GLU  65           HA       GLU  65   4.051 -10.746  -6.816
  508   1HB   GLU  65          HB2       GLU  65   2.861  -8.042  -6.249
  509   2HB   GLU  65          HB1       GLU  65   3.401  -8.675  -7.799
  510   1HG   GLU  65          HG2       GLU  65   1.023  -9.620  -6.178
  511   2HG   GLU  65          HG1       GLU  65   0.979  -8.789  -7.731
  512    H    VAL  66           HN       VAL  66   4.328  -9.305  -3.781
  513    HA   VAL  66           HA       VAL  66   7.183  -8.677  -4.329
  514    HB   VAL  66           HB       VAL  66   5.667  -6.644  -4.664
  515   1HG1  VAL  66          HG11      VAL  66   5.608  -6.552  -1.661
  516   2HG1  VAL  66          HG12      VAL  66   4.319  -7.299  -2.581
  517   3HG1  VAL  66          HG13      VAL  66   4.669  -5.590  -2.802
  518   1HG2  VAL  66          HG21      VAL  66   8.075  -6.802  -2.884
  519   2HG2  VAL  66          HG22      VAL  66   7.243  -5.256  -3.002
  520   3HG2  VAL  66          HG23      VAL  66   7.894  -6.013  -4.450
  521    H    SER  67           HN       SER  67   8.446  -9.335  -2.614
  522    HA   SER  67           HA       SER  67   7.188 -10.558  -0.312
  523   1HB   SER  67          HB2       SER  67  10.103  -9.788  -0.572
  524   2HB   SER  67          HB1       SER  67   9.421 -11.076   0.414
  525    HG   SER  67           HG       SER  67   9.404 -12.322  -1.277
  526    HA   PRO  68           HA       PRO  68   6.682  -6.930   2.169
  527   1HB   PRO  68          HB2       PRO  68   7.675  -8.073   4.629
  528   2HB   PRO  68          HB1       PRO  68   5.984  -7.834   4.149
  529   1HG   PRO  68          HG2       PRO  68   7.509 -10.328   4.235
  530   2HG   PRO  68          HG1       PRO  68   5.779 -10.105   3.930
  531   1HD   PRO  68          HD2       PRO  68   7.741 -10.845   2.012
  532   2HD   PRO  68          HD1       PRO  68   6.068 -10.357   1.679
  533    H    GLU  69           HN       GLU  69   9.770  -8.632   2.205
  534    HA   GLU  69           HA       GLU  69  11.180  -6.409   3.457
  535   1HB   GLU  69          HB2       GLU  69  13.192  -7.870   2.240
  536   2HB   GLU  69          HB1       GLU  69  12.558  -8.194   3.848
  537   1HG   GLU  69          HG2       GLU  69  11.406  -9.444   1.340
  538   2HG   GLU  69          HG1       GLU  69  12.659 -10.198   2.317
  539    H    LEU  70           HN       LEU  70  11.024  -7.623   0.075
  540    HA   LEU  70           HA       LEU  70  12.677  -5.667  -1.098
  541   1HB   LEU  70          HB2       LEU  70  11.898  -7.404  -2.518
  542   2HB   LEU  70          HB1       LEU  70  10.222  -7.142  -2.061
  543    HG   LEU  70           HG       LEU  70  10.224  -4.979  -3.270
  544   1HD1  LEU  70          HD11      LEU  70  12.443  -4.198  -3.180
  545   2HD1  LEU  70          HD12      LEU  70  12.276  -4.687  -4.859
  546   3HD1  LEU  70          HD13      LEU  70  13.116  -5.734  -3.712
  547   1HD2  LEU  70          HD21      LEU  70  11.361  -7.041  -5.162
  548   2HD2  LEU  70          HD22      LEU  70  10.027  -5.917  -5.419
  549   3HD2  LEU  70          HD23      LEU  70   9.809  -7.319  -4.373
  550    H    VAL  71           HN       VAL  71   9.315  -5.512  -0.054
  551    HA   VAL  71           HA       VAL  71   8.543  -3.039  -1.129
  552    HB   VAL  71           HB       VAL  71   7.884  -4.195   1.588
  553   1HG1  VAL  71          HG11      VAL  71   5.795  -2.799   1.287
  554   2HG1  VAL  71          HG12      VAL  71   6.605  -2.006  -0.064
  555   3HG1  VAL  71          HG13      VAL  71   7.269  -1.873   1.565
  556   1HG2  VAL  71          HG21      VAL  71   7.442  -5.510  -0.633
  557   2HG2  VAL  71          HG22      VAL  71   6.172  -4.319  -0.890
  558   3HG2  VAL  71          HG23      VAL  71   6.137  -5.355   0.538
  559    H    CYS  72           HN       CYS  72   9.595  -3.413   2.267
  560    HA   CYS  72           HA       CYS  72  10.046  -0.719   2.818
  561   1HB   CYS  72          HB2       CYS  72  10.340  -2.509   4.519
  562   2HB   CYS  72          HB1       CYS  72  11.875  -2.952   3.759
  563    H    SER  73           HN       SER  73  11.752  -2.671   0.581
  564    HA   SER  73           HA       SER  73  14.094  -0.873   0.481
  565   1HB   SER  73          HB2       SER  73  13.543  -2.925  -1.637
  566   2HB   SER  73          HB1       SER  73  15.076  -2.441  -0.929
  567    HG   SER  73           HG       SER  73  14.185  -4.548  -0.280
  568    H    MET  74           HN       MET  74  11.451  -1.877  -1.782
  569    HA   MET  74           HA       MET  74  11.926   0.020  -3.803
  570   1HB   MET  74          HB2       MET  74   9.342  -1.102  -2.692
  571   2HB   MET  74          HB1       MET  74   9.326   0.069  -4.007
  572   1HG   MET  74          HG2       MET  74  10.992  -1.529  -5.189
  573   2HG   MET  74          HG1       MET  74  10.478  -2.722  -3.999
  574   1HE   MET  74          HE1       MET  74   6.970  -3.535  -4.574
  575   2HE   MET  74          HE2       MET  74   7.095  -1.989  -3.732
  576   3HE   MET  74          HE3       MET  74   8.285  -3.249  -3.424
  577    H    LEU  75           HN       LEU  75  10.362   0.464  -0.655
  578    HA   LEU  75           HA       LEU  75   9.455   3.143  -1.066
  579   1HB   LEU  75          HB2       LEU  75  10.467   1.919   1.523
  580   2HB   LEU  75          HB1       LEU  75   9.431   3.335   1.378
  581    HG   LEU  75           HG       LEU  75   8.717   0.504   0.556
  582   1HD1  LEU  75          HD11      LEU  75   8.753   1.196   3.047
  583   2HD1  LEU  75          HD12      LEU  75   7.277   0.460   2.424
  584   3HD1  LEU  75          HD13      LEU  75   7.365   2.208   2.643
  585   1HD2  LEU  75          HD21      LEU  75   7.545   1.819  -0.992
  586   2HD2  LEU  75          HD22      LEU  75   7.348   3.156   0.143
  587   3HD2  LEU  75          HD23      LEU  75   6.386   1.691   0.331
  588    H    HIS  76           HN       HIS  76  12.618   1.797  -0.462
  589    HA   HIS  76           HA       HIS  76  14.716   2.818  -0.207
  590   1HB   HIS  76          HB2       HIS  76  13.204   4.592  -2.127
  591   2HB   HIS  76          HB1       HIS  76  14.876   4.949  -1.690
  592    HD1  HIS  76           HD1      HIS  76  16.400   2.504  -1.828
  593    HD2  HIS  76           HD2      HIS  76  13.163   3.047  -4.399
  594    HE1  HIS  76           HE1      HIS  76  16.747   0.907  -3.763
  595    H    LEU  77           HN       LEU  77  13.191   3.303   2.041
  596    HA   LEU  77           HA       LEU  77  13.276   6.220   2.565
  597   1HB   LEU  77          HB2       LEU  77  11.926   5.799   4.425
  598   2HB   LEU  77          HB1       LEU  77  11.442   4.494   3.351
  599    HG   LEU  77           HG       LEU  77  13.353   3.140   4.534
  600   1HD1  LEU  77          HD11      LEU  77  14.398   4.064   6.302
  601   2HD1  LEU  77          HD12      LEU  77  12.869   4.426   7.096
  602   3HD1  LEU  77          HD13      LEU  77  13.581   5.589   5.986
  603   1HD2  LEU  77          HD21      LEU  77  11.738   2.369   6.237
  604   2HD2  LEU  77          HD22      LEU  77  10.938   2.635   4.689
  605   3HD2  LEU  77          HD23      LEU  77  10.770   3.822   5.981
  606    H    CYS  78           HN       CYS  78  15.067   3.294   3.267
  607    HA   CYS  78           HA       CYS  78  16.619   4.237   5.472
  608   1HB   CYS  78          HB2       CYS  78  17.297   2.258   3.276
  609   2HB   CYS  78          HB1       CYS  78  18.343   2.571   4.658
  610    H    SER  79           HN       SER  79  16.413   5.452   2.372
  611    HA   SER  79           HA       SER  79  18.984   6.042   1.503
  612   1HB   SER  79          HB2       SER  79  16.597   7.911   1.547
  613   2HB   SER  79          HB1       SER  79  18.042   8.142   0.565
  614    HG   SER  79           HG       SER  79  16.138   7.010  -0.395
  615    H    GLY  80           HN       GLY  80  20.627   6.643   2.838
  616   1HA   GLY  80          HA2       GLY  80  20.153   8.525   5.067
  617   2HA   GLY  80          HA1       GLY  80  21.670   7.699   4.706
  618    H    LEU  81           HN       LEU  81  21.463   8.464   1.858
  619    HA   LEU  81           HA       LEU  81  22.083  11.374   2.017
  620   1HB   LEU  81          HB2       LEU  81  23.739  10.798   0.098
  621   2HB   LEU  81          HB1       LEU  81  24.230  10.432   1.745
  622    HG   LEU  81           HG       LEU  81  24.685   8.590   0.090
  623   1HD1  LEU  81          HD11      LEU  81  22.765   7.250   1.890
  624   2HD1  LEU  81          HD12      LEU  81  23.850   8.364   2.716
  625   3HD1  LEU  81          HD13      LEU  81  24.508   7.058   1.739
  626   1HD2  LEU  81          HD21      LEU  81  21.696   8.098   0.099
  627   2HD2  LEU  81          HD22      LEU  81  22.925   7.324  -0.892
  628   3HD2  LEU  81          HD23      LEU  81  22.497   9.006  -1.186
  629    H    VAL  82           HN       VAL  82  22.309  11.990  -0.570
  630    HA   VAL  82           HA       VAL  82  19.611  11.451  -1.542
  631    HB   VAL  82           HB       VAL  82  20.475  12.859  -3.562
  632   1HG1  VAL  82          HG11      VAL  82  20.298  14.070  -0.786
  633   2HG1  VAL  82          HG12      VAL  82  18.925  13.674  -1.823
  634   3HG1  VAL  82          HG13      VAL  82  20.064  14.932  -2.309
  635   1HG2  VAL  82          HG21      VAL  82  22.426  14.224  -3.089
  636   2HG2  VAL  82          HG22      VAL  82  22.887  12.534  -2.887
  637   3HG2  VAL  82          HG23      VAL  82  22.570  13.538  -1.471
  638    HA   PRO  83           HA       PRO  83  20.846   7.764  -3.680
  639   1HB   PRO  83          HB2       PRO  83  18.960   8.486  -5.848
  640   2HB   PRO  83          HB1       PRO  83  18.985   7.050  -4.811
  641   1HG   PRO  83          HG2       PRO  83  17.197   9.199  -4.543
  642   2HG   PRO  83          HG1       PRO  83  17.544   7.985  -3.304
  643   1HD   PRO  83          HD2       PRO  83  18.310  10.818  -3.327
  644   2HD   PRO  83          HD1       PRO  83  18.446   9.624  -2.010
  645    H    ARG  84           HN       ARG  84  22.374   7.337  -5.349
  646    HA   ARG  84           HA       ARG  84  23.484   9.700  -6.713
  647   1HB   ARG  84          HB2       ARG  84  24.300   6.782  -6.572
  648   2HB   ARG  84          HB1       ARG  84  25.106   7.924  -7.641
  649   1HG   ARG  84          HG2       ARG  84  26.456   8.046  -5.738
  650   2HG   ARG  84          HG1       ARG  84  25.352   9.387  -5.454
  651   1HD   ARG  84          HD2       ARG  84  25.609   7.994  -3.432
  652   2HD   ARG  84          HD1       ARG  84  23.952   7.936  -4.031
  653    HE   ARG  84           HE       ARG  84  25.160   5.765  -5.247
  654   1HH1  ARG  84          HH21      ARG  84  24.857   6.976  -2.034
  655   2HH1  ARG  84          HH22      ARG  84  24.896   5.408  -1.297
  656   1HH2  ARG  84          HH11      ARG  84  25.213   3.710  -4.303
  657   2HH2  ARG  84          HH12      ARG  84  25.098   3.560  -2.582
  Start of MODEL   14
    1   1H    SER   1           HT1      SER   1  19.859   6.942  10.531
    2   2H    SER   1           HT2      SER   1  21.368   7.608  10.125
    3   3H    SER   1           HT3      SER   1  21.190   5.925  10.268
    4    HA   SER   1           HA       SER   1  19.831   7.607   8.235
    5   1HB   SER   1          HB2       SER   1  22.213   5.744   8.007
    6   2HB   SER   1          HB1       SER   1  21.395   6.514   6.650
    7    HG   SER   1           HG       SER   1  22.060   8.272   8.623
    8    H    ASP   2           HN       ASP   2  21.032   4.252   8.571
    9    HA   ASP   2           HA       ASP   2  18.661   3.208   7.262
   10   1HB   ASP   2          HB2       ASP   2  20.830   1.761   8.817
   11   2HB   ASP   2          HB1       ASP   2  19.638   0.998   7.763
   12    H    VAL   3           HN       VAL   3  17.708   4.690   9.336
   13    HA   VAL   3           HA       VAL   3  17.179   2.932  11.640
   14    HB   VAL   3           HB       VAL   3  16.274   5.723  11.009
   15   1HG1  VAL   3          HG11      VAL   3  14.655   4.880  12.510
   16   2HG1  VAL   3          HG12      VAL   3  15.817   5.687  13.559
   17   3HG1  VAL   3          HG13      VAL   3  15.850   3.932  13.394
   18   1HG2  VAL   3          HG21      VAL   3  17.935   6.371  12.722
   19   2HG2  VAL   3          HG22      VAL   3  18.702   5.524  11.379
   20   3HG2  VAL   3          HG23      VAL   3  18.400   4.678  12.896
   21    H    TYR   4           HN       TYR   4  15.285   4.660   9.159
   22    HA   TYR   4           HA       TYR   4  12.787   3.458   9.920
   23   1HB   TYR   4          HB2       TYR   4  13.788   5.031   7.567
   24   2HB   TYR   4          HB1       TYR   4  12.252   4.185   7.401
   25    HD1  TYR   4           HD1      TYR   4  10.834   6.125   7.311
   26    HD2  TYR   4           HD2      TYR   4  13.519   5.572  10.618
   27    HE1  TYR   4           HE1      TYR   4   9.684   7.929   8.553
   28    HE2  TYR   4           HE2      TYR   4  12.379   7.367  11.856
   29    HH   TYR   4           HH       TYR   4  10.451   8.622  11.917
   30    H    CYS   5           HN       CYS   5  15.120   2.658   7.320
   31    HA   CYS   5           HA       CYS   5  13.742   0.583   6.071
   32   1HB   CYS   5          HB2       CYS   5  16.640   1.072   6.638
   33   2HB   CYS   5          HB1       CYS   5  16.187  -0.519   6.028
   34    H    GLU   6           HN       GLU   6  15.677   0.345   9.073
   35    HA   GLU   6           HA       GLU   6  15.173  -2.442   9.510
   36   1HB   GLU   6          HB2       GLU   6  15.722  -0.235  11.520
   37   2HB   GLU   6          HB1       GLU   6  15.814  -1.964  11.859
   38   1HG   GLU   6          HG2       GLU   6  17.577  -2.228  10.176
   39   2HG   GLU   6          HG1       GLU   6  17.463  -0.516   9.766
   40    H    VAL   7           HN       VAL   7  13.551   0.455  10.840
   41    HA   VAL   7           HA       VAL   7  11.528  -0.988  12.269
   42    HB   VAL   7           HB       VAL   7  11.334   1.789  11.058
   43   1HG1  VAL   7          HG11      VAL   7   9.185   0.978  11.816
   44   2HG1  VAL   7          HG12      VAL   7   9.780   2.135  13.006
   45   3HG1  VAL   7          HG13      VAL   7   9.883   0.404  13.330
   46   1HG2  VAL   7          HG21      VAL   7  12.181   1.126  13.885
   47   2HG2  VAL   7          HG22      VAL   7  12.347   2.655  13.020
   48   3HG2  VAL   7          HG23      VAL   7  13.361   1.282  12.587
   49    H    CYS   8           HN       CYS   8  11.106   0.940   9.309
   50    HA   CYS   8           HA       CYS   8   8.604   0.071   8.512
   51   1HB   CYS   8          HB2       CYS   8   9.573   1.783   7.231
   52   2HB   CYS   8          HB1       CYS   8  11.056   0.873   6.964
   53    H    GLU   9           HN       GLU   9  11.392  -1.896   8.788
   54    HA   GLU   9           HA       GLU   9  10.463  -3.861   6.761
   55   1HB   GLU   9          HB2       GLU   9  12.927  -3.589   7.126
   56   2HB   GLU   9          HB1       GLU   9  12.728  -4.228   8.764
   57   1HG   GLU   9          HG2       GLU   9  11.916  -6.333   7.909
   58   2HG   GLU   9          HG1       GLU   9  11.869  -5.701   6.262
   59    H    PHE  10           HN       PHE  10  10.703  -3.689  10.313
   60    HA   PHE  10           HA       PHE  10   9.549  -6.315  10.701
   61   1HB   PHE  10          HB2       PHE  10  10.947  -5.313  12.429
   62   2HB   PHE  10          HB1       PHE  10   9.829  -3.959  12.588
   63    HD1  PHE  10           HD1      PHE  10   9.749  -7.716  12.609
   64    HD2  PHE  10           HD2      PHE  10   8.266  -4.068  14.329
   65    HE1  PHE  10           HE1      PHE  10   8.413  -9.025  14.237
   66    HE2  PHE  10           HE2      PHE  10   6.932  -5.380  15.956
   67    HZ   PHE  10           HZ       PHE  10   7.005  -7.857  15.910
   68    H    LEU  11           HN       LEU  11   8.186  -3.178  10.087
   69    HA   LEU  11           HA       LEU  11   5.550  -3.902  11.190
   70   1HB   LEU  11          HB2       LEU  11   6.229  -1.538   9.426
   71   2HB   LEU  11          HB1       LEU  11   4.858  -1.707  10.523
   72    HG   LEU  11           HG       LEU  11   7.773  -1.605  11.347
   73   1HD1  LEU  11          HD11      LEU  11   6.962   0.558  12.440
   74   2HD1  LEU  11          HD12      LEU  11   5.512   0.404  11.449
   75   3HD1  LEU  11          HD13      LEU  11   7.089   0.588  10.681
   76   1HD2  LEU  11          HD21      LEU  11   6.594  -1.307  13.654
   77   2HD2  LEU  11          HD22      LEU  11   6.684  -2.930  12.977
   78   3HD2  LEU  11          HD23      LEU  11   5.185  -2.010  12.857
   79    H    VAL  12           HN       VAL  12   6.866  -3.199   7.935
   80    HA   VAL  12           HA       VAL  12   4.504  -3.812   6.501
   81    HB   VAL  12           HB       VAL  12   6.539  -2.714   5.576
   82   1HG1  VAL  12          HG11      VAL  12   8.089  -4.445   6.622
   83   2HG1  VAL  12          HG12      VAL  12   8.455  -3.980   4.960
   84   3HG1  VAL  12          HG13      VAL  12   7.637  -5.504   5.289
   85   1HG2  VAL  12          HG21      VAL  12   4.829  -3.517   4.047
   86   2HG2  VAL  12          HG22      VAL  12   5.491  -5.149   4.115
   87   3HG2  VAL  12          HG23      VAL  12   6.415  -3.856   3.353
   88    H    LYS  13           HN       LYS  13   6.908  -5.939   7.912
   89    HA   LYS  13           HA       LYS  13   5.930  -8.316   6.460
   90   1HB   LYS  13          HB2       LYS  13   8.287  -8.122   7.052
   91   2HB   LYS  13          HB1       LYS  13   7.869  -8.010   8.758
   92   1HG   LYS  13          HG2       LYS  13   6.612 -10.392   7.686
   93   2HG   LYS  13          HG1       LYS  13   8.295 -10.396   7.181
   94   1HD   LYS  13          HD2       LYS  13   8.261 -11.510   9.282
   95   2HD   LYS  13          HD1       LYS  13   8.888  -9.899   9.622
   96   1HE   LYS  13          HE2       LYS  13   6.745  -9.164  10.454
   97   2HE   LYS  13          HE1       LYS  13   5.966 -10.649   9.911
   98   1HZ   LYS  13          HZ1       LYS  13   6.895 -10.268  12.383
   99   2HZ   LYS  13          HZ2       LYS  13   8.242 -11.014  11.663
  100   3HZ   LYS  13          HZ3       LYS  13   6.732 -11.794  11.661
  101    H    GLU  14           HN       GLU  14   5.613  -6.910   9.720
  102    HA   GLU  14           HA       GLU  14   4.108  -9.179  10.754
  103   1HB   GLU  14          HB2       GLU  14   5.393  -7.487  12.159
  104   2HB   GLU  14          HB1       GLU  14   4.097  -6.340  11.816
  105   1HG   GLU  14          HG2       GLU  14   3.526  -7.353  13.902
  106   2HG   GLU  14          HG1       GLU  14   2.482  -8.112  12.700
  107    H    VAL  15           HN       VAL  15   3.209  -5.876   9.757
  108    HA   VAL  15           HA       VAL  15   0.419  -6.125  10.002
  109    HB   VAL  15           HB       VAL  15   1.751  -4.038   9.338
  110   1HG1  VAL  15          HG11      VAL  15   1.367  -5.117   6.535
  111   2HG1  VAL  15          HG12      VAL  15   2.892  -5.259   7.405
  112   3HG1  VAL  15          HG13      VAL  15   2.237  -3.666   7.027
  113   1HG2  VAL  15          HG21      VAL  15  -0.151  -3.271   7.764
  114   2HG2  VAL  15          HG22      VAL  15  -0.613  -3.847   9.366
  115   3HG2  VAL  15          HG23      VAL  15  -0.800  -4.900   7.965
  116    H    THR  16           HN       THR  16   2.559  -7.058   7.334
  117    HA   THR  16           HA       THR  16   0.647  -7.974   5.494
  118    HB   THR  16           HB       THR  16   2.725  -9.812   5.239
  119    HG1  THR  16           HG1      THR  16   4.255  -7.732   5.794
  120   1HG2  THR  16          HG21      THR  16   1.865  -8.258   3.509
  121   2HG2  THR  16          HG22      THR  16   3.633  -8.243   3.596
  122   3HG2  THR  16          HG23      THR  16   2.705  -6.923   4.317
  123    H    LYS  17           HN       LYS  17   2.187  -9.790   8.179
  124    HA   LYS  17           HA       LYS  17   1.044 -12.295   7.810
  125   1HB   LYS  17          HB2       LYS  17   1.626 -10.738  10.331
  126   2HB   LYS  17          HB1       LYS  17   0.922 -12.350  10.414
  127   1HG   LYS  17          HG2       LYS  17   2.801 -13.286   9.178
  128   2HG   LYS  17          HG1       LYS  17   3.473 -11.680   8.920
  129   1HD   LYS  17          HD2       LYS  17   4.727 -12.458  10.745
  130   2HD   LYS  17          HD1       LYS  17   3.469 -11.508  11.530
  131   1HE   LYS  17          HE2       LYS  17   3.793 -13.713  12.628
  132   2HE   LYS  17          HE1       LYS  17   2.170 -13.545  11.966
  133   1HZ   LYS  17          HZ1       LYS  17   3.287 -15.698  11.468
  134   2HZ   LYS  17          HZ2       LYS  17   4.404 -14.846  10.514
  135   3HZ   LYS  17          HZ3       LYS  17   2.758 -14.853  10.097
  136    H    LEU  18           HN       LEU  18  -0.527  -9.376   9.063
  137    HA   LEU  18           HA       LEU  18  -3.087 -10.883   9.371
  138   1HB   LEU  18          HB2       LEU  18  -3.593  -9.347  10.979
  139   2HB   LEU  18          HB1       LEU  18  -1.907  -8.867  10.867
  140    HG   LEU  18           HG       LEU  18  -2.628  -7.230   9.043
  141   1HD1  LEU  18          HD11      LEU  18  -5.112  -8.598   9.369
  142   2HD1  LEU  18          HD12      LEU  18  -4.773  -7.205   8.345
  143   3HD1  LEU  18          HD13      LEU  18  -5.361  -6.963   9.987
  144   1HD2  LEU  18          HD21      LEU  18  -2.094  -6.583  11.368
  145   2HD2  LEU  18          HD22      LEU  18  -3.771  -6.877  11.829
  146   3HD2  LEU  18          HD23      LEU  18  -3.382  -5.579  10.700
  147    H    ILE  19           HN       ILE  19  -1.652  -8.288   7.428
  148    HA   ILE  19           HA       ILE  19  -4.044  -7.703   5.924
  149    HB   ILE  19           HB       ILE  19  -1.241  -6.921   6.034
  150   1HG1  ILE  19          HG12      ILE  19  -3.526  -5.410   4.789
  151   2HG1  ILE  19          HG11      ILE  19  -3.297  -5.525   6.536
  152   1HG2  ILE  19          HG21      ILE  19  -1.077  -6.107   3.672
  153   2HG2  ILE  19          HG22      ILE  19  -2.478  -7.102   3.283
  154   3HG2  ILE  19          HG23      ILE  19  -0.981  -7.860   3.827
  155   1HD1  ILE  19          HD11      ILE  19  -1.956  -3.716   6.314
  156   2HD1  ILE  19          HD12      ILE  19  -1.848  -3.908   4.570
  157   3HD1  ILE  19          HD13      ILE  19  -0.756  -4.814   5.622
  158    H    ASP  20           HN       ASP  20  -1.707 -10.207   5.870
  159    HA   ASP  20           HA       ASP  20  -1.336 -11.053   3.327
  160   1HB   ASP  20          HB2       ASP  20  -1.523 -13.400   4.136
  161   2HB   ASP  20          HB1       ASP  20  -0.627 -12.376   5.260
  162    H    ASN  21           HN       ASN  21  -4.404 -11.685   5.122
  163    HA   ASN  21           HA       ASN  21  -5.913 -11.490   2.629
  164   1HB   ASN  21          HB2       ASN  21  -5.507 -14.144   4.009
  165   2HB   ASN  21          HB1       ASN  21  -6.884 -13.839   2.946
  166   1HD2  ASN  21          HD21      ASN  21  -6.408 -13.382   0.642
  167   2HD2  ASN  21          HD22      ASN  21  -4.928 -13.862  -0.037
  168    H    ASN  22           HN       ASN  22  -5.717 -11.190   5.941
  169    HA   ASN  22           HA       ASN  22  -8.178 -11.932   6.997
  170   1HB   ASN  22          HB2       ASN  22  -7.947 -10.140   8.600
  171   2HB   ASN  22          HB1       ASN  22  -6.332 -10.750   8.238
  172   1HD2  ASN  22          HD21      ASN  22  -5.947  -9.502   5.692
  173   2HD2  ASN  22          HD22      ASN  22  -5.858  -7.822   5.931
  174    H    LYS  23           HN       LYS  23  -7.499  -8.984   5.113
  175    HA   LYS  23           HA       LYS  23 -10.457  -8.579   4.797
  176   1HB   LYS  23          HB2       LYS  23 -10.011  -6.231   4.537
  177   2HB   LYS  23          HB1       LYS  23  -9.186  -6.781   5.992
  178   1HG   LYS  23          HG2       LYS  23  -7.366  -5.719   5.075
  179   2HG   LYS  23          HG1       LYS  23  -7.208  -7.206   4.141
  180   1HD   LYS  23          HD2       LYS  23  -8.882  -6.011   2.492
  181   2HD   LYS  23          HD1       LYS  23  -8.344  -4.548   3.306
  182   1HE   LYS  23          HE2       LYS  23  -6.517  -6.577   1.990
  183   2HE   LYS  23          HE1       LYS  23  -6.985  -5.030   1.285
  184   1HZ   LYS  23          HZ1       LYS  23  -5.453  -3.998   2.484
  185   2HZ   LYS  23          HZ2       LYS  23  -4.879  -5.510   3.002
  186   3HZ   LYS  23          HZ3       LYS  23  -6.031  -4.673   3.928
  187    H    THR  24           HN       THR  24 -11.281  -8.484   2.735
  188    HA   THR  24           HA       THR  24  -9.423  -9.231   0.542
  189    HB   THR  24           HB       THR  24 -11.610  -9.605  -0.707
  190    HG1  THR  24           HG1      THR  24 -12.999  -8.370   0.473
  191   1HG2  THR  24          HG21      THR  24 -10.303 -11.400   0.454
  192   2HG2  THR  24          HG22      THR  24 -12.038 -11.715   0.428
  193   3HG2  THR  24          HG23      THR  24 -11.272 -11.116   1.900
  194    H    GLU  25           HN       GLU  25 -10.672  -8.271  -1.678
  195    HA   GLU  25           HA       GLU  25 -10.050  -5.387  -1.502
  196   1HB   GLU  25          HB2       GLU  25 -10.304  -5.504  -4.001
  197   2HB   GLU  25          HB1       GLU  25  -9.056  -6.559  -3.346
  198   1HG   GLU  25          HG2       GLU  25 -11.855  -7.607  -3.759
  199   2HG   GLU  25          HG1       GLU  25 -10.731  -7.526  -5.112
  200    H    LYS  26           HN       LYS  26 -12.774  -6.948  -0.801
  201    HA   LYS  26           HA       LYS  26 -14.644  -5.406  -2.471
  202   1HB   LYS  26          HB2       LYS  26 -14.931  -7.433  -0.251
  203   2HB   LYS  26          HB1       LYS  26 -16.316  -6.466  -0.755
  204   1HG   LYS  26          HG2       LYS  26 -16.344  -7.378  -2.915
  205   2HG   LYS  26          HG1       LYS  26 -14.669  -7.916  -2.825
  206   1HD   LYS  26          HD2       LYS  26 -16.676  -9.086  -0.903
  207   2HD   LYS  26          HD1       LYS  26 -16.655  -9.662  -2.568
  208   1HE   LYS  26          HE2       LYS  26 -14.391 -10.399  -2.393
  209   2HE   LYS  26          HE1       LYS  26 -14.150  -9.536  -0.876
  210   1HZ   LYS  26          HZ1       LYS  26 -14.705 -11.432   0.110
  211   2HZ   LYS  26          HZ2       LYS  26 -15.266 -12.126  -1.336
  212   3HZ   LYS  26          HZ3       LYS  26 -16.297 -11.149  -0.403
  213    H    GLU  27           HN       GLU  27 -13.507  -5.495   0.885
  214    HA   GLU  27           HA       GLU  27 -15.118  -3.217   1.670
  215   1HB   GLU  27          HB2       GLU  27 -12.686  -4.438   3.010
  216   2HB   GLU  27          HB1       GLU  27 -13.796  -3.286   3.751
  217   1HG   GLU  27          HG2       GLU  27 -15.660  -4.919   3.368
  218   2HG   GLU  27          HG1       GLU  27 -14.466  -6.082   2.794
  219    H    ILE  28           HN       ILE  28 -12.175  -3.648  -0.014
  220    HA   ILE  28           HA       ILE  28 -11.017  -1.065   0.718
  221    HB   ILE  28           HB       ILE  28 -10.321  -3.061  -1.450
  222   1HG1  ILE  28          HG12      ILE  28 -10.085  -3.950   0.842
  223   2HG1  ILE  28          HG11      ILE  28  -8.519  -3.742   0.072
  224   1HG2  ILE  28          HG21      ILE  28  -9.446  -0.942  -2.093
  225   2HG2  ILE  28          HG22      ILE  28  -8.106  -1.826  -1.364
  226   3HG2  ILE  28          HG23      ILE  28  -8.942  -0.581  -0.442
  227   1HD1  ILE  28          HD11      ILE  28  -9.653  -2.383   2.433
  228   2HD1  ILE  28          HD12      ILE  28  -8.817  -1.303   1.321
  229   3HD1  ILE  28          HD13      ILE  28  -7.972  -2.679   2.007
  230    H    LEU  29           HN       LEU  29 -11.753  -2.375  -2.516
  231    HA   LEU  29           HA       LEU  29 -11.922   0.033  -3.880
  232   1HB   LEU  29          HB2       LEU  29 -13.739  -2.355  -4.317
  233   2HB   LEU  29          HB1       LEU  29 -13.362  -1.111  -5.507
  234    HG   LEU  29           HG       LEU  29 -11.262  -2.855  -4.187
  235   1HD1  LEU  29          HD11      LEU  29 -12.819  -3.217  -6.749
  236   2HD1  LEU  29          HD12      LEU  29 -12.583  -4.373  -5.437
  237   3HD1  LEU  29          HD13      LEU  29 -11.240  -3.964  -6.503
  238   1HD2  LEU  29          HD21      LEU  29 -11.264  -0.827  -6.432
  239   2HD2  LEU  29          HD22      LEU  29 -10.039  -2.092  -6.366
  240   3HD2  LEU  29          HD23      LEU  29 -10.182  -0.937  -5.043
  241    H    ASP  30           HN       ASP  30 -14.263  -1.335  -1.661
  242    HA   ASP  30           HA       ASP  30 -16.432   0.455  -2.380
  243   1HB   ASP  30          HB2       ASP  30 -15.796  -1.151   0.111
  244   2HB   ASP  30          HB1       ASP  30 -17.215  -0.109   0.007
  245    H    ALA  31           HN       ALA  31 -13.834   0.462   0.019
  246    HA   ALA  31           HA       ALA  31 -14.443   2.796   1.408
  247   1HB   ALA  31          HB1       ALA  31 -11.699   1.905   0.569
  248   2HB   ALA  31          HB2       ALA  31 -12.587   1.292   1.965
  249   3HB   ALA  31          HB3       ALA  31 -12.090   2.983   1.910
  250    H    PHE  32           HN       PHE  32 -12.738   2.519  -1.701
  251    HA   PHE  32           HA       PHE  32 -12.271   5.350  -1.881
  252   1HB   PHE  32          HB2       PHE  32 -12.445   3.204  -4.021
  253   2HB   PHE  32          HB1       PHE  32 -11.972   4.872  -4.346
  254    HD1  PHE  32           HD1      PHE  32  -9.811   5.709  -3.723
  255    HD2  PHE  32           HD2      PHE  32 -11.059   1.782  -2.493
  256    HE1  PHE  32           HE1      PHE  32  -7.494   5.200  -3.010
  257    HE2  PHE  32           HE2      PHE  32  -8.727   1.273  -1.796
  258    HZ   PHE  32           HZ       PHE  32  -6.954   2.983  -2.045
  259    H    ASP  33           HN       ASP  33 -14.974   3.258  -2.739
  260    HA   ASP  33           HA       ASP  33 -16.430   5.321  -4.181
  261   1HB   ASP  33          HB2       ASP  33 -16.906   2.886  -4.471
  262   2HB   ASP  33          HB1       ASP  33 -17.475   2.822  -2.802
  263    H    LYS  34           HN       LYS  34 -15.453   5.039  -1.074
  264    HA   LYS  34           HA       LYS  34 -17.814   6.520   0.048
  265   1HB   LYS  34          HB2       LYS  34 -15.765   4.704   1.362
  266   2HB   LYS  34          HB1       LYS  34 -16.889   5.712   2.272
  267   1HG   LYS  34          HG2       LYS  34 -18.738   4.434   1.685
  268   2HG   LYS  34          HG1       LYS  34 -18.039   3.921   0.151
  269   1HD   LYS  34          HD2       LYS  34 -18.237   2.115   1.944
  270   2HD   LYS  34          HD1       LYS  34 -16.644   2.296   1.221
  271   1HE   LYS  34          HE2       LYS  34 -15.725   3.210   3.149
  272   2HE   LYS  34          HE1       LYS  34 -17.259   3.891   3.681
  273   1HZ   LYS  34          HZ1       LYS  34 -16.666   0.987   3.620
  274   2HZ   LYS  34          HZ2       LYS  34 -18.035   1.739   4.290
  275   3HZ   LYS  34          HZ3       LYS  34 -16.507   1.960   5.001
  276    H    MET  35           HN       MET  35 -14.379   6.123   0.931
  277    HA   MET  35           HA       MET  35 -14.112   8.789   1.903
  278   1HB   MET  35          HB2       MET  35 -12.345   7.693   2.803
  279   2HB   MET  35          HB1       MET  35 -12.459   6.431   1.597
  280   1HG   MET  35          HG2       MET  35 -11.159   9.089   0.987
  281   2HG   MET  35          HG1       MET  35 -10.268   7.764   1.709
  282   1HE   MET  35          HE1       MET  35 -11.437   5.058   0.217
  283   2HE   MET  35          HE2       MET  35  -9.928   5.623   0.912
  284   3HE   MET  35          HE3       MET  35  -9.970   5.070  -0.757
  285    H    CYS  36           HN       CYS  36 -13.321   7.373  -1.276
  286    HA   CYS  36           HA       CYS  36 -12.401   9.993  -2.252
  287   1HB   CYS  36          HB2       CYS  36 -12.224   7.233  -3.128
  288   2HB   CYS  36          HB1       CYS  36 -12.829   8.220  -4.455
  289    H    SER  37           HN       SER  37 -15.288   9.062  -1.360
  290    HA   SER  37           HA       SER  37 -16.870   9.745  -3.737
  291   1HB   SER  37          HB2       SER  37 -17.543   8.125  -1.830
  292   2HB   SER  37          HB1       SER  37 -17.917   9.576  -0.908
  293    HG   SER  37           HG       SER  37 -18.889   9.169  -3.531
  294    H    LYS  38           HN       LYS  38 -16.202  11.186  -0.545
  295    HA   LYS  38           HA       LYS  38 -17.613  13.641  -1.070
  296   1HB   LYS  38          HB2       LYS  38 -16.327  14.496   0.897
  297   2HB   LYS  38          HB1       LYS  38 -17.114  12.950   1.220
  298   1HG   LYS  38          HG2       LYS  38 -14.931  11.822   0.582
  299   2HG   LYS  38          HG1       LYS  38 -14.194  13.425   0.571
  300   1HD   LYS  38          HD2       LYS  38 -15.120  13.694   2.949
  301   2HD   LYS  38          HD1       LYS  38 -15.427  11.957   2.907
  302   1HE   LYS  38          HE2       LYS  38 -13.026  11.575   2.361
  303   2HE   LYS  38          HE1       LYS  38 -12.741  13.309   2.513
  304   1HZ   LYS  38          HZ1       LYS  38 -13.912  12.908   4.810
  305   2HZ   LYS  38          HZ2       LYS  38 -12.246  12.636   4.613
  306   3HZ   LYS  38          HZ3       LYS  38 -13.333  11.330   4.586
  307    H    LEU  39           HN       LEU  39 -14.413  12.477  -1.822
  308    HA   LEU  39           HA       LEU  39 -12.915  14.761  -2.164
  309   1HB   LEU  39          HB2       LEU  39 -12.837  12.090  -3.207
  310   2HB   LEU  39          HB1       LEU  39 -12.623  13.143  -4.585
  311    HG   LEU  39           HG       LEU  39 -10.880  14.238  -2.644
  312   1HD1  LEU  39          HD11      LEU  39 -11.345  12.012  -1.414
  313   2HD1  LEU  39          HD12      LEU  39  -9.665  12.504  -1.641
  314   3HD1  LEU  39          HD13      LEU  39 -10.373  11.276  -2.688
  315   1HD2  LEU  39          HD21      LEU  39 -10.238  12.251  -4.840
  316   2HD2  LEU  39          HD22      LEU  39  -9.117  13.409  -4.123
  317   3HD2  LEU  39          HD23      LEU  39 -10.487  13.980  -5.074
  318    HA   PRO  40           HA       PRO  40 -15.181  17.338  -5.032
  319   1HB   PRO  40          HB2       PRO  40 -12.730  18.083  -6.471
  320   2HB   PRO  40          HB1       PRO  40 -13.759  19.094  -5.448
  321   1HG   PRO  40          HG2       PRO  40 -11.176  18.061  -4.785
  322   2HG   PRO  40          HG1       PRO  40 -12.282  18.922  -3.704
  323   1HD   PRO  40          HD2       PRO  40 -11.595  16.111  -3.657
  324   2HD   PRO  40          HD1       PRO  40 -12.675  16.986  -2.555
  325    H    LYS  41           HN       LYS  41 -16.189  16.691  -6.902
  326    HA   LYS  41           HA       LYS  41 -15.914  14.322  -8.199
  327   1HB   LYS  41          HB2       LYS  41 -17.655  16.060  -8.643
  328   2HB   LYS  41          HB1       LYS  41 -16.482  16.899  -9.658
  329   1HG   LYS  41          HG2       LYS  41 -16.311  15.012 -11.144
  330   2HG   LYS  41          HG1       LYS  41 -17.315  14.023 -10.082
  331   1HD   LYS  41          HD2       LYS  41 -19.283  15.067 -10.724
  332   2HD   LYS  41          HD1       LYS  41 -18.498  16.619 -11.004
  333   1HE   LYS  41          HE2       LYS  41 -17.496  15.767 -13.069
  334   2HE   LYS  41          HE1       LYS  41 -18.231  14.188 -12.793
  335   1HZ   LYS  41          HZ1       LYS  41 -20.404  15.170 -12.949
  336   2HZ   LYS  41          HZ2       LYS  41 -19.513  15.582 -14.336
  337   3HZ   LYS  41          HZ3       LYS  41 -19.743  16.725 -13.100
  338    H    SER  42           HN       SER  42 -14.124  17.236  -9.083
  339    HA   SER  42           HA       SER  42 -12.794  16.260 -11.373
  340   1HB   SER  42          HB2       SER  42 -12.769  18.626 -10.347
  341   2HB   SER  42          HB1       SER  42 -11.469  18.035  -9.313
  342    HG   SER  42           HG       SER  42 -10.858  19.044 -11.385
  343    H    LEU  43           HN       LEU  43 -11.385  16.475  -8.108
  344    HA   LEU  43           HA       LEU  43  -9.263  14.624  -8.811
  345   1HB   LEU  43          HB2       LEU  43 -10.125  15.944  -6.236
  346   2HB   LEU  43          HB1       LEU  43  -8.750  14.838  -6.317
  347    HG   LEU  43           HG       LEU  43  -8.919  17.163  -8.234
  348   1HD1  LEU  43          HD11      LEU  43  -7.521  18.447  -6.552
  349   2HD1  LEU  43          HD12      LEU  43  -8.005  17.250  -5.349
  350   3HD1  LEU  43          HD13      LEU  43  -9.223  18.265  -6.125
  351   1HD2  LEU  43          HD21      LEU  43  -6.652  15.596  -6.952
  352   2HD2  LEU  43          HD22      LEU  43  -6.417  17.001  -7.989
  353   3HD2  LEU  43          HD23      LEU  43  -7.151  15.540  -8.643
  354    H    SER  44           HN       SER  44 -12.472  14.071  -8.118
  355    HA   SER  44           HA       SER  44 -12.029  11.648  -6.483
  356   1HB   SER  44          HB2       SER  44 -14.350  11.555  -6.239
  357   2HB   SER  44          HB1       SER  44 -14.132  13.286  -6.467
  358    HG   SER  44           HG       SER  44 -15.322  11.418  -8.079
  359    H    GLU  45           HN       GLU  45 -12.374  12.729  -9.726
  360    HA   GLU  45           HA       GLU  45 -12.918  10.079 -10.817
  361   1HB   GLU  45          HB2       GLU  45 -12.273  12.757 -12.063
  362   2HB   GLU  45          HB1       GLU  45 -12.459  11.288 -13.022
  363   1HG   GLU  45          HG2       GLU  45 -14.736  10.993 -12.224
  364   2HG   GLU  45          HG1       GLU  45 -14.562  12.355 -11.116
  365    H    GLU  46           HN       GLU  46 -10.205  12.213 -10.226
  366    HA   GLU  46           HA       GLU  46  -8.314  10.541 -11.719
  367   1HB   GLU  46          HB2       GLU  46  -8.058  12.980  -9.960
  368   2HB   GLU  46          HB1       GLU  46  -6.630  12.094 -10.494
  369   1HG   GLU  46          HG2       GLU  46  -7.153  13.957 -12.033
  370   2HG   GLU  46          HG1       GLU  46  -7.304  12.397 -12.842
  371    H    CYS  47           HN       CYS  47  -9.432  10.835  -8.384
  372    HA   CYS  47           HA       CYS  47  -7.229   9.251  -7.316
  373   1HB   CYS  47          HB2       CYS  47  -8.231   9.482  -5.222
  374   2HB   CYS  47          HB1       CYS  47  -8.764  10.937  -6.051
  375    H    GLN  48           HN       GLN  48 -10.392   8.623  -8.654
  376    HA   GLN  48           HA       GLN  48 -10.390   5.808  -7.796
  377   1HB   GLN  48          HB2       GLN  48 -12.228   7.546  -9.454
  378   2HB   GLN  48          HB1       GLN  48 -12.421   5.793  -9.431
  379   1HG   GLN  48          HG2       GLN  48 -12.270   7.404  -6.878
  380   2HG   GLN  48          HG1       GLN  48 -13.797   7.145  -7.721
  381   1HE2  GLN  48          HE21      GLN  48 -14.311   5.916  -5.605
  382   2HE2  GLN  48          HE22      GLN  48 -13.847   4.285  -5.520
  383    H    GLU  49           HN       GLU  49  -9.202   7.804 -10.288
  384    HA   GLU  49           HA       GLU  49  -9.177   5.895 -12.419
  385   1HB   GLU  49          HB2       GLU  49  -8.878   8.319 -12.809
  386   2HB   GLU  49          HB1       GLU  49  -7.351   8.265 -11.928
  387   1HG   GLU  49          HG2       GLU  49  -6.398   6.749 -13.566
  388   2HG   GLU  49          HG1       GLU  49  -7.945   6.625 -14.403
  389    H    VAL  50           HN       VAL  50  -6.670   6.963 -10.100
  390    HA   VAL  50           HA       VAL  50  -4.725   5.037 -10.936
  391    HB   VAL  50           HB       VAL  50  -5.011   6.213  -8.161
  392   1HG1  VAL  50          HG11      VAL  50  -2.471   5.916  -8.307
  393   2HG1  VAL  50          HG12      VAL  50  -2.764   4.939  -9.749
  394   3HG1  VAL  50          HG13      VAL  50  -3.421   4.435  -8.188
  395   1HG2  VAL  50          HG21      VAL  50  -3.836   7.314 -10.723
  396   2HG2  VAL  50          HG22      VAL  50  -3.292   7.872  -9.141
  397   3HG2  VAL  50          HG23      VAL  50  -4.975   8.091  -9.621
  398    H    VAL  51           HN       VAL  51  -7.264   4.951  -8.428
  399    HA   VAL  51           HA       VAL  51  -6.708   2.556  -7.097
  400    HB   VAL  51           HB       VAL  51  -9.331   3.707  -8.118
  401   1HG1  VAL  51          HG11      VAL  51  -8.896   1.268  -6.380
  402   2HG1  VAL  51          HG12      VAL  51  -9.778   1.346  -7.905
  403   3HG1  VAL  51          HG13      VAL  51 -10.425   2.136  -6.469
  404   1HG2  VAL  51          HG21      VAL  51  -9.589   4.515  -5.906
  405   2HG2  VAL  51          HG22      VAL  51  -7.889   4.802  -6.279
  406   3HG2  VAL  51          HG23      VAL  51  -8.351   3.428  -5.277
  407    H    ASP  52           HN       ASP  52  -8.531   2.806 -10.188
  408    HA   ASP  52           HA       ASP  52  -8.709   0.041 -10.726
  409   1HB   ASP  52          HB2       ASP  52  -8.265   2.326 -12.681
  410   2HB   ASP  52          HB1       ASP  52  -8.782   0.700 -13.130
  411    H    THR  53           HN       THR  53  -6.048   2.328 -11.164
  412    HA   THR  53           HA       THR  53  -4.317   0.320 -12.373
  413    HB   THR  53           HB       THR  53  -3.685   3.086 -11.440
  414    HG1  THR  53           HG1      THR  53  -4.960   2.139 -13.556
  415   1HG2  THR  53          HG21      THR  53  -1.616   2.850 -12.686
  416   2HG2  THR  53          HG22      THR  53  -2.092   1.243 -13.227
  417   3HG2  THR  53          HG23      THR  53  -1.712   1.523 -11.531
  418    H    TYR  54           HN       TYR  54  -5.057   1.461  -9.218
  419    HA   TYR  54           HA       TYR  54  -3.027  -0.428  -8.081
  420   1HB   TYR  54          HB2       TYR  54  -3.753   2.339  -7.097
  421   2HB   TYR  54          HB1       TYR  54  -2.886   1.155  -6.122
  422    HD1  TYR  54           HD1      TYR  54  -0.541   1.153  -6.211
  423    HD2  TYR  54           HD2      TYR  54  -2.785   2.683  -9.492
  424    HE1  TYR  54           HE1      TYR  54   1.565   1.892  -7.301
  425    HE2  TYR  54           HE2      TYR  54  -0.724   3.447 -10.602
  426    HH   TYR  54           HH       TYR  54   1.771   4.089  -9.591
  427    H    GLY  55           HN       GLY  55  -5.089  -1.788  -8.199
  428   1HA   GLY  55          HA2       GLY  55  -6.639  -1.414  -5.680
  429   2HA   GLY  55          HA1       GLY  55  -7.513  -1.641  -7.198
  430    H    SER  56           HN       SER  56  -6.642  -3.687  -8.471
  431    HA   SER  56           HA       SER  56  -6.973  -5.914  -6.608
  432   1HB   SER  56          HB2       SER  56  -7.385  -7.191  -8.491
  433   2HB   SER  56          HB1       SER  56  -7.690  -5.597  -9.172
  434    HG   SER  56           HG       SER  56  -6.231  -6.344 -10.543
  435    H    SER  57           HN       SER  57  -4.290  -4.235  -7.963
  436    HA   SER  57           HA       SER  57  -2.423  -6.497  -7.516
  437   1HB   SER  57          HB2       SER  57  -1.999  -3.675  -8.543
  438   2HB   SER  57          HB1       SER  57  -0.679  -4.807  -8.243
  439    HG   SER  57           HG       SER  57  -1.914  -4.629 -10.436
  440    H    ILE  58           HN       ILE  58  -2.101  -3.067  -6.652
  441    HA   ILE  58           HA       ILE  58  -0.458  -2.958  -4.561
  442    HB   ILE  58           HB       ILE  58  -1.932  -1.122  -5.291
  443   1HG1  ILE  58          HG12      ILE  58  -1.828  -1.691  -2.318
  444   2HG1  ILE  58          HG11      ILE  58  -0.709  -0.695  -3.260
  445   1HG2  ILE  58          HG21      ILE  58  -4.177  -0.950  -4.744
  446   2HG2  ILE  58          HG22      ILE  58  -4.032  -2.065  -3.406
  447   3HG2  ILE  58          HG23      ILE  58  -4.024  -2.676  -5.070
  448   1HD1  ILE  58          HD11      ILE  58  -2.782   0.752  -3.835
  449   2HD1  ILE  58          HD12      ILE  58  -2.143   0.879  -2.195
  450   3HD1  ILE  58          HD13      ILE  58  -3.580  -0.099  -2.510
  451    H    LEU  59           HN       LEU  59  -3.779  -4.159  -4.164
  452    HA   LEU  59           HA       LEU  59  -3.264  -4.946  -1.399
  453   1HB   LEU  59          HB2       LEU  59  -5.559  -6.121  -2.968
  454   2HB   LEU  59          HB1       LEU  59  -5.486  -5.687  -1.263
  455    HG   LEU  59           HG       LEU  59  -5.375  -3.638  -3.446
  456   1HD1  LEU  59          HD11      LEU  59  -7.443  -4.931  -3.682
  457   2HD1  LEU  59          HD12      LEU  59  -7.763  -3.284  -3.140
  458   3HD1  LEU  59          HD13      LEU  59  -7.814  -4.616  -1.985
  459   1HD2  LEU  59          HD21      LEU  59  -6.349  -3.306  -0.624
  460   2HD2  LEU  59          HD22      LEU  59  -5.818  -2.056  -1.746
  461   3HD2  LEU  59          HD23      LEU  59  -4.642  -3.146  -1.023
  462    H    SER  60           HN       SER  60  -3.713  -6.710  -4.483
  463    HA   SER  60           HA       SER  60  -3.076  -9.277  -3.242
  464   1HB   SER  60          HB2       SER  60  -4.624  -8.830  -5.262
  465   2HB   SER  60          HB1       SER  60  -3.139  -8.764  -6.207
  466    HG   SER  60           HG       SER  60  -3.244 -10.856  -6.187
  467    H    ILE  61           HN       ILE  61  -1.092  -6.778  -4.029
  468    HA   ILE  61           HA       ILE  61   1.052  -8.451  -5.204
  469    HB   ILE  61           HB       ILE  61   0.247  -5.992  -5.816
  470   1HG1  ILE  61          HG12      ILE  61   2.012  -7.343  -6.955
  471   2HG1  ILE  61          HG11      ILE  61   2.328  -5.616  -6.961
  472   1HG2  ILE  61          HG21      ILE  61   2.461  -5.441  -3.856
  473   2HG2  ILE  61          HG22      ILE  61   0.761  -5.011  -3.648
  474   3HG2  ILE  61          HG23      ILE  61   1.704  -4.272  -4.929
  475   1HD1  ILE  61          HD11      ILE  61   3.515  -7.586  -4.986
  476   2HD1  ILE  61          HD12      ILE  61   3.873  -5.860  -5.073
  477   3HD1  ILE  61          HD13      ILE  61   4.350  -6.933  -6.395
  478    H    LEU  62           HN       LEU  62   1.006  -6.098  -2.444
  479    HA   LEU  62           HA       LEU  62   3.363  -6.940  -1.247
  480   1HB   LEU  62          HB2       LEU  62   0.834  -5.782  -0.119
  481   2HB   LEU  62          HB1       LEU  62   2.133  -6.270   0.961
  482    HG   LEU  62           HG       LEU  62   3.646  -4.854  -0.698
  483   1HD1  LEU  62          HD11      LEU  62   2.517  -3.870  -2.343
  484   2HD1  LEU  62          HD12      LEU  62   1.958  -2.726  -1.132
  485   3HD1  LEU  62          HD13      LEU  62   0.953  -4.101  -1.570
  486   1HD2  LEU  62          HD21      LEU  62   1.829  -3.735   1.440
  487   2HD2  LEU  62          HD22      LEU  62   3.166  -2.823   0.740
  488   3HD2  LEU  62          HD23      LEU  62   3.485  -4.314   1.627
  489    H    LEU  63           HN       LEU  63   0.851  -8.983  -1.876
  490    HA   LEU  63           HA       LEU  63   1.087 -10.548   0.617
  491   1HB   LEU  63          HB2       LEU  63  -0.435 -11.476  -1.797
  492   2HB   LEU  63          HB1       LEU  63  -0.809 -11.701  -0.088
  493    HG   LEU  63           HG       LEU  63  -1.219  -9.255  -1.811
  494   1HD1  LEU  63          HD11      LEU  63  -2.991 -10.985  -1.672
  495   2HD1  LEU  63          HD12      LEU  63  -3.515  -9.454  -0.968
  496   3HD1  LEU  63          HD13      LEU  63  -3.030 -10.785   0.079
  497   1HD2  LEU  63          HD21      LEU  63  -0.453  -8.062   0.020
  498   2HD2  LEU  63          HD22      LEU  63  -0.797  -9.365   1.157
  499   3HD2  LEU  63          HD23      LEU  63  -2.099  -8.339   0.569
  500    H    GLU  64           HN       GLU  64   1.490 -11.224  -2.900
  501    HA   GLU  64           HA       GLU  64   3.504 -13.335  -2.140
  502   1HB   GLU  64          HB2       GLU  64   1.348 -13.442  -4.254
  503   2HB   GLU  64          HB1       GLU  64   2.596 -14.669  -4.025
  504   1HG   GLU  64          HG2       GLU  64   1.795 -15.086  -1.740
  505   2HG   GLU  64          HG1       GLU  64   0.573 -13.828  -1.927
  506    H    GLU  65           HN       GLU  65   2.287 -11.607  -5.042
  507    HA   GLU  65           HA       GLU  65   4.409 -12.031  -6.740
  508   1HB   GLU  65          HB2       GLU  65   3.136  -9.314  -6.449
  509   2HB   GLU  65          HB1       GLU  65   3.806 -10.030  -7.912
  510   1HG   GLU  65          HG2       GLU  65   2.066 -11.867  -7.667
  511   2HG   GLU  65          HG1       GLU  65   1.318 -10.876  -6.414
  512    H    VAL  66           HN       VAL  66   4.537 -10.392  -3.813
  513    HA   VAL  66           HA       VAL  66   7.411  -9.777  -4.247
  514    HB   VAL  66           HB       VAL  66   5.846  -7.790  -4.827
  515   1HG1  VAL  66          HG11      VAL  66   4.906  -6.546  -3.060
  516   2HG1  VAL  66          HG12      VAL  66   5.800  -7.455  -1.841
  517   3HG1  VAL  66          HG13      VAL  66   4.493  -8.225  -2.725
  518   1HG2  VAL  66          HG21      VAL  66   7.425  -6.226  -3.378
  519   2HG2  VAL  66          HG22      VAL  66   8.097  -7.192  -4.686
  520   3HG2  VAL  66          HG23      VAL  66   8.246  -7.744  -3.018
  521    H    SER  67           HN       SER  67   8.498  -9.330  -2.136
  522    HA   SER  67           HA       SER  67   7.121 -10.751   0.101
  523   1HB   SER  67          HB2       SER  67  10.047  -9.997  -0.019
  524   2HB   SER  67          HB1       SER  67   9.287 -11.237   0.970
  525    HG   SER  67           HG       SER  67   8.650 -12.103  -1.236
  526    HA   PRO  68           HA       PRO  68   6.515  -6.904   2.206
  527   1HB   PRO  68          HB2       PRO  68   7.441  -7.831   4.793
  528   2HB   PRO  68          HB1       PRO  68   5.770  -7.590   4.257
  529   1HG   PRO  68          HG2       PRO  68   7.193 -10.106   4.620
  530   2HG   PRO  68          HG1       PRO  68   5.492  -9.862   4.196
  531   1HD   PRO  68          HD2       PRO  68   7.550 -10.814   2.468
  532   2HD   PRO  68          HD1       PRO  68   5.900 -10.357   2.005
  533    H    GLU  69           HN       GLU  69   9.563  -8.582   2.259
  534    HA   GLU  69           HA       GLU  69  11.022  -6.309   3.413
  535   1HB   GLU  69          HB2       GLU  69  11.792  -8.631   3.809
  536   2HB   GLU  69          HB1       GLU  69  12.077  -8.830   2.083
  537   1HG   GLU  69          HG2       GLU  69  13.368  -6.566   3.610
  538   2HG   GLU  69          HG1       GLU  69  14.091  -8.173   3.593
  539    H    LEU  70           HN       LEU  70  10.858  -7.858   0.171
  540    HA   LEU  70           HA       LEU  70  12.535  -5.924  -1.102
  541   1HB   LEU  70          HB2       LEU  70  12.102  -7.879  -2.369
  542   2HB   LEU  70          HB1       LEU  70  10.374  -7.802  -2.065
  543    HG   LEU  70           HG       LEU  70  10.220  -5.784  -3.542
  544   1HD1  LEU  70          HD11      LEU  70  13.147  -6.381  -4.104
  545   2HD1  LEU  70          HD12      LEU  70  12.558  -4.982  -3.214
  546   3HD1  LEU  70          HD13      LEU  70  12.162  -5.167  -4.918
  547   1HD2  LEU  70          HD21      LEU  70  11.681  -7.944  -5.065
  548   2HD2  LEU  70          HD22      LEU  70  10.270  -7.003  -5.550
  549   3HD2  LEU  70          HD23      LEU  70  10.107  -8.275  -4.338
  550    H    VAL  71           HN       VAL  71   9.427  -5.728   0.249
  551    HA   VAL  71           HA       VAL  71   8.378  -3.633  -1.455
  552    HB   VAL  71           HB       VAL  71   7.623  -4.680   1.277
  553   1HG1  VAL  71          HG11      VAL  71   6.452  -2.428  -0.352
  554   2HG1  VAL  71          HG12      VAL  71   6.832  -2.467   1.371
  555   3HG1  VAL  71          HG13      VAL  71   5.449  -3.367   0.755
  556   1HG2  VAL  71          HG21      VAL  71   7.332  -5.953  -1.016
  557   2HG2  VAL  71          HG22      VAL  71   5.986  -4.837  -1.247
  558   3HG2  VAL  71          HG23      VAL  71   6.000  -5.925   0.141
  559    H    CYS  72           HN       CYS  72   9.327  -3.479   2.007
  560    HA   CYS  72           HA       CYS  72   9.481  -0.654   2.108
  561   1HB   CYS  72          HB2       CYS  72   9.740  -2.232   4.092
  562   2HB   CYS  72          HB1       CYS  72  11.428  -2.426   3.601
  563    H    SER  73           HN       SER  73  11.396  -2.837   0.372
  564    HA   SER  73           HA       SER  73  13.697  -0.982   0.105
  565   1HB   SER  73          HB2       SER  73  13.939  -3.533   0.192
  566   2HB   SER  73          HB1       SER  73  13.186  -3.567  -1.401
  567    HG   SER  73           HG       SER  73  15.645  -2.437  -0.594
  568    H    MET  74           HN       MET  74  11.418  -2.673  -2.059
  569    HA   MET  74           HA       MET  74  11.856  -1.162  -4.392
  570   1HB   MET  74          HB2       MET  74  10.373  -3.214  -4.136
  571   2HB   MET  74          HB1       MET  74   9.148  -2.146  -3.451
  572   1HG   MET  74          HG2       MET  74   8.845  -1.000  -5.484
  573   2HG   MET  74          HG1       MET  74  10.385  -1.559  -6.134
  574   1HE   MET  74          HE1       MET  74   8.291  -4.210  -4.140
  575   2HE   MET  74          HE2       MET  74   6.920  -4.450  -5.219
  576   3HE   MET  74          HE3       MET  74   7.181  -2.874  -4.478
  577    H    LEU  75           HN       LEU  75   9.643  -0.514  -1.661
  578    HA   LEU  75           HA       LEU  75   8.524   1.900  -2.695
  579   1HB   LEU  75          HB2       LEU  75   9.088   1.141   0.191
  580   2HB   LEU  75          HB1       LEU  75   8.031   2.453  -0.322
  581    HG   LEU  75           HG       LEU  75   7.622  -0.451  -1.097
  582   1HD1  LEU  75          HD11      LEU  75   7.372  -0.205   1.323
  583   2HD1  LEU  75          HD12      LEU  75   5.781  -0.392   0.589
  584   3HD1  LEU  75          HD13      LEU  75   6.335   1.203   1.097
  585   1HD2  LEU  75          HD21      LEU  75   6.070   2.110  -1.509
  586   2HD2  LEU  75          HD22      LEU  75   5.230   0.560  -1.461
  587   3HD2  LEU  75          HD23      LEU  75   6.463   0.853  -2.683
  588    H    HIS  76           HN       HIS  76  11.596   1.168  -1.197
  589    HA   HIS  76           HA       HIS  76  13.411   2.543  -0.622
  590   1HB   HIS  76          HB2       HIS  76  12.386   3.340  -3.321
  591   2HB   HIS  76          HB1       HIS  76  13.641   4.357  -2.610
  592    HD1  HIS  76           HD1      HIS  76  15.840   2.941  -1.747
  593    HD2  HIS  76           HD2      HIS  76  13.380   1.074  -4.548
  594    HE1  HIS  76           HE1      HIS  76  17.205   1.064  -2.760
  595    H    LEU  77           HN       LEU  77  11.458   3.283   1.052
  596    HA   LEU  77           HA       LEU  77  10.945   6.185   0.765
  597   1HB   LEU  77          HB2       LEU  77   9.456   5.975   2.594
  598   2HB   LEU  77          HB1       LEU  77   9.246   4.491   1.673
  599    HG   LEU  77           HG       LEU  77  11.243   3.706   3.390
  600   1HD1  LEU  77          HD11      LEU  77   9.516   5.696   4.906
  601   2HD1  LEU  77          HD12      LEU  77  11.264   5.775   4.690
  602   3HD1  LEU  77          HD13      LEU  77  10.555   4.495   5.669
  603   1HD2  LEU  77          HD21      LEU  77   8.237   3.621   3.714
  604   2HD2  LEU  77          HD22      LEU  77   9.317   2.771   4.819
  605   3HD2  LEU  77          HD23      LEU  77   9.304   2.356   3.105
  606    H    CYS  78           HN       CYS  78  13.097   3.999   2.406
  607    HA   CYS  78           HA       CYS  78  13.996   5.560   4.570
  608   1HB   CYS  78          HB2       CYS  78  15.581   3.753   2.717
  609   2HB   CYS  78          HB1       CYS  78  16.198   4.400   4.238
  610    H    SER  79           HN       SER  79  14.211   6.191   1.213
  611    HA   SER  79           HA       SER  79  16.602   7.662   0.981
  612   1HB   SER  79          HB2       SER  79  13.910   8.061  -0.338
  613   2HB   SER  79          HB1       SER  79  15.348   8.969  -0.794
  614    HG   SER  79           HG       SER  79  14.782   6.854  -1.904
  615    H    GLY  80           HN       GLY  80  17.190   9.139   2.510
  616   1HA   GLY  80          HA2       GLY  80  15.190  10.977   3.677
  617   2HA   GLY  80          HA1       GLY  80  16.892  10.865   4.131
  618    H    LEU  81           HN       LEU  81  17.478  10.870   1.154
  619    HA   LEU  81           HA       LEU  81  17.140  13.778   0.610
  620   1HB   LEU  81          HB2       LEU  81  19.418  13.487  -0.608
  621   2HB   LEU  81          HB1       LEU  81  19.434  13.643   1.142
  622    HG   LEU  81           HG       LEU  81  20.913  11.813   0.247
  623   1HD1  LEU  81          HD11      LEU  81  20.665  10.665   2.176
  624   2HD1  LEU  81          HD12      LEU  81  18.992  10.237   1.841
  625   3HD1  LEU  81          HD13      LEU  81  19.376  11.804   2.547
  626   1HD2  LEU  81          HD21      LEU  81  20.014   9.833  -0.725
  627   2HD2  LEU  81          HD22      LEU  81  19.229  11.156  -1.578
  628   3HD2  LEU  81          HD23      LEU  81  18.361  10.281  -0.318
  629    H    VAL  82           HN       VAL  82  17.990  13.945  -1.906
  630    HA   VAL  82           HA       VAL  82  16.033  12.311  -3.314
  631    HB   VAL  82           HB       VAL  82  17.099  13.525  -5.374
  632   1HG1  VAL  82          HG11      VAL  82  14.891  14.052  -4.387
  633   2HG1  VAL  82          HG12      VAL  82  15.729  15.510  -4.921
  634   3HG1  VAL  82          HG13      VAL  82  15.677  15.102  -3.206
  635   1HG2  VAL  82          HG21      VAL  82  18.338  15.530  -4.842
  636   2HG2  VAL  82          HG22      VAL  82  19.127  14.194  -4.003
  637   3HG2  VAL  82          HG23      VAL  82  18.078  15.297  -3.113
  638    HA   PRO  83           HA       PRO  83  18.818   8.918  -3.910
  639   1HB   PRO  83          HB2       PRO  83  17.700   8.603  -6.640
  640   2HB   PRO  83          HB1       PRO  83  17.747   7.445  -5.300
  641   1HG   PRO  83          HG2       PRO  83  15.469   8.869  -6.102
  642   2HG   PRO  83          HG1       PRO  83  15.688   8.083  -4.531
  643   1HD   PRO  83          HD2       PRO  83  15.626  10.957  -5.125
  644   2HD   PRO  83          HD1       PRO  83  15.621  10.134  -3.543
  645    H    ARG  84           HN       ARG  84  20.956   9.237  -4.415
  646    HA   ARG  84           HA       ARG  84  21.727  11.256  -6.394
  647   1HB   ARG  84          HB2       ARG  84  23.452   9.331  -4.804
  648   2HB   ARG  84          HB1       ARG  84  24.024  10.741  -5.690
  649   1HG   ARG  84          HG2       ARG  84  21.920  11.043  -3.545
  650   2HG   ARG  84          HG1       ARG  84  23.624  10.950  -3.112
  651   1HD   ARG  84          HD2       ARG  84  22.359  12.981  -4.979
  652   2HD   ARG  84          HD1       ARG  84  22.980  13.290  -3.359
  653    HE   ARG  84           HE       ARG  84  25.160  12.239  -4.694
  654   1HH1  ARG  84          HH21      ARG  84  22.888  14.776  -5.234
  655   2HH1  ARG  84          HH22      ARG  84  24.004  15.768  -6.111
  656   1HH2  ARG  84          HH11      ARG  84  26.629  13.519  -5.838
  657   2HH2  ARG  84          HH12      ARG  84  26.123  15.057  -6.453
  Start of MODEL   15
    1   1H    SER   1           HT1      SER   1  22.255   2.669  12.724
    2   2H    SER   1           HT2      SER   1  23.421   3.838  12.320
    3   3H    SER   1           HT3      SER   1  23.852   2.496  13.269
    4    HA   SER   1           HA       SER   1  23.716   2.745  10.424
    5   1HB   SER   1          HB2       SER   1  24.784   0.622  12.308
    6   2HB   SER   1          HB1       SER   1  25.123   0.712  10.582
    7    HG   SER   1           HG       SER   1  26.546   1.797  12.364
    8    H    ASP   2           HN       ASP   2  22.104   1.938   9.182
    9    HA   ASP   2           HA       ASP   2  20.257   0.643   8.531
   10   1HB   ASP   2          HB2       ASP   2  21.721  -1.490  10.113
   11   2HB   ASP   2          HB1       ASP   2  20.524  -1.765   8.847
   12    H    VAL   3           HN       VAL   3  19.317   2.175  10.393
   13    HA   VAL   3           HA       VAL   3  18.311   0.606  12.690
   14    HB   VAL   3           HB       VAL   3  17.914   3.507  12.018
   15   1HG1  VAL   3          HG11      VAL   3  17.495   1.932  14.569
   16   2HG1  VAL   3          HG12      VAL   3  16.227   2.630  13.562
   17   3HG1  VAL   3          HG13      VAL   3  17.344   3.683  14.430
   18   1HG2  VAL   3          HG21      VAL   3  19.682   3.894  13.726
   19   2HG2  VAL   3          HG22      VAL   3  20.291   3.005  12.328
   20   3HG2  VAL   3          HG23      VAL   3  19.928   2.150  13.827
   21    H    TYR   4           HN       TYR   4  16.899   2.790  10.233
   22    HA   TYR   4           HA       TYR   4  14.214   1.835  10.741
   23   1HB   TYR   4          HB2       TYR   4  15.526   3.676   8.773
   24   2HB   TYR   4          HB1       TYR   4  13.932   3.051   8.355
   25    HD1  TYR   4           HD1      TYR   4  12.630   5.032   8.587
   26    HD2  TYR   4           HD2      TYR   4  15.170   3.747  11.805
   27    HE1  TYR   4           HE1      TYR   4  11.571   6.692  10.088
   28    HE2  TYR   4           HE2      TYR   4  14.117   5.404  13.304
   29    HH   TYR   4           HH       TYR   4  12.879   7.632  13.004
   30    H    CYS   5           HN       CYS   5  16.746   0.934   8.449
   31    HA   CYS   5           HA       CYS   5  15.157  -0.530   6.617
   32   1HB   CYS   5          HB2       CYS   5  17.745  -0.060   6.624
   33   2HB   CYS   5          HB1       CYS   5  17.839  -1.599   7.482
   34    H    GLU   6           HN       GLU   6  16.513  -1.518   9.754
   35    HA   GLU   6           HA       GLU   6  15.428  -4.215   9.559
   36   1HB   GLU   6          HB2       GLU   6  16.418  -2.693  11.990
   37   2HB   GLU   6          HB1       GLU   6  16.149  -4.434  11.895
   38   1HG   GLU   6          HG2       GLU   6  18.046  -2.969  10.048
   39   2HG   GLU   6          HG1       GLU   6  18.562  -3.686  11.574
   40    H    VAL   7           HN       VAL   7  14.564  -1.311  11.468
   41    HA   VAL   7           HA       VAL   7  12.237  -2.428  12.682
   42    HB   VAL   7           HB       VAL   7  12.721   0.468  11.920
   43   1HG1  VAL   7          HG11      VAL   7  10.420   0.097  12.556
   44   2HG1  VAL   7          HG12      VAL   7  11.238   0.860  13.920
   45   3HG1  VAL   7          HG13      VAL   7  10.911  -0.873  13.945
   46   1HG2  VAL   7          HG21      VAL   7  13.301  -0.827  14.592
   47   2HG2  VAL   7          HG22      VAL   7  13.845   0.742  13.995
   48   3HG2  VAL   7          HG23      VAL   7  14.524  -0.740  13.325
   49    H    CYS   8           HN       CYS   8  12.813  -1.176   9.480
   50    HA   CYS   8           HA       CYS   8   9.978  -0.839   8.845
   51   1HB   CYS   8          HB2       CYS   8  11.662   0.533   7.715
   52   2HB   CYS   8          HB1       CYS   8  12.433  -0.915   7.072
   53    H    GLU   9           HN       GLU   9  12.330  -3.413   8.690
   54    HA   GLU   9           HA       GLU   9  10.572  -5.030   6.902
   55   1HB   GLU   9          HB2       GLU   9  13.232  -5.801   8.179
   56   2HB   GLU   9          HB1       GLU   9  12.314  -6.772   7.032
   57   1HG   GLU   9          HG2       GLU   9  12.686  -5.288   5.251
   58   2HG   GLU   9          HG1       GLU   9  13.118  -3.955   6.317
   59    H    PHE  10           HN       PHE  10  11.302  -4.655  10.283
   60    HA   PHE  10           HA       PHE  10  10.241  -7.251  11.073
   61   1HB   PHE  10          HB2       PHE  10  11.815  -6.114  12.542
   62   2HB   PHE  10          HB1       PHE  10  10.754  -4.711  12.652
   63    HD1  PHE  10           HD1      PHE  10   9.159  -4.591  14.380
   64    HD2  PHE  10           HD2      PHE  10  10.802  -8.406  13.280
   65    HE1  PHE  10           HE1      PHE  10   7.966  -5.652  16.277
   66    HE2  PHE  10           HE2      PHE  10   9.608  -9.466  15.177
   67    HZ   PHE  10           HZ       PHE  10   8.190  -8.089  16.676
   68    H    LEU  11           HN       LEU  11   8.959  -3.937  10.906
   69    HA   LEU  11           HA       LEU  11   6.340  -4.775  11.921
   70   1HB   LEU  11          HB2       LEU  11   7.197  -2.186  10.594
   71   2HB   LEU  11          HB1       LEU  11   5.681  -2.449  11.450
   72    HG   LEU  11           HG       LEU  11   8.363  -2.892  12.778
   73   1HD1  LEU  11          HD11      LEU  11   8.253  -0.564  11.941
   74   2HD1  LEU  11          HD12      LEU  11   8.179  -0.624  13.703
   75   3HD1  LEU  11          HD13      LEU  11   6.709  -0.350  12.766
   76   1HD2  LEU  11          HD21      LEU  11   6.896  -2.323  14.814
   77   2HD2  LEU  11          HD22      LEU  11   6.583  -3.872  14.035
   78   3HD2  LEU  11          HD23      LEU  11   5.512  -2.504  13.738
   79    H    VAL  12           HN       VAL  12   7.578  -3.597   8.775
   80    HA   VAL  12           HA       VAL  12   5.167  -3.926   7.334
   81    HB   VAL  12           HB       VAL  12   7.994  -4.313   6.309
   82   1HG1  VAL  12          HG11      VAL  12   6.488  -5.115   4.652
   83   2HG1  VAL  12          HG12      VAL  12   6.864  -3.462   4.171
   84   3HG1  VAL  12          HG13      VAL  12   5.332  -3.822   4.967
   85   1HG2  VAL  12          HG21      VAL  12   8.058  -1.970   5.917
   86   2HG2  VAL  12          HG22      VAL  12   7.379  -2.111   7.537
   87   3HG2  VAL  12          HG23      VAL  12   6.321  -1.796   6.163
   88    H    LYS  13           HN       LYS  13   7.426  -6.314   8.504
   89    HA   LYS  13           HA       LYS  13   6.378  -8.438   6.741
   90   1HB   LYS  13          HB2       LYS  13   8.734  -8.416   7.351
   91   2HB   LYS  13          HB1       LYS  13   8.309  -8.520   9.056
   92   1HG   LYS  13          HG2       LYS  13   6.943 -10.690   7.780
   93   2HG   LYS  13          HG1       LYS  13   8.561 -10.675   7.095
   94   1HD   LYS  13          HD2       LYS  13   8.760 -12.053   8.999
   95   2HD   LYS  13          HD1       LYS  13   9.398 -10.501   9.536
   96   1HE   LYS  13          HE2       LYS  13   7.276  -9.945  10.600
   97   2HE   LYS  13          HE1       LYS  13   6.538 -11.415   9.965
   98   1HZ   LYS  13          HZ1       LYS  13   8.918 -11.438  11.728
   99   2HZ   LYS  13          HZ2       LYS  13   7.929 -12.750  11.296
  100   3HZ   LYS  13          HZ3       LYS  13   7.332 -11.533  12.321
  101    H    GLU  14           HN       GLU  14   6.337  -7.653  10.240
  102    HA   GLU  14           HA       GLU  14   4.662  -9.847  11.000
  103   1HB   GLU  14          HB2       GLU  14   5.999  -8.292  12.538
  104   2HB   GLU  14          HB1       GLU  14   4.692  -7.127  12.336
  105   1HG   GLU  14          HG2       GLU  14   4.223  -9.968  13.279
  106   2HG   GLU  14          HG1       GLU  14   4.503  -8.623  14.384
  107    H    VAL  15           HN       VAL  15   3.878  -6.473  10.157
  108    HA   VAL  15           HA       VAL  15   1.067  -6.702  10.465
  109    HB   VAL  15           HB       VAL  15   2.441  -4.578  10.012
  110   1HG1  VAL  15          HG11      VAL  15   3.501  -5.567   7.921
  111   2HG1  VAL  15          HG12      VAL  15   2.845  -3.940   7.740
  112   3HG1  VAL  15          HG13      VAL  15   1.948  -5.326   7.120
  113   1HG2  VAL  15          HG21      VAL  15   0.491  -3.619   8.575
  114   2HG2  VAL  15          HG22      VAL  15   0.107  -4.297  10.156
  115   3HG2  VAL  15          HG23      VAL  15  -0.193  -5.241   8.700
  116    H    THR  16           HN       THR  16   3.128  -7.295   7.613
  117    HA   THR  16           HA       THR  16   1.147  -8.019   5.766
  118    HB   THR  16           HB       THR  16   3.241  -9.861   5.328
  119    HG1  THR  16           HG1      THR  16   4.526  -9.169   6.856
  120   1HG2  THR  16          HG21      THR  16   2.427  -8.483   3.562
  121   2HG2  THR  16          HG22      THR  16   4.114  -7.995   3.825
  122   3HG2  THR  16          HG23      THR  16   2.798  -7.002   4.460
  123    H    LYS  17           HN       LYS  17   2.816 -10.150   8.122
  124    HA   LYS  17           HA       LYS  17   1.633 -12.585   7.570
  125   1HB   LYS  17          HB2       LYS  17   2.284 -11.310  10.230
  126   2HB   LYS  17          HB1       LYS  17   1.678 -12.958  10.124
  127   1HG   LYS  17          HG2       LYS  17   4.018 -12.135   8.410
  128   2HG   LYS  17          HG1       LYS  17   4.286 -12.499  10.113
  129   1HD   LYS  17          HD2       LYS  17   3.180 -14.715   9.778
  130   2HD   LYS  17          HD1       LYS  17   3.051 -14.357   8.056
  131   1HE   LYS  17          HE2       LYS  17   5.532 -14.068   7.974
  132   2HE   LYS  17          HE1       LYS  17   5.612 -14.568   9.663
  133   1HZ   LYS  17          HZ1       LYS  17   6.017 -16.437   8.217
  134   2HZ   LYS  17          HZ2       LYS  17   4.547 -16.179   7.405
  135   3HZ   LYS  17          HZ3       LYS  17   4.547 -16.661   9.034
  136    H    LEU  18           HN       LEU  18   0.135  -9.856   9.288
  137    HA   LEU  18           HA       LEU  18  -2.391 -11.402   9.554
  138   1HB   LEU  18          HB2       LEU  18  -2.817 -10.029  11.322
  139   2HB   LEU  18          HB1       LEU  18  -1.150  -9.501  11.154
  140    HG   LEU  18           HG       LEU  18  -2.005  -7.717   9.543
  141   1HD1  LEU  18          HD11      LEU  18  -4.694  -7.619  10.639
  142   2HD1  LEU  18          HD12      LEU  18  -4.442  -9.180   9.857
  143   3HD1  LEU  18          HD13      LEU  18  -4.188  -7.690   8.953
  144   1HD2  LEU  18          HD21      LEU  18  -1.371  -7.285  11.891
  145   2HD2  LEU  18          HD22      LEU  18  -3.018  -7.659  12.400
  146   3HD2  LEU  18          HD23      LEU  18  -2.707  -6.252  11.382
  147    H    ILE  19           HN       ILE  19  -1.138  -8.542   7.863
  148    HA   ILE  19           HA       ILE  19  -3.582  -7.867   6.520
  149    HB   ILE  19           HB       ILE  19  -0.744  -7.129   6.508
  150   1HG1  ILE  19          HG12      ILE  19  -3.123  -5.438   5.758
  151   2HG1  ILE  19          HG11      ILE  19  -2.665  -5.779   7.428
  152   1HG2  ILE  19          HG21      ILE  19  -2.256  -6.952   3.902
  153   2HG2  ILE  19          HG22      ILE  19  -0.706  -7.743   4.194
  154   3HG2  ILE  19          HG23      ILE  19  -0.826  -5.989   4.265
  155   1HD1  ILE  19          HD11      ILE  19  -1.392  -3.899   7.208
  156   2HD1  ILE  19          HD12      ILE  19  -1.386  -3.993   5.450
  157   3HD1  ILE  19          HD13      ILE  19  -0.248  -4.967   6.385
  158    H    ASP  20           HN       ASP  20  -1.241 -10.346   6.061
  159    HA   ASP  20           HA       ASP  20  -1.020 -10.929   3.431
  160   1HB   ASP  20          HB2       ASP  20  -0.276 -12.433   5.264
  161   2HB   ASP  20          HB1       ASP  20  -1.942 -12.968   5.485
  162    H    ASN  21           HN       ASN  21  -4.010 -11.581   5.310
  163    HA   ASN  21           HA       ASN  21  -5.621 -11.213   2.899
  164   1HB   ASN  21          HB2       ASN  21  -5.373 -13.937   4.197
  165   2HB   ASN  21          HB1       ASN  21  -6.703 -13.491   3.125
  166   1HD2  ASN  21          HD21      ASN  21  -5.919 -12.563   0.900
  167   2HD2  ASN  21          HD22      ASN  21  -4.570 -13.320   0.203
  168    H    ASN  22           HN       ASN  22  -5.558  -9.896   5.463
  169    HA   ASN  22           HA       ASN  22  -7.814 -10.952   7.023
  170   1HB   ASN  22          HB2       ASN  22  -7.491  -8.996   8.450
  171   2HB   ASN  22          HB1       ASN  22  -5.937  -9.759   8.134
  172   1HD2  ASN  22          HD21      ASN  22  -5.970  -8.640   5.282
  173   2HD2  ASN  22          HD22      ASN  22  -5.552  -7.006   5.467
  174    H    LYS  23           HN       LYS  23  -7.231  -8.371   4.689
  175    HA   LYS  23           HA       LYS  23 -10.193  -7.914   4.542
  176   1HB   LYS  23          HB2       LYS  23  -9.814  -5.551   4.226
  177   2HB   LYS  23          HB1       LYS  23  -9.001  -6.049   5.706
  178   1HG   LYS  23          HG2       LYS  23  -7.208  -4.935   4.793
  179   2HG   LYS  23          HG1       LYS  23  -6.972  -6.447   3.921
  180   1HD   LYS  23          HD2       LYS  23  -8.666  -5.346   2.193
  181   2HD   LYS  23          HD1       LYS  23  -8.134  -3.848   2.949
  182   1HE   LYS  23          HE2       LYS  23  -5.773  -4.469   2.481
  183   2HE   LYS  23          HE1       LYS  23  -6.337  -5.928   1.667
  184   1HZ   LYS  23          HZ1       LYS  23  -5.859  -3.869   0.260
  185   2HZ   LYS  23          HZ2       LYS  23  -7.324  -3.264   0.871
  186   3HZ   LYS  23          HZ3       LYS  23  -7.304  -4.706  -0.028
  187    H    THR  24           HN       THR  24 -10.988  -8.206   2.533
  188    HA   THR  24           HA       THR  24  -9.102  -8.733   0.327
  189    HB   THR  24           HB       THR  24 -11.270  -9.259  -0.914
  190    HG1  THR  24           HG1      THR  24 -12.195  -8.478   1.606
  191   1HG2  THR  24          HG21      THR  24 -11.575 -11.385   0.286
  192   2HG2  THR  24          HG22      THR  24 -10.723 -10.727   1.683
  193   3HG2  THR  24          HG23      THR  24  -9.861 -10.984   0.167
  194    H    GLU  25           HN       GLU  25 -10.433  -7.851  -1.895
  195    HA   GLU  25           HA       GLU  25 -10.029  -4.930  -1.696
  196   1HB   GLU  25          HB2       GLU  25 -10.739  -6.468  -4.196
  197   2HB   GLU  25          HB1       GLU  25  -9.878  -4.935  -4.058
  198   1HG   GLU  25          HG2       GLU  25  -8.165  -6.514  -4.482
  199   2HG   GLU  25          HG1       GLU  25  -8.097  -6.274  -2.736
  200    H    LYS  26           HN       LYS  26 -12.586  -6.649  -0.889
  201    HA   LYS  26           HA       LYS  26 -14.623  -5.315  -2.549
  202   1HB   LYS  26          HB2       LYS  26 -15.225  -6.867  -0.032
  203   2HB   LYS  26          HB1       LYS  26 -16.173  -6.739  -1.515
  204   1HG   LYS  26          HG2       LYS  26 -13.559  -8.227  -1.177
  205   2HG   LYS  26          HG1       LYS  26 -15.155  -8.938  -1.405
  206   1HD   LYS  26          HD2       LYS  26 -15.296  -7.669  -3.599
  207   2HD   LYS  26          HD1       LYS  26 -13.588  -7.273  -3.389
  208   1HE   LYS  26          HE2       LYS  26 -12.993  -9.615  -3.345
  209   2HE   LYS  26          HE1       LYS  26 -14.692 -10.085  -3.380
  210   1HZ   LYS  26          HZ1       LYS  26 -14.918  -9.464  -5.562
  211   2HZ   LYS  26          HZ2       LYS  26 -13.318 -10.035  -5.564
  212   3HZ   LYS  26          HZ3       LYS  26 -13.628  -8.365  -5.510
  213    H    GLU  27           HN       GLU  27 -13.376  -5.238   0.764
  214    HA   GLU  27           HA       GLU  27 -15.162  -3.106   1.582
  215   1HB   GLU  27          HB2       GLU  27 -12.574  -4.086   2.823
  216   2HB   GLU  27          HB1       GLU  27 -13.726  -2.997   3.595
  217   1HG   GLU  27          HG2       GLU  27 -14.424  -5.783   2.625
  218   2HG   GLU  27          HG1       GLU  27 -13.989  -5.399   4.290
  219    H    ILE  28           HN       ILE  28 -12.339  -3.274  -0.298
  220    HA   ILE  28           HA       ILE  28 -11.368  -0.587   0.360
  221    HB   ILE  28           HB       ILE  28 -10.598  -2.573  -1.785
  222   1HG1  ILE  28          HG12      ILE  28 -10.092  -3.365   0.472
  223   2HG1  ILE  28          HG11      ILE  28  -8.608  -2.937  -0.364
  224   1HG2  ILE  28          HG21      ILE  28  -8.509  -1.077  -1.841
  225   2HG2  ILE  28          HG22      ILE  28  -9.502   0.126  -1.022
  226   3HG2  ILE  28          HG23      ILE  28  -9.964  -0.461  -2.619
  227   1HD1  ILE  28          HD11      ILE  28  -8.231  -1.895   1.658
  228   2HD1  ILE  28          HD12      ILE  28  -9.944  -1.586   1.937
  229   3HD1  ILE  28          HD13      ILE  28  -9.038  -0.578   0.813
  230    H    LEU  29           HN       LEU  29 -12.136  -1.952  -2.889
  231    HA   LEU  29           HA       LEU  29 -12.651   0.462  -4.151
  232   1HB   LEU  29          HB2       LEU  29 -13.701  -2.326  -4.547
  233   2HB   LEU  29          HB1       LEU  29 -14.475  -1.027  -5.449
  234    HG   LEU  29           HG       LEU  29 -12.150  -0.330  -6.209
  235   1HD1  LEU  29          HD11      LEU  29 -10.739  -1.387  -4.627
  236   2HD1  LEU  29          HD12      LEU  29 -10.474  -2.237  -6.148
  237   3HD1  LEU  29          HD13      LEU  29 -11.487  -2.962  -4.901
  238   1HD2  LEU  29          HD21      LEU  29 -12.086  -1.964  -7.991
  239   2HD2  LEU  29          HD22      LEU  29 -13.777  -1.667  -7.589
  240   3HD2  LEU  29          HD23      LEU  29 -12.978  -3.129  -7.010
  241    H    ASP  30           HN       ASP  30 -14.655  -1.211  -1.828
  242    HA   ASP  30           HA       ASP  30 -17.047   0.362  -2.342
  243   1HB   ASP  30          HB2       ASP  30 -16.117  -1.239   0.064
  244   2HB   ASP  30          HB1       ASP  30 -17.682  -0.429  -0.013
  245    H    ALA  31           HN       ALA  31 -14.441   0.470   0.089
  246    HA   ALA  31           HA       ALA  31 -15.159   2.777   1.492
  247   1HB   ALA  31          HB1       ALA  31 -13.142   1.334   1.928
  248   2HB   ALA  31          HB2       ALA  31 -12.835   3.070   2.013
  249   3HB   ALA  31          HB3       ALA  31 -12.346   2.153   0.583
  250    H    PHE  32           HN       PHE  32 -13.200   2.628  -1.503
  251    HA   PHE  32           HA       PHE  32 -12.882   5.384  -1.900
  252   1HB   PHE  32          HB2       PHE  32 -13.218   3.089  -3.842
  253   2HB   PHE  32          HB1       PHE  32 -13.051   4.743  -4.429
  254    HD1  PHE  32           HD1      PHE  32 -10.994   6.054  -3.926
  255    HD2  PHE  32           HD2      PHE  32 -11.346   1.901  -2.873
  256    HE1  PHE  32           HE1      PHE  32  -8.539   5.922  -3.618
  257    HE2  PHE  32           HE2      PHE  32  -8.891   1.774  -2.568
  258    HZ   PHE  32           HZ       PHE  32  -7.489   3.782  -2.940
  259    H    ASP  33           HN       ASP  33 -15.734   3.363  -2.666
  260    HA   ASP  33           HA       ASP  33 -17.214   5.455  -3.938
  261   1HB   ASP  33          HB2       ASP  33 -18.368   3.204  -2.264
  262   2HB   ASP  33          HB1       ASP  33 -19.167   4.080  -3.569
  263    H    LYS  34           HN       LYS  34 -16.138   5.092  -0.764
  264    HA   LYS  34           HA       LYS  34 -18.301   6.831   0.360
  265   1HB   LYS  34          HB2       LYS  34 -16.048   5.434   1.843
  266   2HB   LYS  34          HB1       LYS  34 -17.495   6.169   2.540
  267   1HG   LYS  34          HG2       LYS  34 -18.917   4.523   1.433
  268   2HG   LYS  34          HG1       LYS  34 -17.519   3.831   0.615
  269   1HD   LYS  34          HD2       LYS  34 -16.610   3.569   3.120
  270   2HD   LYS  34          HD1       LYS  34 -18.327   3.629   3.505
  271   1HE   LYS  34          HE2       LYS  34 -17.183   1.732   1.435
  272   2HE   LYS  34          HE1       LYS  34 -17.370   1.304   3.131
  273   1HZ   LYS  34          HZ1       LYS  34 -19.266   0.670   1.663
  274   2HZ   LYS  34          HZ2       LYS  34 -19.595   2.325   1.460
  275   3HZ   LYS  34          HZ3       LYS  34 -19.696   1.618   3.002
  276    H    MET  35           HN       MET  35 -14.739   6.627   0.891
  277    HA   MET  35           HA       MET  35 -14.568   9.388   1.664
  278   1HB   MET  35          HB2       MET  35 -12.213   7.950   0.443
  279   2HB   MET  35          HB1       MET  35 -12.226   9.149   1.723
  280   1HG   MET  35          HG2       MET  35 -12.726   7.600   3.368
  281   2HG   MET  35          HG1       MET  35 -13.643   6.568   2.279
  282   1HE   MET  35          HE1       MET  35 -12.797   5.672   0.325
  283   2HE   MET  35          HE2       MET  35 -11.619   4.381   0.502
  284   3HE   MET  35          HE3       MET  35 -11.146   5.905  -0.249
  285    H    CYS  36           HN       CYS  36 -13.775   7.756  -1.415
  286    HA   CYS  36           HA       CYS  36 -13.146  10.261  -2.734
  287   1HB   CYS  36          HB2       CYS  36 -12.391   7.851  -3.365
  288   2HB   CYS  36          HB1       CYS  36 -13.959   7.732  -4.166
  289    H    SER  37           HN       SER  37 -15.885   9.605  -1.395
  290    HA   SER  37           HA       SER  37 -17.763   9.963  -3.625
  291   1HB   SER  37          HB2       SER  37 -18.217   8.656  -1.454
  292   2HB   SER  37          HB1       SER  37 -18.395  10.225  -0.680
  293    HG   SER  37           HG       SER  37 -20.394   9.837  -1.378
  294    H    LYS  38           HN       LYS  38 -16.563  11.829  -0.847
  295    HA   LYS  38           HA       LYS  38 -18.025  14.237  -1.586
  296   1HB   LYS  38          HB2       LYS  38 -16.714  15.278   0.236
  297   2HB   LYS  38          HB1       LYS  38 -17.428  13.751   0.759
  298   1HG   LYS  38          HG2       LYS  38 -15.154  12.707  -0.026
  299   2HG   LYS  38          HG1       LYS  38 -14.551  14.358   0.089
  300   1HD   LYS  38          HD2       LYS  38 -15.446  14.421   2.454
  301   2HD   LYS  38          HD1       LYS  38 -15.778  12.694   2.302
  302   1HE   LYS  38          HE2       LYS  38 -13.433  12.218   1.908
  303   2HE   LYS  38          HE1       LYS  38 -13.050  13.938   1.858
  304   1HZ   LYS  38          HZ1       LYS  38 -14.278  13.736   4.223
  305   2HZ   LYS  38          HZ2       LYS  38 -12.595  13.627   4.016
  306   3HZ   LYS  38          HZ3       LYS  38 -13.532  12.215   4.133
  307    H    LEU  39           HN       LEU  39 -15.075  12.793  -2.584
  308    HA   LEU  39           HA       LEU  39 -13.450  15.008  -3.119
  309   1HB   LEU  39          HB2       LEU  39 -13.529  12.246  -3.949
  310   2HB   LEU  39          HB1       LEU  39 -13.303  13.204  -5.397
  311    HG   LEU  39           HG       LEU  39 -11.462  14.384  -3.697
  312   1HD1  LEU  39          HD11      LEU  39 -11.164  11.435  -3.165
  313   2HD1  LEU  39          HD12      LEU  39 -12.064  12.473  -2.058
  314   3HD1  LEU  39          HD13      LEU  39 -10.357  12.789  -2.372
  315   1HD2  LEU  39          HD21      LEU  39 -11.008  11.983  -5.487
  316   2HD2  LEU  39          HD22      LEU  39  -9.775  13.133  -4.964
  317   3HD2  LEU  39          HD23      LEU  39 -11.089  13.664  -6.007
  318    HA   PRO  40           HA       PRO  40 -15.894  17.359  -6.030
  319   1HB   PRO  40          HB2       PRO  40 -13.549  18.135  -7.586
  320   2HB   PRO  40          HB1       PRO  40 -14.521  19.137  -6.503
  321   1HG   PRO  40          HG2       PRO  40 -11.877  18.086  -6.019
  322   2HG   PRO  40          HG1       PRO  40 -12.866  19.062  -4.923
  323   1HD   PRO  40          HD2       PRO  40 -12.240  16.270  -4.678
  324   2HD   PRO  40          HD1       PRO  40 -13.295  17.230  -3.626
  325    H    LYS  41           HN       LYS  41 -16.924  16.553  -7.824
  326    HA   LYS  41           HA       LYS  41 -16.614  14.139  -9.001
  327   1HB   LYS  41          HB2       LYS  41 -18.377  15.840  -9.530
  328   2HB   LYS  41          HB1       LYS  41 -17.223  16.604 -10.622
  329   1HG   LYS  41          HG2       LYS  41 -17.069  14.619 -11.969
  330   2HG   LYS  41          HG1       LYS  41 -18.038  13.699 -10.818
  331   1HD   LYS  41          HD2       LYS  41 -20.031  14.675 -11.488
  332   2HD   LYS  41          HD1       LYS  41 -19.268  16.206 -11.911
  333   1HE   LYS  41          HE2       LYS  41 -18.330  15.227 -13.932
  334   2HE   LYS  41          HE1       LYS  41 -18.975  13.643 -13.502
  335   1HZ   LYS  41          HZ1       LYS  41 -21.206  14.959 -13.408
  336   2HZ   LYS  41          HZ2       LYS  41 -20.593  14.418 -14.899
  337   3HZ   LYS  41          HZ3       LYS  41 -20.393  16.040 -14.432
  338    H    SER  42           HN       SER  42 -14.886  17.023 -10.077
  339    HA   SER  42           HA       SER  42 -13.554  15.975 -12.319
  340   1HB   SER  42          HB2       SER  42 -12.560  17.918 -10.221
  341   2HB   SER  42          HB1       SER  42 -11.759  17.638 -11.765
  342    HG   SER  42           HG       SER  42 -14.131  18.962 -11.178
  343    H    LEU  43           HN       LEU  43 -12.113  16.274  -9.068
  344    HA   LEU  43           HA       LEU  43 -10.042  14.350  -9.748
  345   1HB   LEU  43          HB2       LEU  43 -10.825  15.655  -7.137
  346   2HB   LEU  43          HB1       LEU  43  -9.441  14.582  -7.315
  347    HG   LEU  43           HG       LEU  43  -8.703  16.887  -7.440
  348   1HD1  LEU  43          HD11      LEU  43  -7.862  14.997  -9.098
  349   2HD1  LEU  43          HD12      LEU  43  -7.301  16.661  -9.260
  350   3HD1  LEU  43          HD13      LEU  43  -8.577  16.059 -10.316
  351   1HD2  LEU  43          HD21      LEU  43  -9.612  18.518  -8.841
  352   2HD2  LEU  43          HD22      LEU  43 -11.048  17.617  -8.358
  353   3HD2  LEU  43          HD23      LEU  43 -10.313  17.332  -9.940
  354    H    SER  44           HN       SER  44 -13.261  13.924  -9.008
  355    HA   SER  44           HA       SER  44 -12.860  11.548  -7.295
  356   1HB   SER  44          HB2       SER  44 -15.124  11.669  -6.861
  357   2HB   SER  44          HB1       SER  44 -14.934  13.320  -7.438
  358    HG   SER  44           HG       SER  44 -15.330  12.303  -9.597
  359    H    GLU  45           HN       GLU  45 -13.379  12.497 -10.601
  360    HA   GLU  45           HA       GLU  45 -13.996   9.798 -11.482
  361   1HB   GLU  45          HB2       GLU  45 -14.357  10.707 -13.591
  362   2HB   GLU  45          HB1       GLU  45 -14.616  12.137 -12.596
  363   1HG   GLU  45          HG2       GLU  45 -12.072  12.560 -12.933
  364   2HG   GLU  45          HG1       GLU  45 -12.204  11.407 -14.256
  365    H    GLU  46           HN       GLU  46 -11.213  11.851 -11.074
  366    HA   GLU  46           HA       GLU  46  -9.410  10.047 -12.530
  367   1HB   GLU  46          HB2       GLU  46  -9.015  12.542 -10.871
  368   2HB   GLU  46          HB1       GLU  46  -7.644  11.586 -11.433
  369   1HG   GLU  46          HG2       GLU  46  -8.494  11.813 -13.771
  370   2HG   GLU  46          HG1       GLU  46  -9.770  12.871 -13.171
  371    H    CYS  47           HN       CYS  47 -10.588  10.446  -9.278
  372    HA   CYS  47           HA       CYS  47  -8.408   8.931  -8.045
  373   1HB   CYS  47          HB2       CYS  47  -9.288  10.229  -6.364
  374   2HB   CYS  47          HB1       CYS  47 -10.839  10.360  -7.173
  375    H    GLN  48           HN       GLN  48 -11.484   8.231  -9.534
  376    HA   GLN  48           HA       GLN  48 -11.501   5.457  -8.484
  377   1HB   GLN  48          HB2       GLN  48 -13.410   7.143 -10.111
  378   2HB   GLN  48          HB1       GLN  48 -13.579   5.386 -10.087
  379   1HG   GLN  48          HG2       GLN  48 -13.363   6.984  -7.529
  380   2HG   GLN  48          HG1       GLN  48 -14.916   6.727  -8.327
  381   1HE2  GLN  48          HE21      GLN  48 -12.242   5.064  -6.675
  382   2HE2  GLN  48          HE22      GLN  48 -13.078   3.608  -6.423
  383    H    GLU  49           HN       GLU  49 -10.512   7.367 -11.162
  384    HA   GLU  49           HA       GLU  49 -10.429   5.234 -13.100
  385   1HB   GLU  49          HB2       GLU  49 -10.466   7.636 -13.754
  386   2HB   GLU  49          HB1       GLU  49  -8.870   7.832 -13.031
  387   1HG   GLU  49          HG2       GLU  49  -7.928   6.201 -14.583
  388   2HG   GLU  49          HG1       GLU  49  -9.524   5.906 -15.273
  389    H    VAL  50           HN       VAL  50  -8.099   6.739 -10.870
  390    HA   VAL  50           HA       VAL  50  -5.911   5.070 -11.721
  391    HB   VAL  50           HB       VAL  50  -5.651   7.250 -10.451
  392   1HG1  VAL  50          HG11      VAL  50  -7.447   6.565  -8.758
  393   2HG1  VAL  50          HG12      VAL  50  -5.989   7.303  -8.098
  394   3HG1  VAL  50          HG13      VAL  50  -6.210   5.555  -8.014
  395   1HG2  VAL  50          HG21      VAL  50  -3.624   6.521  -9.443
  396   2HG2  VAL  50          HG22      VAL  50  -3.909   5.312 -10.699
  397   3HG2  VAL  50          HG23      VAL  50  -4.304   4.952  -9.017
  398    H    VAL  51           HN       VAL  51  -8.261   4.872  -9.038
  399    HA   VAL  51           HA       VAL  51  -7.310   2.640  -7.630
  400    HB   VAL  51           HB       VAL  51 -10.138   3.406  -8.451
  401   1HG1  VAL  51          HG11      VAL  51 -10.841   1.879  -6.554
  402   2HG1  VAL  51          HG12      VAL  51  -9.211   1.214  -6.584
  403   3HG1  VAL  51          HG13      VAL  51 -10.255   1.052  -7.997
  404   1HG2  VAL  51          HG21      VAL  51  -8.554   4.770  -6.804
  405   2HG2  VAL  51          HG22      VAL  51  -9.030   3.525  -5.653
  406   3HG2  VAL  51          HG23      VAL  51 -10.257   4.538  -6.414
  407    H    ASP  52           HN       ASP  52  -9.336   2.575 -10.599
  408    HA   ASP  52           HA       ASP  52  -9.322  -0.233 -10.972
  409   1HB   ASP  52          HB2       ASP  52 -10.635   1.381 -12.373
  410   2HB   ASP  52          HB1       ASP  52  -9.130   1.889 -13.139
  411    H    THR  53           HN       THR  53  -6.924   2.258 -11.663
  412    HA   THR  53           HA       THR  53  -5.062   0.365 -12.867
  413    HB   THR  53           HB       THR  53  -4.664   3.231 -12.135
  414    HG1  THR  53           HG1      THR  53  -4.705   3.238 -14.560
  415   1HG2  THR  53          HG21      THR  53  -2.657   3.120 -13.494
  416   2HG2  THR  53          HG22      THR  53  -2.998   1.441 -13.906
  417   3HG2  THR  53          HG23      THR  53  -2.554   1.869 -12.257
  418    H    TYR  54           HN       TYR  54  -5.787   1.575  -9.747
  419    HA   TYR  54           HA       TYR  54  -3.496   0.003  -8.627
  420   1HB   TYR  54          HB2       TYR  54  -4.486   2.720  -7.749
  421   2HB   TYR  54          HB1       TYR  54  -3.445   1.696  -6.760
  422    HD1  TYR  54           HD1      TYR  54  -3.705   3.080 -10.181
  423    HD2  TYR  54           HD2      TYR  54  -1.112   1.861  -7.026
  424    HE1  TYR  54           HE1      TYR  54  -1.792   3.968 -11.463
  425    HE2  TYR  54           HE2      TYR  54   0.844   2.728  -8.292
  426    HH   TYR  54           HH       TYR  54   1.297   3.145 -10.911
  427    H    GLY  55           HN       GLY  55  -5.272  -1.621  -8.519
  428   1HA   GLY  55          HA2       GLY  55  -6.721  -1.369  -5.947
  429   2HA   GLY  55          HA1       GLY  55  -7.682  -1.717  -7.389
  430    H    SER  56           HN       SER  56  -7.570  -3.822  -8.295
  431    HA   SER  56           HA       SER  56  -7.112  -5.970  -6.596
  432   1HB   SER  56          HB2       SER  56  -7.501  -7.313  -8.441
  433   2HB   SER  56          HB1       SER  56  -7.990  -5.772  -9.136
  434    HG   SER  56           HG       SER  56  -5.990  -7.384  -9.862
  435    H    SER  57           HN       SER  57  -4.722  -4.000  -8.100
  436    HA   SER  57           HA       SER  57  -2.579  -6.023  -7.697
  437   1HB   SER  57          HB2       SER  57  -2.575  -3.249  -8.915
  438   2HB   SER  57          HB1       SER  57  -1.094  -4.155  -8.596
  439    HG   SER  57           HG       SER  57  -2.796  -5.784  -9.799
  440    H    ILE  58           HN       ILE  58  -2.370  -2.538  -7.072
  441    HA   ILE  58           HA       ILE  58  -0.668  -2.274  -5.033
  442    HB   ILE  58           HB       ILE  58  -2.174  -0.487  -5.854
  443   1HG1  ILE  58          HG12      ILE  58  -1.948  -0.854  -2.855
  444   2HG1  ILE  58          HG11      ILE  58  -0.913   0.125  -3.903
  445   1HG2  ILE  58          HG21      ILE  58  -4.233  -1.987  -5.519
  446   2HG2  ILE  58          HG22      ILE  58  -4.396  -0.271  -5.175
  447   3HG2  ILE  58          HG23      ILE  58  -4.190  -1.401  -3.854
  448   1HD1  ILE  58          HD11      ILE  58  -3.081   1.447  -4.464
  449   2HD1  ILE  58          HD12      ILE  58  -2.360   1.708  -2.872
  450   3HD1  ILE  58          HD13      ILE  58  -3.767   0.651  -3.045
  451    H    LEU  59           HN       LEU  59  -3.964  -3.461  -4.523
  452    HA   LEU  59           HA       LEU  59  -3.484  -3.983  -1.705
  453   1HB   LEU  59          HB2       LEU  59  -5.680  -5.389  -3.222
  454   2HB   LEU  59          HB1       LEU  59  -5.671  -4.823  -1.555
  455    HG   LEU  59           HG       LEU  59  -5.606  -2.968  -3.914
  456   1HD1  LEU  59          HD11      LEU  59  -7.973  -3.968  -2.357
  457   2HD1  LEU  59          HD12      LEU  59  -7.636  -4.265  -4.064
  458   3HD1  LEU  59          HD13      LEU  59  -8.020  -2.634  -3.508
  459   1HD2  LEU  59          HD21      LEU  59  -6.433  -2.480  -1.051
  460   2HD2  LEU  59          HD22      LEU  59  -6.239  -1.268  -2.316
  461   3HD2  LEU  59          HD23      LEU  59  -4.831  -2.107  -1.681
  462    H    SER  60           HN       SER  60  -4.014  -6.204  -4.496
  463    HA   SER  60           HA       SER  60  -3.136  -8.509  -2.949
  464   1HB   SER  60          HB2       SER  60  -4.798  -8.391  -4.950
  465   2HB   SER  60          HB1       SER  60  -3.350  -8.504  -5.945
  466    HG   SER  60           HG       SER  60  -3.089 -10.289  -4.041
  467    H    ILE  61           HN       ILE  61  -1.303  -6.087  -4.233
  468    HA   ILE  61           HA       ILE  61   0.844  -7.843  -5.275
  469    HB   ILE  61           HB       ILE  61  -0.077  -5.556  -6.203
  470   1HG1  ILE  61          HG12      ILE  61   1.761  -6.984  -7.151
  471   2HG1  ILE  61          HG11      ILE  61   1.892  -5.273  -7.502
  472   1HG2  ILE  61          HG21      ILE  61   0.391  -4.231  -4.214
  473   2HG2  ILE  61          HG22      ILE  61   1.261  -3.626  -5.615
  474   3HG2  ILE  61          HG23      ILE  61   2.117  -4.554  -4.392
  475   1HD1  ILE  61          HD11      ILE  61   3.548  -5.000  -5.753
  476   2HD1  ILE  61          HD12      ILE  61   4.051  -6.301  -6.832
  477   3HD1  ILE  61          HD13      ILE  61   3.352  -6.683  -5.261
  478    H    LEU  62           HN       LEU  62   0.753  -5.190  -2.866
  479    HA   LEU  62           HA       LEU  62   3.270  -5.750  -1.730
  480   1HB   LEU  62          HB2       LEU  62   0.819  -4.630  -0.378
  481   2HB   LEU  62          HB1       LEU  62   2.464  -4.539   0.256
  482    HG   LEU  62           HG       LEU  62   1.601  -3.438  -2.422
  483   1HD1  LEU  62          HD11      LEU  62   2.019  -1.211  -1.209
  484   2HD1  LEU  62          HD12      LEU  62   1.933  -2.147   0.284
  485   3HD1  LEU  62          HD13      LEU  62   0.538  -2.075  -0.793
  486   1HD2  LEU  62          HD21      LEU  62   3.881  -2.147  -1.924
  487   2HD2  LEU  62          HD22      LEU  62   3.859  -3.724  -2.710
  488   3HD2  LEU  62          HD23      LEU  62   4.209  -3.602  -0.983
  489    H    LEU  63           HN       LEU  63   0.816  -7.927  -1.877
  490    HA   LEU  63           HA       LEU  63   1.263  -9.042   0.844
  491   1HB   LEU  63          HB2       LEU  63  -0.493 -10.423  -1.142
  492   2HB   LEU  63          HB1       LEU  63  -0.722 -10.194   0.590
  493    HG   LEU  63           HG       LEU  63  -1.224  -8.237  -1.652
  494   1HD1  LEU  63          HD11      LEU  63  -3.483  -8.203  -0.659
  495   2HD1  LEU  63          HD12      LEU  63  -2.941  -9.289   0.617
  496   3HD1  LEU  63          HD13      LEU  63  -2.997  -9.853  -1.051
  497   1HD2  LEU  63          HD21      LEU  63  -1.987  -6.847   0.594
  498   2HD2  LEU  63          HD22      LEU  63  -0.461  -6.603  -0.239
  499   3HD2  LEU  63          HD23      LEU  63  -0.530  -7.646   1.182
  500    H    GLU  64           HN       GLU  64   1.453 -10.176  -2.571
  501    HA   GLU  64           HA       GLU  64   3.399 -12.270  -1.623
  502   1HB   GLU  64          HB2       GLU  64   1.217 -12.465  -3.705
  503   2HB   GLU  64          HB1       GLU  64   2.446 -13.704  -3.440
  504   1HG   GLU  64          HG2       GLU  64   1.700 -13.944  -1.095
  505   2HG   GLU  64          HG1       GLU  64   0.462 -12.717  -1.368
  506    H    GLU  65           HN       GLU  65   2.294 -10.732  -4.680
  507    HA   GLU  65           HA       GLU  65   4.591 -11.359  -6.170
  508   1HB   GLU  65          HB2       GLU  65   3.147  -8.710  -6.384
  509   2HB   GLU  65          HB1       GLU  65   3.963  -9.600  -7.671
  510   1HG   GLU  65          HG2       GLU  65   2.291 -11.469  -7.300
  511   2HG   GLU  65          HG1       GLU  65   1.407 -10.367  -6.242
  512    H    VAL  66           HN       VAL  66   4.350  -9.566  -3.418
  513    HA   VAL  66           HA       VAL  66   7.063  -8.410  -3.768
  514    HB   VAL  66           HB       VAL  66   4.445  -7.119  -3.267
  515   1HG1  VAL  66          HG11      VAL  66   5.329  -6.663  -1.116
  516   2HG1  VAL  66          HG12      VAL  66   5.528  -5.200  -2.078
  517   3HG1  VAL  66          HG13      VAL  66   6.912  -6.258  -1.783
  518   1HG2  VAL  66          HG21      VAL  66   5.739  -6.830  -5.323
  519   2HG2  VAL  66          HG22      VAL  66   7.016  -6.051  -4.387
  520   3HG2  VAL  66          HG23      VAL  66   5.423  -5.307  -4.496
  521    H    SER  67           HN       SER  67   8.308  -9.177  -2.101
  522    HA   SER  67           HA       SER  67   7.036 -10.365   0.256
  523   1HB   SER  67          HB2       SER  67   9.915  -9.970  -0.589
  524   2HB   SER  67          HB1       SER  67   9.485 -10.633   0.985
  525    HG   SER  67           HG       SER  67   8.985 -11.666  -1.598
  526    HA   PRO  68           HA       PRO  68   6.934  -6.631   2.625
  527   1HB   PRO  68          HB2       PRO  68   7.933  -7.731   5.093
  528   2HB   PRO  68          HB1       PRO  68   6.245  -7.437   4.645
  529   1HG   PRO  68          HG2       PRO  68   7.681  -9.997   4.757
  530   2HG   PRO  68          HG1       PRO  68   5.944  -9.711   4.573
  531   1HD   PRO  68          HD2       PRO  68   7.700 -10.621   2.541
  532   2HD   PRO  68          HD1       PRO  68   6.047 -10.016   2.304
  533    H    GLU  69           HN       GLU  69   9.826  -8.508   2.300
  534    HA   GLU  69           HA       GLU  69  11.574  -6.500   3.505
  535   1HB   GLU  69          HB2       GLU  69  12.712  -8.445   1.523
  536   2HB   GLU  69          HB1       GLU  69  13.323  -7.967   3.106
  537   1HG   GLU  69          HG2       GLU  69  11.200  -9.256   4.000
  538   2HG   GLU  69          HG1       GLU  69  11.245 -10.032   2.414
  539    H    LEU  70           HN       LEU  70  10.804  -7.537   0.187
  540    HA   LEU  70           HA       LEU  70  12.340  -5.597  -1.173
  541   1HB   LEU  70          HB2       LEU  70  11.401  -7.261  -2.542
  542   2HB   LEU  70          HB1       LEU  70   9.816  -7.112  -1.798
  543    HG   LEU  70           HG       LEU  70   9.435  -4.975  -2.931
  544   1HD1  LEU  70          HD11      LEU  70  12.351  -5.152  -3.437
  545   2HD1  LEU  70          HD12      LEU  70  11.294  -3.744  -3.396
  546   3HD1  LEU  70          HD13      LEU  70  11.418  -4.699  -4.862
  547   1HD2  LEU  70          HD21      LEU  70  10.537  -6.978  -4.922
  548   2HD2  LEU  70          HD22      LEU  70   9.205  -5.849  -5.162
  549   3HD2  LEU  70          HD23      LEU  70   9.021  -7.212  -4.058
  550    H    VAL  71           HN       VAL  71   9.155  -5.419   0.351
  551    HA   VAL  71           HA       VAL  71   8.238  -2.958  -0.581
  552    HB   VAL  71           HB       VAL  71   8.119  -3.987   2.261
  553   1HG1  VAL  71          HG11      VAL  71   5.970  -2.556   2.207
  554   2HG1  VAL  71          HG12      VAL  71   6.681  -1.770   0.799
  555   3HG1  VAL  71          HG13      VAL  71   7.503  -1.701   2.357
  556   1HG2  VAL  71          HG21      VAL  71   6.243  -4.244  -0.093
  557   2HG2  VAL  71          HG22      VAL  71   5.909  -4.836   1.532
  558   3HG2  VAL  71          HG23      VAL  71   7.219  -5.535   0.583
  559    H    CYS  72           HN       CYS  72  10.009  -3.257   2.527
  560    HA   CYS  72           HA       CYS  72  10.661  -0.524   2.746
  561   1HB   CYS  72          HB2       CYS  72  12.375  -2.860   3.577
  562   2HB   CYS  72          HB1       CYS  72  12.539  -1.200   4.139
  563    H    SER  73           HN       SER  73  11.746  -2.758   0.402
  564    HA   SER  73           HA       SER  73  14.241  -1.288  -0.154
  565   1HB   SER  73          HB2       SER  73  13.737  -3.860  -0.493
  566   2HB   SER  73          HB1       SER  73  13.114  -3.323  -2.048
  567    HG   SER  73           HG       SER  73  15.709  -3.170  -0.989
  568    H    MET  74           HN       MET  74  11.208  -1.954  -2.059
  569    HA   MET  74           HA       MET  74  11.882  -0.040  -4.057
  570   1HB   MET  74          HB2       MET  74   9.716  -0.242  -4.913
  571   2HB   MET  74          HB1       MET  74   9.979  -1.794  -4.131
  572   1HG   MET  74          HG2       MET  74   8.685  -1.088  -2.210
  573   2HG   MET  74          HG1       MET  74   8.537   0.537  -2.852
  574   1HE   MET  74          HE1       MET  74   6.793  -2.693  -2.401
  575   2HE   MET  74          HE2       MET  74   7.906  -3.224  -3.661
  576   3HE   MET  74          HE3       MET  74   6.172  -3.180  -3.986
  577    H    LEU  75           HN       LEU  75  10.303   0.335  -0.937
  578    HA   LEU  75           HA       LEU  75   9.467   3.045  -1.277
  579   1HB   LEU  75          HB2       LEU  75  10.396   1.651   1.254
  580   2HB   LEU  75          HB1       LEU  75   9.494   3.163   1.197
  581    HG   LEU  75           HG       LEU  75   8.492   0.533   0.066
  582   1HD1  LEU  75          HD11      LEU  75   6.945   0.608   2.052
  583   2HD1  LEU  75          HD12      LEU  75   7.918   1.934   2.689
  584   3HD1  LEU  75          HD13      LEU  75   8.635   0.340   2.474
  585   1HD2  LEU  75          HD21      LEU  75   7.321   2.209  -1.082
  586   2HD2  LEU  75          HD22      LEU  75   7.353   3.316   0.290
  587   3HD2  LEU  75          HD23      LEU  75   6.273   1.923   0.304
  588    H    HIS  76           HN       HIS  76  12.603   1.634  -0.778
  589    HA   HIS  76           HA       HIS  76  14.711   2.633  -0.811
  590   1HB   HIS  76          HB2       HIS  76  13.112   4.243  -2.410
  591   2HB   HIS  76          HB1       HIS  76  13.741   5.407  -1.249
  592    HD1  HIS  76           HD1      HIS  76  16.388   5.657  -1.150
  593    HD2  HIS  76           HD2      HIS  76  14.959   3.283  -4.264
  594    HE1  HIS  76           HE1      HIS  76  18.313   5.374  -2.772
  595    H    LEU  77           HN       LEU  77  13.260   2.362   1.650
  596    HA   LEU  77           HA       LEU  77  13.714   4.831   3.163
  597   1HB   LEU  77          HB2       LEU  77  11.905   2.754   3.459
  598   2HB   LEU  77          HB1       LEU  77  13.116   2.320   4.662
  599    HG   LEU  77           HG       LEU  77  12.942   4.836   5.352
  600   1HD1  LEU  77          HD11      LEU  77  10.930   5.972   4.833
  601   2HD1  LEU  77          HD12      LEU  77  10.160   4.505   4.230
  602   3HD1  LEU  77          HD13      LEU  77  11.440   5.275   3.295
  603   1HD2  LEU  77          HD21      LEU  77  10.646   2.934   5.921
  604   2HD2  LEU  77          HD22      LEU  77  11.139   4.294   6.932
  605   3HD2  LEU  77          HD23      LEU  77  12.207   2.903   6.741
  606    H    CYS  78           HN       CYS  78  15.329   1.798   2.529
  607    HA   CYS  78           HA       CYS  78  17.203   2.068   4.760
  608   1HB   CYS  78          HB2       CYS  78  17.410   0.340   2.275
  609   2HB   CYS  78          HB1       CYS  78  18.346   0.156   3.757
  610    H    SER  79           HN       SER  79  17.007   4.387   3.018
  611    HA   SER  79           HA       SER  79  18.959   4.639   1.044
  612   1HB   SER  79          HB2       SER  79  17.338   6.423   1.907
  613   2HB   SER  79          HB1       SER  79  18.528   6.752   3.162
  614    HG   SER  79           HG       SER  79  18.506   7.764   0.797
  615    H    GLY  80           HN       GLY  80  21.041   3.971   1.156
  616   1HA   GLY  80          HA2       GLY  80  22.472   3.797   3.699
  617   2HA   GLY  80          HA1       GLY  80  23.141   3.435   2.106
  618    H    LEU  81           HN       LEU  81  22.052   6.069   1.186
  619    HA   LEU  81           HA       LEU  81  24.047   7.911   2.408
  620   1HB   LEU  81          HB2       LEU  81  24.097   8.929   0.017
  621   2HB   LEU  81          HB1       LEU  81  25.023   7.464   0.307
  622    HG   LEU  81           HG       LEU  81  23.679   7.437  -1.820
  623   1HD1  LEU  81          HD11      LEU  81  23.517   5.188  -1.701
  624   2HD1  LEU  81          HD12      LEU  81  22.405   5.223  -0.339
  625   3HD1  LEU  81          HD13      LEU  81  24.139   5.354  -0.063
  626   1HD2  LEU  81          HD21      LEU  81  21.301   7.334  -1.805
  627   2HD2  LEU  81          HD22      LEU  81  21.704   8.680  -0.743
  628   3HD2  LEU  81          HD23      LEU  81  21.235   7.124  -0.057
  629    H    VAL  82           HN       VAL  82  23.338  10.240   1.309
  630    HA   VAL  82           HA       VAL  82  20.659  10.603   2.388
  631    HB   VAL  82           HB       VAL  82  21.060  13.032   1.512
  632   1HG1  VAL  82          HG11      VAL  82  21.157  12.335   3.882
  633   2HG1  VAL  82          HG12      VAL  82  22.392  13.540   3.511
  634   3HG1  VAL  82          HG13      VAL  82  22.836  11.840   3.661
  635   1HG2  VAL  82          HG21      VAL  82  22.967  12.253   0.031
  636   2HG2  VAL  82          HG22      VAL  82  23.900  11.961   1.499
  637   3HG2  VAL  82          HG23      VAL  82  23.375  13.596   1.097
  638    HA   PRO  83           HA       PRO  83  18.645   9.606  -1.439
  639   1HB   PRO  83          HB2       PRO  83  16.660  11.725  -0.837
  640   2HB   PRO  83          HB1       PRO  83  16.414   9.989  -1.094
  641   1HG   PRO  83          HG2       PRO  83  16.358  11.262   1.405
  642   2HG   PRO  83          HG1       PRO  83  16.574   9.525   1.140
  643   1HD   PRO  83          HD2       PRO  83  18.561  11.476   2.073
  644   2HD   PRO  83          HD1       PRO  83  18.668   9.697   2.015
  645    H    ARG  84           HN       ARG  84  19.388  10.362  -3.398
  646    HA   ARG  84           HA       ARG  84  20.168  13.205  -3.665
  647   1HB   ARG  84          HB2       ARG  84  20.425  10.915  -5.635
  648   2HB   ARG  84          HB1       ARG  84  21.183  12.496  -5.779
  649   1HG   ARG  84          HG2       ARG  84  21.671  10.545  -3.510
  650   2HG   ARG  84          HG1       ARG  84  22.743  10.759  -4.892
  651   1HD   ARG  84          HD2       ARG  84  22.163  12.668  -2.639
  652   2HD   ARG  84          HD1       ARG  84  23.718  12.139  -3.268
  653    HE   ARG  84           HE       ARG  84  22.620  13.508  -5.393
  654   1HH1  ARG  84          HH21      ARG  84  23.156  14.139  -2.047
  655   2HH1  ARG  84          HH22      ARG  84  23.368  15.844  -2.265
  656   1HH2  ARG  84          HH11      ARG  84  22.892  15.730  -5.698
  657   2HH2  ARG  84          HH12      ARG  84  23.219  16.745  -4.333
  Start of MODEL   16
    1   1H    SER   1           HT1      SER   1  20.879   5.273  15.386
    2   2H    SER   1           HT2      SER   1  21.546   6.647  14.641
    3   3H    SER   1           HT3      SER   1  21.896   5.097  14.041
    4    HA   SER   1           HA       SER   1  19.078   5.741  14.162
    5   1HB   SER   1          HB2       SER   1  19.093   7.243  12.288
    6   2HB   SER   1          HB1       SER   1  20.211   7.909  13.476
    7    HG   SER   1           HG       SER   1  20.674   7.000  10.957
    8    H    ASP   2           HN       ASP   2  19.371   5.738  11.100
    9    HA   ASP   2           HA       ASP   2  19.182   4.070   9.455
   10   1HB   ASP   2          HB2       ASP   2  21.500   2.857  10.984
   11   2HB   ASP   2          HB1       ASP   2  21.088   2.569   9.293
   12    H    VAL   3           HN       VAL   3  17.525   3.749  11.756
   13    HA   VAL   3           HA       VAL   3  17.533   0.814  12.249
   14    HB   VAL   3           HB       VAL   3  17.353   2.612  14.097
   15   1HG1  VAL   3          HG11      VAL   3  15.178   3.472  14.611
   16   2HG1  VAL   3          HG12      VAL   3  14.474   2.641  13.229
   17   3HG1  VAL   3          HG13      VAL   3  15.624   3.962  12.981
   18   1HG2  VAL   3          HG21      VAL   3  15.696   1.190  15.366
   19   2HG2  VAL   3          HG22      VAL   3  17.008   0.287  14.607
   20   3HG2  VAL   3          HG23      VAL   3  15.411   0.314  13.862
   21    H    TYR   4           HN       TYR   4  16.072   3.199  10.351
   22    HA   TYR   4           HA       TYR   4  13.416   2.175  10.118
   23   1HB   TYR   4          HB2       TYR   4  14.996   3.508   7.917
   24   2HB   TYR   4          HB1       TYR   4  13.251   3.433   8.077
   25    HD1  TYR   4           HD1      TYR   4  14.036   3.959  11.388
   26    HD2  TYR   4           HD2      TYR   4  14.350   5.977   7.598
   27    HE1  TYR   4           HE1      TYR   4  14.092   6.124  12.547
   28    HE2  TYR   4           HE2      TYR   4  14.382   8.148   8.768
   29    HH   TYR   4           HH       TYR   4  14.421   9.180  10.735
   30    H    CYS   5           HN       CYS   5  16.432   0.969   8.981
   31    HA   CYS   5           HA       CYS   5  15.291  -0.572   6.769
   32   1HB   CYS   5          HB2       CYS   5  17.987  -1.104   8.010
   33   2HB   CYS   5          HB1       CYS   5  17.490  -1.254   6.324
   34    H    GLU   6           HN       GLU   6  16.525  -1.335  10.042
   35    HA   GLU   6           HA       GLU   6  15.783  -4.153   9.748
   36   1HB   GLU   6          HB2       GLU   6  16.710  -2.542  12.143
   37   2HB   GLU   6          HB1       GLU   6  16.459  -4.288  12.151
   38   1HG   GLU   6          HG2       GLU   6  18.804  -3.908  11.746
   39   2HG   GLU   6          HG1       GLU   6  18.090  -4.439  10.223
   40    H    VAL   7           HN       VAL   7  14.425  -1.283  11.333
   41    HA   VAL   7           HA       VAL   7  12.379  -2.745  12.742
   42    HB   VAL   7           HB       VAL   7  13.275  -0.298  13.103
   43   1HG1  VAL   7          HG11      VAL   7  10.858   0.445  11.476
   44   2HG1  VAL   7          HG12      VAL   7  12.431   0.280  10.708
   45   3HG1  VAL   7          HG13      VAL   7  12.207   1.457  11.998
   46   1HG2  VAL   7          HG21      VAL   7  11.691  -1.151  14.641
   47   2HG2  VAL   7          HG22      VAL   7  10.425  -1.241  13.418
   48   3HG2  VAL   7          HG23      VAL   7  10.944   0.328  14.038
   49    H    CYS   8           HN       CYS   8  12.511  -1.218   9.538
   50    HA   CYS   8           HA       CYS   8   9.703  -1.524   8.986
   51   1HB   CYS   8          HB2       CYS   8  10.260  -0.994   6.706
   52   2HB   CYS   8          HB1       CYS   8  11.277   0.001   7.742
   53    H    GLU   9           HN       GLU   9  12.528  -3.457   7.947
   54    HA   GLU   9           HA       GLU   9  11.175  -5.478   6.549
   55   1HB   GLU   9          HB2       GLU   9  13.594  -5.795   8.376
   56   2HB   GLU   9          HB1       GLU   9  12.940  -7.108   7.409
   57   1HG   GLU   9          HG2       GLU   9  13.173  -5.508   5.384
   58   2HG   GLU   9          HG1       GLU   9  14.215  -4.547   6.431
   59    H    PHE  10           HN       PHE  10  11.496  -5.134  10.065
   60    HA   PHE  10           HA       PHE  10  10.092  -7.641  10.581
   61   1HB   PHE  10          HB2       PHE  10  11.722  -6.813  12.199
   62   2HB   PHE  10          HB1       PHE  10  10.799  -5.326  12.404
   63    HD1  PHE  10           HD1      PHE  10   8.844  -5.246  13.787
   64    HD2  PHE  10           HD2      PHE  10  10.752  -9.000  12.938
   65    HE1  PHE  10           HE1      PHE  10   7.455  -6.344  15.523
   66    HE2  PHE  10           HE2      PHE  10   9.362 -10.098  14.673
   67    HZ   PHE  10           HZ       PHE  10   7.713  -8.770  15.966
   68    H    LEU  11           HN       LEU  11   9.191  -4.224  10.414
   69    HA   LEU  11           HA       LEU  11   6.508  -4.731  11.456
   70   1HB   LEU  11          HB2       LEU  11   7.758  -2.345  10.078
   71   2HB   LEU  11          HB1       LEU  11   6.101  -2.360  10.673
   72    HG   LEU  11           HG       LEU  11   8.465  -3.032  12.435
   73   1HD1  LEU  11          HD11      LEU  11   8.157  -0.655  13.294
   74   2HD1  LEU  11          HD12      LEU  11   7.197  -0.351  11.846
   75   3HD1  LEU  11          HD13      LEU  11   8.896  -0.802  11.699
   76   1HD2  LEU  11          HD21      LEU  11   5.533  -2.460  12.878
   77   2HD2  LEU  11          HD22      LEU  11   6.694  -2.120  14.159
   78   3HD2  LEU  11          HD23      LEU  11   6.526  -3.757  13.540
   79    H    VAL  12           HN       VAL  12   7.833  -3.938   8.229
   80    HA   VAL  12           HA       VAL  12   5.334  -4.106   6.880
   81    HB   VAL  12           HB       VAL  12   7.996  -4.849   5.659
   82   1HG1  VAL  12          HG11      VAL  12   6.949  -3.951   3.623
   83   2HG1  VAL  12          HG12      VAL  12   5.487  -3.578   4.535
   84   3HG1  VAL  12          HG13      VAL  12   5.977  -5.255   4.303
   85   1HG2  VAL  12          HG21      VAL  12   8.004  -2.633   6.974
   86   2HG2  VAL  12          HG22      VAL  12   6.806  -2.066   5.816
   87   3HG2  VAL  12          HG23      VAL  12   8.418  -2.519   5.265
   88    H    LYS  13           HN       LYS  13   7.555  -6.639   7.957
   89    HA   LYS  13           HA       LYS  13   6.202  -8.660   6.313
   90   1HB   LYS  13          HB2       LYS  13   7.850 -10.144   6.973
   91   2HB   LYS  13          HB1       LYS  13   8.688  -8.607   7.043
   92   1HG   LYS  13          HG2       LYS  13   9.270  -9.097   9.151
   93   2HG   LYS  13          HG1       LYS  13   7.602  -8.919   9.628
   94   1HD   LYS  13          HD2       LYS  13   8.791 -11.504   8.588
   95   2HD   LYS  13          HD1       LYS  13   8.692 -11.096  10.298
   96   1HE   LYS  13          HE2       LYS  13   6.213 -10.765   9.972
   97   2HE   LYS  13          HE1       LYS  13   6.401 -11.466   8.367
   98   1HZ   LYS  13          HZ1       LYS  13   7.615 -13.324   9.699
   99   2HZ   LYS  13          HZ2       LYS  13   5.918 -13.310   9.603
  100   3HZ   LYS  13          HZ3       LYS  13   6.698 -12.731  10.997
  101    H    GLU  14           HN       GLU  14   5.984  -7.414   9.567
  102    HA   GLU  14           HA       GLU  14   4.327  -9.596  10.592
  103   1HB   GLU  14          HB2       GLU  14   5.027  -6.831  11.591
  104   2HB   GLU  14          HB1       GLU  14   3.844  -7.838  12.425
  105   1HG   GLU  14          HG2       GLU  14   6.627  -8.815  11.754
  106   2HG   GLU  14          HG1       GLU  14   6.240  -8.020  13.279
  107    H    VAL  15           HN       VAL  15   3.670  -6.206   9.660
  108    HA   VAL  15           HA       VAL  15   0.868  -6.277   9.923
  109    HB   VAL  15           HB       VAL  15   2.270  -4.251   9.311
  110   1HG1  VAL  15          HG11      VAL  15   1.996  -5.312   6.489
  111   2HG1  VAL  15          HG12      VAL  15   3.466  -5.493   7.444
  112   3HG1  VAL  15          HG13      VAL  15   2.882  -3.884   7.025
  113   1HG2  VAL  15          HG21      VAL  15  -0.235  -4.986   7.785
  114   2HG2  VAL  15          HG22      VAL  15   0.494  -3.385   7.653
  115   3HG2  VAL  15          HG23      VAL  15  -0.085  -3.965   9.215
  116    H    THR  16           HN       THR  16   2.934  -7.323   7.242
  117    HA   THR  16           HA       THR  16   0.982  -8.080   5.383
  118    HB   THR  16           HB       THR  16   3.031 -10.108   5.415
  119    HG1  THR  16           HG1      THR  16   3.877  -7.502   6.047
  120   1HG2  THR  16          HG21      THR  16   2.690  -7.511   3.882
  121   2HG2  THR  16          HG22      THR  16   2.138  -9.114   3.374
  122   3HG2  THR  16          HG23      THR  16   3.871  -8.758   3.466
  123    H    LYS  17           HN       LYS  17   2.315 -10.036   8.073
  124    HA   LYS  17           HA       LYS  17   0.920 -12.407   7.673
  125   1HB   LYS  17          HB2       LYS  17   2.188 -11.067   9.934
  126   2HB   LYS  17          HB1       LYS  17   0.770 -11.955  10.482
  127   1HG   LYS  17          HG2       LYS  17   1.621 -14.003   9.431
  128   2HG   LYS  17          HG1       LYS  17   3.009 -13.118   8.793
  129   1HD   LYS  17          HD2       LYS  17   3.693 -12.566  11.120
  130   2HD   LYS  17          HD1       LYS  17   2.346 -13.531  11.724
  131   1HE   LYS  17          HE2       LYS  17   4.655 -14.539  10.037
  132   2HE   LYS  17          HE1       LYS  17   4.387 -14.876  11.748
  133   1HZ   LYS  17          HZ1       LYS  17   2.045 -15.514  10.381
  134   2HZ   LYS  17          HZ2       LYS  17   3.119 -16.572  11.165
  135   3HZ   LYS  17          HZ3       LYS  17   3.327 -16.213   9.518
  136    H    LEU  18           HN       LEU  18  -0.335  -9.392   9.086
  137    HA   LEU  18           HA       LEU  18  -3.016 -10.629   9.397
  138   1HB   LEU  18          HB2       LEU  18  -3.359  -8.997  10.955
  139   2HB   LEU  18          HB1       LEU  18  -1.639  -8.672  10.804
  140    HG   LEU  18           HG       LEU  18  -2.238  -7.040   8.935
  141   1HD1  LEU  18          HD11      LEU  18  -4.930  -6.506   9.888
  142   2HD1  LEU  18          HD12      LEU  18  -4.831  -8.177   9.330
  143   3HD1  LEU  18          HD13      LEU  18  -4.382  -6.858   8.251
  144   1HD2  LEU  18          HD21      LEU  18  -3.323  -6.494  11.714
  145   2HD2  LEU  18          HD22      LEU  18  -2.829  -5.275  10.539
  146   3HD2  LEU  18          HD23      LEU  18  -1.630  -6.365  11.235
  147    H    ILE  19           HN       ILE  19  -1.387  -8.224   7.369
  148    HA   ILE  19           HA       ILE  19  -3.723  -7.480   5.859
  149    HB   ILE  19           HB       ILE  19  -0.857  -6.963   5.930
  150   1HG1  ILE  19          HG12      ILE  19  -3.018  -5.267   4.696
  151   2HG1  ILE  19          HG11      ILE  19  -2.747  -5.365   6.436
  152   1HG2  ILE  19          HG21      ILE  19  -2.138  -7.085   3.199
  153   2HG2  ILE  19          HG22      ILE  19  -0.715  -7.973   3.750
  154   3HG2  ILE  19          HG23      ILE  19  -0.641  -6.225   3.553
  155   1HD1  ILE  19          HD11      ILE  19  -0.179  -4.908   5.446
  156   2HD1  ILE  19          HD12      ILE  19  -1.260  -3.689   6.129
  157   3HD1  ILE  19          HD13      ILE  19  -1.211  -3.939   4.388
  158    H    ASP  20           HN       ASP  20  -1.723 -10.234   5.935
  159    HA   ASP  20           HA       ASP  20  -1.464 -11.195   3.386
  160   1HB   ASP  20          HB2       ASP  20  -0.846 -12.459   5.430
  161   2HB   ASP  20          HB1       ASP  20  -2.550 -12.812   5.717
  162    H    ASN  21           HN       ASN  21  -4.485 -11.581   5.324
  163    HA   ASN  21           HA       ASN  21  -6.088 -11.264   2.897
  164   1HB   ASN  21          HB2       ASN  21  -5.819 -13.939   4.275
  165   2HB   ASN  21          HB1       ASN  21  -7.205 -13.537   3.260
  166   1HD2  ASN  21          HD21      ASN  21  -6.181 -12.261   1.087
  167   2HD2  ASN  21          HD22      ASN  21  -5.014 -13.207   0.297
  168    H    ASN  22           HN       ASN  22  -5.798 -10.337   5.869
  169    HA   ASN  22           HA       ASN  22  -8.227 -11.140   7.181
  170   1HB   ASN  22          HB2       ASN  22  -7.835  -9.270   8.685
  171   2HB   ASN  22          HB1       ASN  22  -6.291 -10.052   8.340
  172   1HD2  ASN  22          HD21      ASN  22  -5.814  -8.999   5.734
  173   2HD2  ASN  22          HD22      ASN  22  -5.568  -7.323   5.869
  174    H    LYS  23           HN       LYS  23  -7.413  -8.252   5.250
  175    HA   LYS  23           HA       LYS  23 -10.344  -7.675   4.980
  176   1HB   LYS  23          HB2       LYS  23  -9.732  -5.390   4.536
  177   2HB   LYS  23          HB1       LYS  23  -8.885  -5.901   5.991
  178   1HG   LYS  23          HG2       LYS  23  -7.046  -5.027   4.921
  179   2HG   LYS  23          HG1       LYS  23  -7.022  -6.595   4.116
  180   1HD   LYS  23          HD2       LYS  23  -8.694  -5.406   2.429
  181   2HD   LYS  23          HD1       LYS  23  -7.978  -3.937   3.081
  182   1HE   LYS  23          HE2       LYS  23  -5.704  -4.916   2.560
  183   2HE   LYS  23          HE1       LYS  23  -6.535  -6.219   1.710
  184   1HZ   LYS  23          HZ1       LYS  23  -7.456  -4.700   0.181
  185   2HZ   LYS  23          HZ2       LYS  23  -5.810  -4.296   0.304
  186   3HZ   LYS  23          HZ3       LYS  23  -6.981  -3.355   1.099
  187    H    THR  24           HN       THR  24 -11.251  -7.848   2.984
  188    HA   THR  24           HA       THR  24  -9.510  -8.740   0.757
  189    HB   THR  24           HB       THR  24 -11.754  -9.124  -0.377
  190    HG1  THR  24           HG1      THR  24 -12.552  -8.210   2.165
  191   1HG2  THR  24          HG21      THR  24 -11.393 -10.473   2.312
  192   2HG2  THR  24          HG22      THR  24 -10.463 -10.880   0.870
  193   3HG2  THR  24          HG23      THR  24 -12.207 -11.139   0.897
  194    H    GLU  25           HN       GLU  25 -10.819  -7.854  -1.462
  195    HA   GLU  25           HA       GLU  25 -10.165  -4.966  -1.436
  196   1HB   GLU  25          HB2       GLU  25 -11.016  -6.650  -3.801
  197   2HB   GLU  25          HB1       GLU  25 -10.140  -5.119  -3.824
  198   1HG   GLU  25          HG2       GLU  25  -8.229  -6.196  -2.684
  199   2HG   GLU  25          HG1       GLU  25  -9.101  -7.728  -2.676
  200    H    LYS  26           HN       LYS  26 -12.807  -6.444  -0.475
  201    HA   LYS  26           HA       LYS  26 -14.792  -5.036  -2.148
  202   1HB   LYS  26          HB2       LYS  26 -15.441  -6.479   0.420
  203   2HB   LYS  26          HB1       LYS  26 -16.410  -6.325  -1.045
  204   1HG   LYS  26          HG2       LYS  26 -13.897  -7.980  -0.720
  205   2HG   LYS  26          HG1       LYS  26 -15.542  -8.586  -0.900
  206   1HD   LYS  26          HD2       LYS  26 -15.636  -7.356  -3.122
  207   2HD   LYS  26          HD1       LYS  26 -13.900  -7.086  -2.954
  208   1HE   LYS  26          HE2       LYS  26 -13.489  -9.472  -2.850
  209   2HE   LYS  26          HE1       LYS  26 -15.221  -9.803  -2.865
  210   1HZ   LYS  26          HZ1       LYS  26 -15.359  -9.445  -5.061
  211   2HZ   LYS  26          HZ2       LYS  26 -13.687  -9.747  -5.053
  212   3HZ   LYS  26          HZ3       LYS  26 -14.264  -8.150  -5.039
  213    H    GLU  27           HN       GLU  27 -13.419  -4.930   1.110
  214    HA   GLU  27           HA       GLU  27 -15.052  -2.660   1.915
  215   1HB   GLU  27          HB2       GLU  27 -12.512  -3.781   3.138
  216   2HB   GLU  27          HB1       GLU  27 -13.588  -2.611   3.903
  217   1HG   GLU  27          HG2       GLU  27 -14.455  -5.373   3.005
  218   2HG   GLU  27          HG1       GLU  27 -13.981  -4.976   4.656
  219    H    ILE  28           HN       ILE  28 -12.279  -3.114   0.009
  220    HA   ILE  28           HA       ILE  28 -11.092  -0.483   0.535
  221    HB   ILE  28           HB       ILE  28 -10.531  -2.600  -1.558
  222   1HG1  ILE  28          HG12      ILE  28 -10.022  -3.369   0.708
  223   2HG1  ILE  28          HG11      ILE  28  -8.529  -3.068  -0.171
  224   1HG2  ILE  28          HG21      ILE  28  -9.757  -0.569  -2.468
  225   2HG2  ILE  28          HG22      ILE  28  -8.335  -1.285  -1.715
  226   3HG2  ILE  28          HG23      ILE  28  -9.197   0.019  -0.903
  227   1HD1  ILE  28          HD11      ILE  28  -9.712  -1.579   2.131
  228   2HD1  ILE  28          HD12      ILE  28  -8.793  -0.646   0.955
  229   3HD1  ILE  28          HD13      ILE  28  -8.030  -1.985   1.804
  230    H    LEU  29           HN       LEU  29 -12.035  -1.982  -2.564
  231    HA   LEU  29           HA       LEU  29 -12.359   0.346  -4.039
  232   1HB   LEU  29          HB2       LEU  29 -14.169  -2.086  -4.220
  233   2HB   LEU  29          HB1       LEU  29 -13.890  -0.902  -5.494
  234    HG   LEU  29           HG       LEU  29 -11.617  -2.472  -4.257
  235   1HD1  LEU  29          HD11      LEU  29 -13.453  -3.236  -6.533
  236   2HD1  LEU  29          HD12      LEU  29 -13.042  -4.182  -5.101
  237   3HD1  LEU  29          HD13      LEU  29 -11.833  -3.913  -6.357
  238   1HD2  LEU  29          HD21      LEU  29 -10.848  -0.590  -5.530
  239   2HD2  LEU  29          HD22      LEU  29 -12.006  -0.899  -6.823
  240   3HD2  LEU  29          HD23      LEU  29 -10.649  -1.994  -6.575
  241    H    ASP  30           HN       ASP  30 -14.545  -1.004  -1.634
  242    HA   ASP  30           HA       ASP  30 -16.757   0.770  -2.251
  243   1HB   ASP  30          HB2       ASP  30 -16.958  -1.351  -0.895
  244   2HB   ASP  30          HB1       ASP  30 -16.090  -0.537   0.407
  245    H    ALA  31           HN       ALA  31 -14.154   0.775   0.181
  246    HA   ALA  31           HA       ALA  31 -14.659   3.158   1.517
  247   1HB   ALA  31          HB1       ALA  31 -12.716   1.563   1.869
  248   2HB   ALA  31          HB2       ALA  31 -12.332   3.280   2.004
  249   3HB   ALA  31          HB3       ALA  31 -11.910   2.391   0.537
  250    H    PHE  32           HN       PHE  32 -12.778   2.861  -1.528
  251    HA   PHE  32           HA       PHE  32 -12.389   5.618  -1.966
  252   1HB   PHE  32          HB2       PHE  32 -12.824   3.328  -3.903
  253   2HB   PHE  32          HB1       PHE  32 -12.500   4.970  -4.459
  254    HD1  PHE  32           HD1      PHE  32 -11.092   1.976  -2.903
  255    HD2  PHE  32           HD2      PHE  32 -10.353   6.098  -3.869
  256    HE1  PHE  32           HE1      PHE  32  -8.668   1.635  -2.519
  257    HE2  PHE  32           HE2      PHE  32  -7.931   5.752  -3.484
  258    HZ   PHE  32           HZ       PHE  32  -7.089   3.521  -2.809
  259    H    ASP  33           HN       ASP  33 -15.267   3.623  -2.457
  260    HA   ASP  33           HA       ASP  33 -16.744   5.704  -3.840
  261   1HB   ASP  33          HB2       ASP  33 -17.256   3.169  -3.808
  262   2HB   ASP  33          HB1       ASP  33 -17.985   3.463  -2.229
  263    H    LYS  34           HN       LYS  34 -15.594   5.440  -0.746
  264    HA   LYS  34           HA       LYS  34 -17.817   7.062   0.454
  265   1HB   LYS  34          HB2       LYS  34 -15.531   5.633   1.857
  266   2HB   LYS  34          HB1       LYS  34 -16.915   6.413   2.624
  267   1HG   LYS  34          HG2       LYS  34 -18.442   4.811   1.586
  268   2HG   LYS  34          HG1       LYS  34 -17.102   4.071   0.716
  269   1HD   LYS  34          HD2       LYS  34 -16.106   3.831   3.211
  270   2HD   LYS  34          HD1       LYS  34 -17.818   3.879   3.624
  271   1HE   LYS  34          HE2       LYS  34 -16.619   1.982   1.585
  272   2HE   LYS  34          HE1       LYS  34 -16.930   1.561   3.266
  273   1HZ   LYS  34          HZ1       LYS  34 -19.289   2.517   2.647
  274   2HZ   LYS  34          HZ2       LYS  34 -18.876   0.897   2.344
  275   3HZ   LYS  34          HZ3       LYS  34 -18.819   2.039   1.089
  276    H    MET  35           HN       MET  35 -14.250   6.851   0.869
  277    HA   MET  35           HA       MET  35 -14.058   9.608   1.689
  278   1HB   MET  35          HB2       MET  35 -11.707   8.171   0.463
  279   2HB   MET  35          HB1       MET  35 -11.729   9.335   1.777
  280   1HG   MET  35          HG2       MET  35 -12.273   7.742   3.373
  281   2HG   MET  35          HG1       MET  35 -13.144   6.727   2.230
  282   1HE   MET  35          HE1       MET  35 -10.555   6.096  -0.235
  283   2HE   MET  35          HE2       MET  35 -12.227   5.921   0.264
  284   3HE   MET  35          HE3       MET  35 -11.111   4.586   0.501
  285    H    CYS  36           HN       CYS  36 -13.236   7.962  -1.373
  286    HA   CYS  36           HA       CYS  36 -12.640  10.461  -2.717
  287   1HB   CYS  36          HB2       CYS  36 -12.491   7.628  -3.284
  288   2HB   CYS  36          HB1       CYS  36 -13.312   8.424  -4.632
  289    H    SER  37           HN       SER  37 -15.382   9.644  -1.386
  290    HA   SER  37           HA       SER  37 -17.257  10.065  -3.604
  291   1HB   SER  37          HB2       SER  37 -17.599   8.691  -1.384
  292   2HB   SER  37          HB1       SER  37 -18.025  10.251  -0.697
  293    HG   SER  37           HG       SER  37 -19.146   9.169  -3.073
  294    H    LYS  38           HN       LYS  38 -16.312  11.820  -0.643
  295    HA   LYS  38           HA       LYS  38 -17.770  14.211  -1.222
  296   1HB   LYS  38          HB2       LYS  38 -16.352  15.247   0.487
  297   2HB   LYS  38          HB1       LYS  38 -16.837  13.635   1.015
  298   1HG   LYS  38          HG2       LYS  38 -14.539  12.980  -0.259
  299   2HG   LYS  38          HG1       LYS  38 -14.131  14.630   0.196
  300   1HD   LYS  38          HD2       LYS  38 -14.735  14.088   2.558
  301   2HD   LYS  38          HD1       LYS  38 -15.029  12.419   2.070
  302   1HE   LYS  38          HE2       LYS  38 -12.429  13.900   2.285
  303   2HE   LYS  38          HE1       LYS  38 -12.816  12.248   2.766
  304   1HZ   LYS  38          HZ1       LYS  38 -12.655  13.170  -0.050
  305   2HZ   LYS  38          HZ2       LYS  38 -12.838  11.571   0.495
  306   3HZ   LYS  38          HZ3       LYS  38 -11.385  12.407   0.775
  307    H    LEU  39           HN       LEU  39 -14.898  12.890  -2.562
  308    HA   LEU  39           HA       LEU  39 -13.485  15.220  -3.282
  309   1HB   LEU  39          HB2       LEU  39 -13.407  12.422  -4.007
  310   2HB   LEU  39          HB1       LEU  39 -13.388  13.336  -5.495
  311    HG   LEU  39           HG       LEU  39 -11.497  14.699  -3.962
  312   1HD1  LEU  39          HD11      LEU  39 -10.150  13.188  -2.784
  313   2HD1  LEU  39          HD12      LEU  39 -10.891  11.781  -3.551
  314   3HD1  LEU  39          HD13      LEU  39 -11.785  12.697  -2.335
  315   1HD2  LEU  39          HD21      LEU  39  -9.859  13.609  -5.443
  316   2HD2  LEU  39          HD22      LEU  39 -11.317  14.046  -6.333
  317   3HD2  LEU  39          HD23      LEU  39 -11.051  12.374  -5.851
  318    HA   PRO  40           HA       PRO  40 -16.302  17.253  -6.091
  319   1HB   PRO  40          HB2       PRO  40 -14.133  17.833  -7.991
  320   2HB   PRO  40          HB1       PRO  40 -15.062  18.963  -6.997
  321   1HG   PRO  40          HG2       PRO  40 -12.356  18.141  -6.571
  322   2HG   PRO  40          HG1       PRO  40 -13.345  19.127  -5.486
  323   1HD   PRO  40          HD2       PRO  40 -12.493  16.392  -5.093
  324   2HD   PRO  40          HD1       PRO  40 -13.475  17.389  -4.004
  325    H    LYS  41           HN       LYS  41 -17.336  16.663  -8.103
  326    HA   LYS  41           HA       LYS  41 -17.267  14.006  -8.879
  327   1HB   LYS  41          HB2       LYS  41 -18.939  15.804  -9.519
  328   2HB   LYS  41          HB1       LYS  41 -17.817  16.252 -10.805
  329   1HG   LYS  41          HG2       LYS  41 -17.897  13.954 -11.687
  330   2HG   LYS  41          HG1       LYS  41 -19.008  13.498 -10.396
  331   1HD   LYS  41          HD2       LYS  41 -20.519  13.975 -12.112
  332   2HD   LYS  41          HD1       LYS  41 -20.437  15.536 -11.295
  333   1HE   LYS  41          HE2       LYS  41 -18.796  16.338 -12.925
  334   2HE   LYS  41          HE1       LYS  41 -18.764  14.758 -13.707
  335   1HZ   LYS  41          HZ1       LYS  41 -20.584  15.249 -14.848
  336   2HZ   LYS  41          HZ2       LYS  41 -20.445  16.848 -14.292
  337   3HZ   LYS  41          HZ3       LYS  41 -21.421  15.737 -13.456
  338    H    SER  42           HN       SER  42 -15.738  16.654 -10.659
  339    HA   SER  42           HA       SER  42 -14.455  15.280 -12.687
  340   1HB   SER  42          HB2       SER  42 -13.160  17.466 -11.047
  341   2HB   SER  42          HB1       SER  42 -12.819  17.065 -12.730
  342    HG   SER  42           HG       SER  42 -15.464  17.620 -12.024
  343    H    LEU  43           HN       LEU  43 -12.781  16.120  -9.649
  344    HA   LEU  43           HA       LEU  43 -10.660  14.236 -10.216
  345   1HB   LEU  43          HB2       LEU  43 -11.331  15.848  -7.749
  346   2HB   LEU  43          HB1       LEU  43  -9.863  14.887  -7.925
  347    HG   LEU  43           HG       LEU  43 -10.682  17.053  -9.876
  348   1HD1  LEU  43          HD11      LEU  43  -8.839  18.370  -8.676
  349   2HD1  LEU  43          HD12      LEU  43  -8.994  17.190  -7.374
  350   3HD1  LEU  43          HD13      LEU  43 -10.369  18.201  -7.817
  351   1HD2  LEU  43          HD21      LEU  43  -9.075  15.729 -10.964
  352   2HD2  LEU  43          HD22      LEU  43  -8.224  15.347  -9.469
  353   3HD2  LEU  43          HD23      LEU  43  -8.065  16.946 -10.191
  354    H    SER  44           HN       SER  44 -13.761  13.635  -9.194
  355    HA   SER  44           HA       SER  44 -13.051  11.543  -7.231
  356   1HB   SER  44          HB2       SER  44 -15.147  12.656  -6.798
  357   2HB   SER  44          HB1       SER  44 -15.675  12.412  -8.456
  358    HG   SER  44           HG       SER  44 -15.054  10.324  -6.641
  359    H    GLU  45           HN       GLU  45 -13.879  12.043 -10.560
  360    HA   GLU  45           HA       GLU  45 -14.192   9.221 -11.158
  361   1HB   GLU  45          HB2       GLU  45 -13.890  11.633 -12.963
  362   2HB   GLU  45          HB1       GLU  45 -14.264  10.003 -13.523
  363   1HG   GLU  45          HG2       GLU  45 -15.947  11.488 -11.491
  364   2HG   GLU  45          HG1       GLU  45 -16.284  11.498 -13.223
  365    H    GLU  46           HN       GLU  46 -11.659  11.603 -11.118
  366    HA   GLU  46           HA       GLU  46  -9.795   9.950 -12.669
  367   1HB   GLU  46          HB2       GLU  46  -9.352  12.499 -11.091
  368   2HB   GLU  46          HB1       GLU  46  -8.173  11.745 -12.163
  369   1HG   GLU  46          HG2       GLU  46  -9.858  11.944 -14.029
  370   2HG   GLU  46          HG1       GLU  46 -10.869  12.890 -12.937
  371    H    CYS  47           HN       CYS  47 -10.576  10.502  -9.287
  372    HA   CYS  47           HA       CYS  47  -8.078   9.346  -8.320
  373   1HB   CYS  47          HB2       CYS  47  -8.882   9.724  -6.165
  374   2HB   CYS  47          HB1       CYS  47  -9.704  10.975  -7.086
  375    H    GLN  48           HN       GLN  48 -11.263   8.197  -9.186
  376    HA   GLN  48           HA       GLN  48 -10.777   5.517  -8.074
  377   1HB   GLN  48          HB2       GLN  48 -12.998   6.744  -9.736
  378   2HB   GLN  48          HB1       GLN  48 -12.951   5.025  -9.338
  379   1HG   GLN  48          HG2       GLN  48 -12.684   5.880  -6.859
  380   2HG   GLN  48          HG1       GLN  48 -13.331   7.389  -7.503
  381   1HE2  GLN  48          HE21      GLN  48 -14.080   3.944  -6.993
  382   2HE2  GLN  48          HE22      GLN  48 -15.760   4.110  -7.174
  383    H    GLU  49           HN       GLU  49 -10.250   7.346 -10.933
  384    HA   GLU  49           HA       GLU  49 -10.170   5.231 -12.825
  385   1HB   GLU  49          HB2       GLU  49 -10.107   7.725 -13.329
  386   2HB   GLU  49          HB1       GLU  49  -8.413   7.697 -12.850
  387   1HG   GLU  49          HG2       GLU  49  -9.532   5.854 -14.967
  388   2HG   GLU  49          HG1       GLU  49  -8.874   7.443 -15.346
  389    H    VAL  50           HN       VAL  50  -7.630   6.725 -10.810
  390    HA   VAL  50           HA       VAL  50  -5.562   4.933 -11.677
  391    HB   VAL  50           HB       VAL  50  -5.739   6.365  -9.013
  392   1HG1  VAL  50          HG11      VAL  50  -3.188   6.280  -9.375
  393   2HG1  VAL  50          HG12      VAL  50  -3.519   5.081 -10.631
  394   3HG1  VAL  50          HG13      VAL  50  -3.985   4.765  -8.955
  395   1HG2  VAL  50          HG21      VAL  50  -4.267   8.048 -10.289
  396   2HG2  VAL  50          HG22      VAL  50  -5.987   8.055 -10.677
  397   3HG2  VAL  50          HG23      VAL  50  -4.841   7.262 -11.761
  398    H    VAL  51           HN       VAL  51  -7.891   4.822  -8.969
  399    HA   VAL  51           HA       VAL  51  -6.923   2.576  -7.555
  400    HB   VAL  51           HB       VAL  51  -9.773   3.364  -8.285
  401   1HG1  VAL  51          HG11      VAL  51  -9.854   1.019  -7.750
  402   2HG1  VAL  51          HG12      VAL  51 -10.394   1.896  -6.319
  403   3HG1  VAL  51          HG13      VAL  51  -8.760   1.237  -6.385
  404   1HG2  VAL  51          HG21      VAL  51  -9.835   4.388  -6.132
  405   2HG2  VAL  51          HG22      VAL  51  -8.289   4.870  -6.833
  406   3HG2  VAL  51          HG23      VAL  51  -8.348   3.586  -5.627
  407    H    ASP  52           HN       ASP  52  -8.928   2.621 -10.522
  408    HA   ASP  52           HA       ASP  52  -9.073  -0.197 -10.879
  409   1HB   ASP  52          HB2       ASP  52  -8.897   2.026 -12.944
  410   2HB   ASP  52          HB1       ASP  52  -9.305   0.352 -13.321
  411    H    THR  53           HN       THR  53  -6.563   2.176 -11.530
  412    HA   THR  53           HA       THR  53  -4.794   0.204 -12.767
  413    HB   THR  53           HB       THR  53  -4.303   3.067 -12.055
  414    HG1  THR  53           HG1      THR  53  -5.133   1.699 -14.346
  415   1HG2  THR  53          HG21      THR  53  -2.291   2.877 -13.414
  416   2HG2  THR  53          HG22      THR  53  -2.668   1.194 -13.776
  417   3HG2  THR  53          HG23      THR  53  -2.224   1.664 -12.138
  418    H    TYR  54           HN       TYR  54  -5.474   1.442  -9.652
  419    HA   TYR  54           HA       TYR  54  -3.218  -0.174  -8.519
  420   1HB   TYR  54          HB2       TYR  54  -4.173   2.555  -7.640
  421   2HB   TYR  54          HB1       TYR  54  -3.148   1.515  -6.653
  422    HD1  TYR  54           HD1      TYR  54  -3.374   2.882 -10.084
  423    HD2  TYR  54           HD2      TYR  54  -0.815   1.686  -6.895
  424    HE1  TYR  54           HE1      TYR  54  -1.450   3.759 -11.354
  425    HE2  TYR  54           HE2      TYR  54   1.155   2.540  -8.147
  426    HH   TYR  54           HH       TYR  54   1.771   3.021 -10.495
  427    H    GLY  55           HN       GLY  55  -4.984  -1.782  -8.392
  428   1HA   GLY  55          HA2       GLY  55  -6.477  -1.484  -5.851
  429   2HA   GLY  55          HA1       GLY  55  -7.410  -1.864  -7.304
  430    H    SER  56           HN       SER  56  -7.270  -3.994  -8.165
  431    HA   SER  56           HA       SER  56  -6.832  -6.091  -6.400
  432   1HB   SER  56          HB2       SER  56  -7.923  -6.609  -8.449
  433   2HB   SER  56          HB1       SER  56  -6.582  -5.998  -9.411
  434    HG   SER  56           HG       SER  56  -5.864  -7.964  -9.355
  435    H    SER  57           HN       SER  57  -4.387  -4.155  -7.908
  436    HA   SER  57           HA       SER  57  -2.284  -6.197  -7.388
  437   1HB   SER  57          HB2       SER  57  -2.188  -3.451  -8.669
  438   2HB   SER  57          HB1       SER  57  -0.738  -4.385  -8.280
  439    HG   SER  57           HG       SER  57  -2.814  -5.642  -9.677
  440    H    ILE  58           HN       ILE  58  -2.059  -2.701  -6.850
  441    HA   ILE  58           HA       ILE  58  -0.438  -2.399  -4.752
  442    HB   ILE  58           HB       ILE  58  -1.896  -0.621  -5.682
  443   1HG1  ILE  58          HG12      ILE  58  -1.737  -0.914  -2.674
  444   2HG1  ILE  58          HG11      ILE  58  -0.683   0.042  -3.722
  445   1HG2  ILE  58          HG21      ILE  58  -4.133  -0.355  -5.070
  446   2HG2  ILE  58          HG22      ILE  58  -3.979  -1.449  -3.713
  447   3HG2  ILE  58          HG23      ILE  58  -3.986  -2.082  -5.364
  448   1HD1  ILE  58          HD11      ILE  58  -2.829   1.361  -4.340
  449   2HD1  ILE  58          HD12      ILE  58  -2.143   1.641  -2.738
  450   3HD1  ILE  58          HD13      ILE  58  -3.551   0.588  -2.926
  451    H    LEU  59           HN       LEU  59  -3.773  -3.526  -4.330
  452    HA   LEU  59           HA       LEU  59  -3.408  -3.957  -1.486
  453   1HB   LEU  59          HB2       LEU  59  -5.528  -5.406  -3.078
  454   2HB   LEU  59          HB1       LEU  59  -5.597  -4.839  -1.413
  455    HG   LEU  59           HG       LEU  59  -5.445  -2.991  -3.780
  456   1HD1  LEU  59          HD11      LEU  59  -7.471  -4.355  -3.928
  457   2HD1  LEU  59          HD12      LEU  59  -7.858  -2.679  -3.528
  458   3HD1  LEU  59          HD13      LEU  59  -7.880  -3.911  -2.267
  459   1HD2  LEU  59          HD21      LEU  59  -6.085  -1.267  -2.244
  460   2HD2  LEU  59          HD22      LEU  59  -4.767  -2.142  -1.482
  461   3HD2  LEU  59          HD23      LEU  59  -6.427  -2.446  -0.979
  462    H    SER  60           HN       SER  60  -3.679  -6.249  -4.257
  463    HA   SER  60           HA       SER  60  -2.852  -8.479  -2.540
  464   1HB   SER  60          HB2       SER  60  -3.016  -8.527  -5.548
  465   2HB   SER  60          HB1       SER  60  -3.240  -9.860  -4.421
  466    HG   SER  60           HG       SER  60  -5.222  -8.984  -5.240
  467    H    ILE  61           HN       ILE  61  -1.071  -6.046  -3.888
  468    HA   ILE  61           HA       ILE  61   1.093  -7.617  -5.008
  469    HB   ILE  61           HB       ILE  61   0.310  -5.081  -5.365
  470   1HG1  ILE  61          HG12      ILE  61   1.996  -6.372  -6.676
  471   2HG1  ILE  61          HG11      ILE  61   2.298  -4.651  -6.583
  472   1HG2  ILE  61          HG21      ILE  61   2.569  -4.754  -3.392
  473   2HG2  ILE  61          HG22      ILE  61   0.889  -4.257  -3.184
  474   3HG2  ILE  61          HG23      ILE  61   1.885  -3.490  -4.403
  475   1HD1  ILE  61          HD11      ILE  61   4.326  -6.093  -6.226
  476   2HD1  ILE  61          HD12      ILE  61   3.582  -6.667  -4.734
  477   3HD1  ILE  61          HD13      ILE  61   3.992  -4.960  -4.916
  478    H    LEU  62           HN       LEU  62   1.095  -5.552  -2.067
  479    HA   LEU  62           HA       LEU  62   3.508  -6.400  -0.983
  480   1HB   LEU  62          HB2       LEU  62   1.005  -5.834   0.586
  481   2HB   LEU  62          HB1       LEU  62   2.661  -5.759   1.195
  482    HG   LEU  62           HG       LEU  62   1.592  -4.107  -1.094
  483   1HD1  LEU  62          HD11      LEU  62   1.713  -2.210   0.477
  484   2HD1  LEU  62          HD12      LEU  62   2.208  -3.314   1.761
  485   3HD1  LEU  62          HD13      LEU  62   0.596  -3.445   1.057
  486   1HD2  LEU  62          HD21      LEU  62   4.288  -4.396   0.162
  487   2HD2  LEU  62          HD22      LEU  62   3.808  -2.808  -0.431
  488   3HD2  LEU  62          HD23      LEU  62   3.858  -4.181  -1.538
  489    H    LEU  63           HN       LEU  63   0.790  -8.377  -1.466
  490    HA   LEU  63           HA       LEU  63   1.332 -10.238   0.680
  491   1HB   LEU  63          HB2       LEU  63  -0.401 -10.283  -1.784
  492   2HB   LEU  63          HB1       LEU  63  -0.332 -11.628  -0.643
  493    HG   LEU  63           HG       LEU  63  -0.895 -10.007   1.183
  494   1HD1  LEU  63          HD11      LEU  63  -2.114  -7.895   0.235
  495   2HD1  LEU  63          HD12      LEU  63  -1.031  -8.131  -1.139
  496   3HD1  LEU  63          HD13      LEU  63  -0.371  -7.875   0.477
  497   1HD2  LEU  63          HD21      LEU  63  -2.860 -10.326  -1.095
  498   2HD2  LEU  63          HD22      LEU  63  -3.312  -9.824   0.534
  499   3HD2  LEU  63          HD23      LEU  63  -2.635 -11.429   0.261
  500    H    GLU  64           HN       GLU  64   1.663 -10.544  -2.910
  501    HA   GLU  64           HA       GLU  64   3.753 -12.657  -2.387
  502   1HB   GLU  64          HB2       GLU  64   1.587 -12.642  -4.496
  503   2HB   GLU  64          HB1       GLU  64   2.849 -13.865  -4.335
  504   1HG   GLU  64          HG2       GLU  64   0.910 -13.184  -2.109
  505   2HG   GLU  64          HG1       GLU  64   0.630 -14.484  -3.269
  506    H    GLU  65           HN       GLU  65   2.444 -10.722  -5.115
  507    HA   GLU  65           HA       GLU  65   4.563 -10.948  -6.852
  508   1HB   GLU  65          HB2       GLU  65   3.264  -8.279  -6.371
  509   2HB   GLU  65          HB1       GLU  65   3.865  -8.930  -7.893
  510   1HG   GLU  65          HG2       GLU  65   2.129 -10.783  -7.634
  511   2HG   GLU  65          HG1       GLU  65   1.431  -9.818  -6.333
  512    H    VAL  66           HN       VAL  66   4.697  -9.545  -3.801
  513    HA   VAL  66           HA       VAL  66   7.531  -8.810  -4.236
  514    HB   VAL  66           HB       VAL  66   5.947  -6.843  -4.721
  515   1HG1  VAL  66          HG11      VAL  66   4.883  -5.735  -2.930
  516   2HG1  VAL  66          HG12      VAL  66   5.819  -6.617  -1.725
  517   3HG1  VAL  66          HG13      VAL  66   4.572  -7.442  -2.647
  518   1HG2  VAL  66          HG21      VAL  66   8.325  -6.846  -2.896
  519   2HG2  VAL  66          HG22      VAL  66   7.447  -5.334  -3.094
  520   3HG2  VAL  66          HG23      VAL  66   8.146  -6.132  -4.497
  521    H    SER  67           HN       SER  67   8.731  -9.281  -2.399
  522    HA   SER  67           HA       SER  67   7.340 -10.452  -0.122
  523   1HB   SER  67          HB2       SER  67  10.231  -9.977  -0.825
  524   2HB   SER  67          HB1       SER  67   9.786 -10.484   0.803
  525    HG   SER  67           HG       SER  67   9.987 -12.370  -0.209
  526    HA   PRO  68           HA       PRO  68   6.903  -6.736   2.239
  527   1HB   PRO  68          HB2       PRO  68   7.741  -7.770   4.783
  528   2HB   PRO  68          HB1       PRO  68   6.081  -7.609   4.184
  529   1HG   PRO  68          HG2       PRO  68   7.707 -10.048   4.440
  530   2HG   PRO  68          HG1       PRO  68   5.971  -9.903   4.124
  531   1HD   PRO  68          HD2       PRO  68   7.946 -10.672   2.238
  532   2HD   PRO  68          HD1       PRO  68   6.269 -10.214   1.876
  533    H    GLU  69           HN       GLU  69   9.909  -8.433   2.064
  534    HA   GLU  69           HA       GLU  69  11.417  -6.311   3.447
  535   1HB   GLU  69          HB2       GLU  69  12.924  -8.294   1.794
  536   2HB   GLU  69          HB1       GLU  69  13.217  -7.748   3.443
  537   1HG   GLU  69          HG2       GLU  69  11.027  -9.093   3.996
  538   2HG   GLU  69          HG1       GLU  69  11.356  -9.902   2.462
  539    H    LEU  70           HN       LEU  70  11.292  -7.586   0.090
  540    HA   LEU  70           HA       LEU  70  12.920  -5.644  -1.127
  541   1HB   LEU  70          HB2       LEU  70  12.152  -7.431  -2.495
  542   2HB   LEU  70          HB1       LEU  70  10.473  -7.157  -2.053
  543    HG   LEU  70           HG       LEU  70  10.489  -5.021  -3.317
  544   1HD1  LEU  70          HD11      LEU  70  12.484  -4.623  -4.816
  545   2HD1  LEU  70          HD12      LEU  70  13.340  -5.866  -3.906
  546   3HD1  LEU  70          HD13      LEU  70  12.808  -4.395  -3.103
  547   1HD2  LEU  70          HD21      LEU  70  10.076  -7.397  -4.357
  548   2HD2  LEU  70          HD22      LEU  70  11.624  -7.131  -5.155
  549   3HD2  LEU  70          HD23      LEU  70  10.286  -6.016  -5.434
  550    H    VAL  71           HN       VAL  71   9.593  -5.513  -0.037
  551    HA   VAL  71           HA       VAL  71   8.764  -3.067  -1.164
  552    HB   VAL  71           HB       VAL  71   8.124  -4.318   1.518
  553   1HG1  VAL  71          HG11      VAL  71   6.001  -2.887   1.228
  554   2HG1  VAL  71          HG12      VAL  71   6.939  -1.953   0.062
  555   3HG1  VAL  71          HG13      VAL  71   7.469  -2.058   1.741
  556   1HG2  VAL  71          HG21      VAL  71   6.356  -5.402   0.423
  557   2HG2  VAL  71          HG22      VAL  71   7.636  -5.479  -0.782
  558   3HG2  VAL  71          HG23      VAL  71   6.361  -4.270  -0.928
  559    H    CYS  72           HN       CYS  72   9.970  -3.505   2.186
  560    HA   CYS  72           HA       CYS  72  10.325  -0.836   2.891
  561   1HB   CYS  72          HB2       CYS  72  10.880  -2.712   4.417
  562   2HB   CYS  72          HB1       CYS  72  12.348  -3.019   3.484
  563    H    SER  73           HN       SER  73  12.021  -2.585   0.454
  564    HA   SER  73           HA       SER  73  14.163  -0.564   0.230
  565   1HB   SER  73          HB2       SER  73  14.278  -3.150  -0.341
  566   2HB   SER  73          HB1       SER  73  13.618  -2.628  -1.885
  567    HG   SER  73           HG       SER  73  15.369  -1.093  -1.949
  568    H    MET  74           HN       MET  74  11.527  -1.799  -1.919
  569    HA   MET  74           HA       MET  74  11.672   0.256  -3.847
  570   1HB   MET  74          HB2       MET  74   9.293  -1.282  -2.769
  571   2HB   MET  74          HB1       MET  74   9.142  -0.130  -4.092
  572   1HG   MET  74          HG2       MET  74  11.106  -1.512  -5.168
  573   2HG   MET  74          HG1       MET  74  10.592  -2.765  -4.038
  574   1HE   MET  74          HE1       MET  74   8.330  -3.264  -3.563
  575   2HE   MET  74          HE2       MET  74   7.224  -3.796  -4.831
  576   3HE   MET  74          HE3       MET  74   7.068  -2.175  -4.155
  577    H    LEU  75           HN       LEU  75  10.066   0.262  -0.672
  578    HA   LEU  75           HA       LEU  75   8.764   2.793  -0.964
  579   1HB   LEU  75          HB2       LEU  75   9.879   1.523   1.560
  580   2HB   LEU  75          HB1       LEU  75   8.706   2.836   1.504
  581    HG   LEU  75           HG       LEU  75   8.287   0.037   0.408
  582   1HD1  LEU  75          HD11      LEU  75   6.488   0.065   2.241
  583   2HD1  LEU  75          HD12      LEU  75   7.330   1.472   2.888
  584   3HD1  LEU  75          HD13      LEU  75   8.161  -0.079   2.781
  585   1HD2  LEU  75          HD21      LEU  75   6.941   1.361  -0.975
  586   2HD2  LEU  75          HD22      LEU  75   6.661   2.571   0.279
  587   3HD2  LEU  75          HD23      LEU  75   5.835   1.015   0.351
  588    H    HIS  76           HN       HIS  76  11.980   2.095  -1.156
  589    HA   HIS  76           HA       HIS  76  13.943   3.334  -0.852
  590   1HB   HIS  76          HB2       HIS  76  11.924   4.899  -2.201
  591   2HB   HIS  76          HB1       HIS  76  12.896   5.994  -1.229
  592    HD1  HIS  76           HD1      HIS  76  15.495   6.052  -1.755
  593    HD2  HIS  76           HD2      HIS  76  13.221   3.831  -4.452
  594    HE1  HIS  76           HE1      HIS  76  16.968   5.655  -3.776
  595    H    LEU  77           HN       LEU  77  12.612   2.717   1.540
  596    HA   LEU  77           HA       LEU  77  12.743   5.137   3.200
  597   1HB   LEU  77          HB2       LEU  77  10.915   3.571   3.598
  598   2HB   LEU  77          HB1       LEU  77  12.052   2.237   3.791
  599    HG   LEU  77           HG       LEU  77  12.961   3.225   5.787
  600   1HD1  LEU  77          HD11      LEU  77  11.668   5.343   6.656
  601   2HD1  LEU  77          HD12      LEU  77  11.261   5.568   4.952
  602   3HD1  LEU  77          HD13      LEU  77  12.948   5.552   5.463
  603   1HD2  LEU  77          HD21      LEU  77  10.848   3.250   7.183
  604   2HD2  LEU  77          HD22      LEU  77  11.004   1.856   6.110
  605   3HD2  LEU  77          HD23      LEU  77   9.938   3.190   5.673
  606    H    CYS  78           HN       CYS  78  14.764   2.609   2.126
  607    HA   CYS  78           HA       CYS  78  16.909   3.493   3.960
  608   1HB   CYS  78          HB2       CYS  78  15.589   0.819   4.060
  609   2HB   CYS  78          HB1       CYS  78  17.349   0.820   4.169
  610    H    SER  79           HN       SER  79  16.003   1.187   1.382
  611    HA   SER  79           HA       SER  79  18.690   0.990   0.344
  612   1HB   SER  79          HB2       SER  79  16.002   0.357  -0.894
  613   2HB   SER  79          HB1       SER  79  17.547  -0.015  -1.656
  614    HG   SER  79           HG       SER  79  16.320  -1.565  -0.070
  615    H    GLY  80           HN       GLY  80  19.419   3.151   0.036
  616   1HA   GLY  80          HA2       GLY  80  17.920   4.948  -1.752
  617   2HA   GLY  80          HA1       GLY  80  19.479   5.292  -0.998
  618    H    LEU  81           HN       LEU  81  20.283   2.520  -1.946
  619    HA   LEU  81           HA       LEU  81  20.824   3.135  -4.807
  620   1HB   LEU  81          HB2       LEU  81  23.013   1.811  -4.341
  621   2HB   LEU  81          HB1       LEU  81  22.939   3.488  -3.823
  622    HG   LEU  81           HG       LEU  81  23.901   1.913  -2.112
  623   1HD1  LEU  81          HD11      LEU  81  21.495   2.864  -0.689
  624   2HD1  LEU  81          HD12      LEU  81  22.254   4.094  -1.696
  625   3HD1  LEU  81          HD13      LEU  81  23.191   3.272  -0.455
  626   1HD2  LEU  81          HD21      LEU  81  22.555   0.299  -0.992
  627   2HD2  LEU  81          HD22      LEU  81  22.247   0.040  -2.704
  628   3HD2  LEU  81          HD23      LEU  81  21.071   0.906  -1.718
  629    H    VAL  82           HN       VAL  82  21.879   0.833  -5.642
  630    HA   VAL  82           HA       VAL  82  19.646  -1.006  -5.295
  631    HB   VAL  82           HB       VAL  82  21.165  -2.503  -6.813
  632   1HG1  VAL  82          HG11      VAL  82  20.097   0.153  -7.819
  633   2HG1  VAL  82          HG12      VAL  82  19.134  -1.303  -7.560
  634   3HG1  VAL  82          HG13      VAL  82  20.392  -1.284  -8.798
  635   1HG2  VAL  82          HG21      VAL  82  22.884  -1.306  -8.022
  636   2HG2  VAL  82          HG22      VAL  82  23.192  -1.065  -6.303
  637   3HG2  VAL  82          HG23      VAL  82  22.440   0.216  -7.252
  638    HA   PRO  83           HA       PRO  83  21.375  -2.944  -1.705
  639   1HB   PRO  83          HB2       PRO  83  20.422  -5.544  -2.767
  640   2HB   PRO  83          HB1       PRO  83  20.035  -4.740  -1.236
  641   1HG   PRO  83          HG2       PRO  83  18.328  -4.856  -3.458
  642   2HG   PRO  83          HG1       PRO  83  18.193  -3.708  -2.119
  643   1HD   PRO  83          HD2       PRO  83  19.002  -3.171  -4.888
  644   2HD   PRO  83          HD1       PRO  83  18.644  -2.017  -3.577
  645    H    ARG  84           HN       ARG  84  23.509  -3.521  -1.454
  646    HA   ARG  84           HA       ARG  84  25.026  -4.496  -3.764
  647   1HB   ARG  84          HB2       ARG  84  25.942  -4.062  -0.905
  648   2HB   ARG  84          HB1       ARG  84  26.980  -4.257  -2.313
  649   1HG   ARG  84          HG2       ARG  84  24.926  -2.044  -2.196
  650   2HG   ARG  84          HG1       ARG  84  26.513  -1.845  -1.461
  651   1HD   ARG  84          HD2       ARG  84  25.942  -2.459  -4.376
  652   2HD   ARG  84          HD1       ARG  84  26.583  -0.956  -3.721
  653    HE   ARG  84           HE       ARG  84  28.411  -2.851  -2.882
  654   1HH1  ARG  84          HH21      ARG  84  26.961  -1.936  -5.873
  655   2HH1  ARG  84          HH22      ARG  84  28.332  -2.389  -6.829
  656   1HH2  ARG  84          HH11      ARG  84  30.209  -3.450  -4.114
  657   2HH2  ARG  84          HH12      ARG  84  30.171  -3.246  -5.834
  Start of MODEL   17
    1   1H    SER   1           HT1      SER   1  23.976   3.503  12.345
    2   2H    SER   1           HT2      SER   1  24.178   1.847  12.024
    3   3H    SER   1           HT3      SER   1  24.856   2.532  13.423
    4    HA   SER   1           HA       SER   1  23.014   1.577  14.333
    5   1HB   SER   1          HB2       SER   1  21.340   3.336  14.677
    6   2HB   SER   1          HB1       SER   1  22.958   4.029  14.726
    7    HG   SER   1           HG       SER   1  22.265   4.079  12.221
    8    H    ASP   2           HN       ASP   2  22.777  -0.090  12.523
    9    HA   ASP   2           HA       ASP   2  20.798   0.375  10.458
   10   1HB   ASP   2          HB2       ASP   2  21.857  -2.237  11.585
   11   2HB   ASP   2          HB1       ASP   2  20.949  -2.057  10.083
   12    H    VAL   3           HN       VAL   3  19.689   1.203  12.877
   13    HA   VAL   3           HA       VAL   3  18.005  -0.902  13.985
   14    HB   VAL   3           HB       VAL   3  17.979   2.086  14.314
   15   1HG1  VAL   3          HG11      VAL   3  16.276  -0.077  15.550
   16   2HG1  VAL   3          HG12      VAL   3  15.745   1.420  14.783
   17   3HG1  VAL   3          HG13      VAL   3  16.533   1.469  16.359
   18   1HG2  VAL   3          HG21      VAL   3  19.946   0.910  15.250
   19   2HG2  VAL   3          HG22      VAL   3  18.864  -0.148  16.157
   20   3HG2  VAL   3          HG23      VAL   3  18.926   1.576  16.526
   21    H    TYR   4           HN       TYR   4  17.508   1.900  11.846
   22    HA   TYR   4           HA       TYR   4  14.697   1.391  11.506
   23   1HB   TYR   4          HB2       TYR   4  16.735   3.159  10.217
   24   2HB   TYR   4          HB1       TYR   4  15.238   2.875   9.330
   25    HD1  TYR   4           HD1      TYR   4  15.570   2.930  13.044
   26    HD2  TYR   4           HD2      TYR   4  14.230   5.039   9.545
   27    HE1  TYR   4           HE1      TYR   4  14.391   4.550  14.481
   28    HE2  TYR   4           HE2      TYR   4  13.044   6.667  10.988
   29    HH   TYR   4           HH       TYR   4  13.492   6.739  14.435
   30    H    CYS   5           HN       CYS   5  17.436   0.840   9.251
   31    HA   CYS   5           HA       CYS   5  15.992  -0.503   7.254
   32   1HB   CYS   5          HB2       CYS   5  18.515   0.098   7.323
   33   2HB   CYS   5          HB1       CYS   5  18.725  -1.464   8.114
   34    H    GLU   6           HN       GLU   6  17.402  -1.857  10.237
   35    HA   GLU   6           HA       GLU   6  16.533  -4.557   9.689
   36   1HB   GLU   6          HB2       GLU   6  17.379  -3.159  12.237
   37   2HB   GLU   6          HB1       GLU   6  16.988  -4.877  12.162
   38   1HG   GLU   6          HG2       GLU   6  18.743  -5.245  10.505
   39   2HG   GLU   6          HG1       GLU   6  19.097  -3.517  10.461
   40    H    VAL   7           HN       VAL   7  15.351  -2.298  12.225
   41    HA   VAL   7           HA       VAL   7  13.052  -3.773  12.876
   42    HB   VAL   7           HB       VAL   7  14.115  -1.519  13.869
   43   1HG1  VAL   7          HG11      VAL   7  13.061   0.482  13.309
   44   2HG1  VAL   7          HG12      VAL   7  11.667  -0.329  12.594
   45   3HG1  VAL   7          HG13      VAL   7  13.204  -0.305  11.740
   46   1HG2  VAL   7          HG21      VAL   7  11.803  -1.130  14.997
   47   2HG2  VAL   7          HG22      VAL   7  12.577  -2.700  15.202
   48   3HG2  VAL   7          HG23      VAL   7  11.274  -2.509  14.033
   49    H    CYS   8           HN       CYS   8  13.650  -1.688  10.133
   50    HA   CYS   8           HA       CYS   8  10.899  -1.389   9.311
   51   1HB   CYS   8          HB2       CYS   8  12.545   0.151   8.453
   52   2HB   CYS   8          HB1       CYS   8  13.515  -1.170   7.802
   53    H    GLU   9           HN       GLU   9  13.297  -3.894   8.901
   54    HA   GLU   9           HA       GLU   9  11.738  -5.227   6.756
   55   1HB   GLU   9          HB2       GLU   9  14.287  -5.411   6.876
   56   2HB   GLU   9          HB1       GLU   9  14.058  -6.472   8.276
   57   1HG   GLU   9          HG2       GLU   9  12.666  -7.971   6.911
   58   2HG   GLU   9          HG1       GLU   9  12.890  -6.913   5.518
   59    H    PHE  10           HN       PHE  10  12.310  -5.632  10.224
   60    HA   PHE  10           HA       PHE  10  10.800  -8.115  10.377
   61   1HB   PHE  10          HB2       PHE  10  12.475  -7.730  12.056
   62   2HB   PHE  10          HB1       PHE  10  11.788  -6.161  12.470
   63    HD1  PHE  10           HD1      PHE  10   9.784  -5.976  13.828
   64    HD2  PHE  10           HD2      PHE  10  11.354  -9.820  12.732
   65    HE1  PHE  10           HE1      PHE  10   8.308  -7.053  15.503
   66    HE2  PHE  10           HE2      PHE  10   9.878 -10.899  14.408
   67    HZ   PHE  10           HZ       PHE  10   8.355  -9.515  15.793
   68    H    LEU  11           HN       LEU  11   9.928  -4.780  10.234
   69    HA   LEU  11           HA       LEU  11   7.343  -5.209  11.608
   70   1HB   LEU  11          HB2       LEU  11   8.633  -2.811  10.298
   71   2HB   LEU  11          HB1       LEU  11   6.980  -2.777  10.901
   72    HG   LEU  11           HG       LEU  11   9.322  -3.625  12.623
   73   1HD1  LEU  11          HD11      LEU  11   9.701  -1.324  11.807
   74   2HD1  LEU  11          HD12      LEU  11   9.325  -1.329  13.530
   75   3HD1  LEU  11          HD13      LEU  11   8.092  -0.864  12.360
   76   1HD2  LEU  11          HD21      LEU  11   7.601  -2.697  14.393
   77   2HD2  LEU  11          HD22      LEU  11   7.356  -4.303  13.720
   78   3HD2  LEU  11          HD23      LEU  11   6.420  -2.941  13.109
   79    H    VAL  12           HN       VAL  12   8.510  -4.551   8.291
   80    HA   VAL  12           HA       VAL  12   5.838  -4.500   7.200
   81    HB   VAL  12           HB       VAL  12   6.922  -4.556   5.028
   82   1HG1  VAL  12          HG11      VAL  12   6.930  -2.413   6.113
   83   2HG1  VAL  12          HG12      VAL  12   8.525  -2.624   5.391
   84   3HG1  VAL  12          HG13      VAL  12   8.302  -2.867   7.124
   85   1HG2  VAL  12          HG21      VAL  12   9.260  -5.529   6.649
   86   2HG2  VAL  12          HG22      VAL  12   9.558  -4.621   5.165
   87   3HG2  VAL  12          HG23      VAL  12   8.641  -6.119   5.109
   88    H    LYS  13           HN       LYS  13   8.075  -7.052   7.961
   89    HA   LYS  13           HA       LYS  13   6.696  -9.079   6.320
   90   1HB   LYS  13          HB2       LYS  13   9.105  -9.193   6.702
   91   2HB   LYS  13          HB1       LYS  13   8.828  -9.332   8.434
   92   1HG   LYS  13          HG2       LYS  13   7.224 -11.371   7.218
   93   2HG   LYS  13          HG1       LYS  13   8.779 -11.430   6.401
   94   1HD   LYS  13          HD2       LYS  13   9.048 -12.881   8.239
   95   2HD   LYS  13          HD1       LYS  13   9.817 -11.387   8.772
   96   1HE   LYS  13          HE2       LYS  13   8.362 -12.268  10.544
   97   2HE   LYS  13          HE1       LYS  13   7.723 -10.742   9.937
   98   1HZ   LYS  13          HZ1       LYS  13   6.420 -13.177  10.050
   99   2HZ   LYS  13          HZ2       LYS  13   6.731 -12.900   8.402
  100   3HZ   LYS  13          HZ3       LYS  13   5.871 -11.752   9.312
  101    H    GLU  14           HN       GLU  14   6.969  -8.284   9.801
  102    HA   GLU  14           HA       GLU  14   5.291 -10.446  10.683
  103   1HB   GLU  14          HB2       GLU  14   6.836  -8.996  12.119
  104   2HB   GLU  14          HB1       GLU  14   5.582  -7.759  12.054
  105   1HG   GLU  14          HG2       GLU  14   5.033 -10.587  12.987
  106   2HG   GLU  14          HG1       GLU  14   5.504  -9.294  14.086
  107    H    VAL  15           HN       VAL  15   4.585  -7.003  10.083
  108    HA   VAL  15           HA       VAL  15   1.817  -7.092  10.616
  109    HB   VAL  15           HB       VAL  15   3.216  -5.034  10.103
  110   1HG1  VAL  15          HG11      VAL  15   3.602  -4.407   7.835
  111   2HG1  VAL  15          HG12      VAL  15   2.598  -5.720   7.224
  112   3HG1  VAL  15          HG13      VAL  15   4.155  -6.076   7.975
  113   1HG2  VAL  15          HG21      VAL  15   1.301  -3.940   8.789
  114   2HG2  VAL  15          HG22      VAL  15   0.869  -4.720  10.309
  115   3HG2  VAL  15          HG23      VAL  15   0.546  -5.533   8.780
  116    H    THR  16           HN       THR  16   3.570  -7.774   7.585
  117    HA   THR  16           HA       THR  16   1.414  -8.302   5.890
  118    HB   THR  16           HB       THR  16   3.330 -10.357   5.376
  119    HG1  THR  16           HG1      THR  16   4.882  -8.183   5.676
  120   1HG2  THR  16          HG21      THR  16   2.403  -9.034   3.603
  121   2HG2  THR  16          HG22      THR  16   4.141  -8.681   3.654
  122   3HG2  THR  16          HG23      THR  16   2.985  -7.534   4.341
  123    H    LYS  17           HN       LYS  17   3.028 -10.643   8.069
  124    HA   LYS  17           HA       LYS  17   1.524 -12.918   7.616
  125   1HB   LYS  17          HB2       LYS  17   3.040 -11.819   9.876
  126   2HB   LYS  17          HB1       LYS  17   1.715 -12.834  10.437
  127   1HG   LYS  17          HG2       LYS  17   2.509 -14.668   8.983
  128   2HG   LYS  17          HG1       LYS  17   3.830 -13.646   8.414
  129   1HD   LYS  17          HD2       LYS  17   4.723 -13.487  10.692
  130   2HD   LYS  17          HD1       LYS  17   3.376 -14.449  11.304
  131   1HE   LYS  17          HE2       LYS  17   5.367 -15.416   9.231
  132   2HE   LYS  17          HE1       LYS  17   5.448 -15.801  10.951
  133   1HZ   LYS  17          HZ1       LYS  17   3.222 -16.468   9.103
  134   2HZ   LYS  17          HZ2       LYS  17   3.225 -16.775  10.774
  135   3HZ   LYS  17          HZ3       LYS  17   4.341 -17.559   9.762
  136    H    LEU  18           HN       LEU  18   0.523 -10.072   9.506
  137    HA   LEU  18           HA       LEU  18  -2.132 -11.311   9.993
  138   1HB   LEU  18          HB2       LEU  18  -2.251  -9.888  11.771
  139   2HB   LEU  18          HB1       LEU  18  -0.550  -9.572  11.462
  140    HG   LEU  18           HG       LEU  18  -1.313  -7.704   9.894
  141   1HD1  LEU  18          HD11      LEU  18  -3.856  -7.256  11.229
  142   2HD1  LEU  18          HD12      LEU  18  -3.877  -8.838  10.450
  143   3HD1  LEU  18          HD13      LEU  18  -3.517  -7.393   9.505
  144   1HD2  LEU  18          HD21      LEU  18  -2.027  -7.517  12.837
  145   2HD2  LEU  18          HD22      LEU  18  -1.675  -6.152  11.776
  146   3HD2  LEU  18          HD23      LEU  18  -0.412  -7.323  12.157
  147    H    ILE  19           HN       ILE  19  -0.686  -8.704   8.087
  148    HA   ILE  19           HA       ILE  19  -3.163  -7.704   7.035
  149    HB   ILE  19           HB       ILE  19  -0.304  -7.232   6.817
  150   1HG1  ILE  19          HG12      ILE  19  -2.557  -5.372   6.074
  151   2HG1  ILE  19          HG11      ILE  19  -2.063  -5.683   7.738
  152   1HG2  ILE  19          HG21      ILE  19  -0.318  -6.200   4.541
  153   2HG2  ILE  19          HG22      ILE  19  -1.880  -6.962   4.250
  154   3HG2  ILE  19          HG23      ILE  19  -0.446  -7.956   4.514
  155   1HD1  ILE  19          HD11      ILE  19  -0.763  -4.040   5.681
  156   2HD1  ILE  19          HD12      ILE  19   0.366  -5.135   6.490
  157   3HD1  ILE  19          HD13      ILE  19  -0.593  -3.986   7.433
  158    H    ASP  20           HN       ASP  20  -1.214 -10.446   6.310
  159    HA   ASP  20           HA       ASP  20  -1.313 -10.987   3.669
  160   1HB   ASP  20          HB2       ASP  20  -2.150 -12.817   5.930
  161   2HB   ASP  20          HB1       ASP  20  -1.965 -13.388   4.271
  162    H    ASN  21           HN       ASN  21  -4.201 -10.923   5.744
  163    HA   ASN  21           HA       ASN  21  -5.926 -10.477   3.432
  164   1HB   ASN  21          HB2       ASN  21  -5.911 -13.144   4.860
  165   2HB   ASN  21          HB1       ASN  21  -7.369 -12.545   4.068
  166   1HD2  ASN  21          HD21      ASN  21  -7.069 -11.924   1.673
  167   2HD2  ASN  21          HD22      ASN  21  -5.979 -12.847   0.757
  168    H    ASN  22           HN       ASN  22  -5.205  -9.490   6.281
  169    HA   ASN  22           HA       ASN  22  -7.384  -9.812   8.025
  170   1HB   ASN  22          HB2       ASN  22  -6.818  -7.593   8.937
  171   2HB   ASN  22          HB1       ASN  22  -5.363  -8.538   8.637
  172   1HD2  ASN  22          HD21      ASN  22  -5.280  -8.169   5.748
  173   2HD2  ASN  22          HD22      ASN  22  -4.918  -6.539   5.457
  174    H    LYS  23           HN       LYS  23  -7.060  -7.645   5.233
  175    HA   LYS  23           HA       LYS  23 -10.005  -7.110   5.403
  176   1HB   LYS  23          HB2       LYS  23  -9.361  -5.038   3.950
  177   2HB   LYS  23          HB1       LYS  23  -9.089  -4.983   5.687
  178   1HG   LYS  23          HG2       LYS  23  -7.156  -4.155   4.349
  179   2HG   LYS  23          HG1       LYS  23  -6.751  -5.509   5.392
  180   1HD   LYS  23          HD2       LYS  23  -6.718  -7.045   3.577
  181   2HD   LYS  23          HD1       LYS  23  -7.543  -5.910   2.505
  182   1HE   LYS  23          HE2       LYS  23  -5.598  -4.415   2.621
  183   2HE   LYS  23          HE1       LYS  23  -4.780  -5.577   3.662
  184   1HZ   LYS  23          HZ1       LYS  23  -5.313  -7.199   1.730
  185   2HZ   LYS  23          HZ2       LYS  23  -3.981  -6.152   1.604
  186   3HZ   LYS  23          HZ3       LYS  23  -5.434  -5.783   0.804
  187    H    THR  24           HN       THR  24 -10.843  -6.475   3.109
  188    HA   THR  24           HA       THR  24  -9.690  -8.326   1.055
  189    HB   THR  24           HB       THR  24 -11.983  -8.857   0.363
  190    HG1  THR  24           HG1      THR  24 -13.125  -7.773   2.612
  191   1HG2  THR  24          HG21      THR  24 -11.386  -9.206   3.304
  192   2HG2  THR  24          HG22      THR  24 -11.016 -10.328   1.993
  193   3HG2  THR  24          HG23      THR  24 -12.691 -10.050   2.468
  194    H    GLU  25           HN       GLU  25 -11.325  -7.649  -1.051
  195    HA   GLU  25           HA       GLU  25 -10.508  -4.816  -1.527
  196   1HB   GLU  25          HB2       GLU  25 -11.242  -5.499  -3.953
  197   2HB   GLU  25          HB1       GLU  25  -9.721  -6.113  -3.307
  198   1HG   GLU  25          HG2       GLU  25 -12.291  -7.661  -2.972
  199   2HG   GLU  25          HG1       GLU  25 -11.313  -7.815  -4.430
  200    H    LYS  26           HN       LYS  26 -13.235  -6.417  -0.492
  201    HA   LYS  26           HA       LYS  26 -15.191  -4.865  -2.039
  202   1HB   LYS  26          HB2       LYS  26 -15.844  -6.265   0.553
  203   2HB   LYS  26          HB1       LYS  26 -16.829  -6.094  -0.899
  204   1HG   LYS  26          HG2       LYS  26 -14.368  -7.834  -0.616
  205   2HG   LYS  26          HG1       LYS  26 -16.038  -8.390  -0.690
  206   1HD   LYS  26          HD2       LYS  26 -16.243  -7.310  -2.943
  207   2HD   LYS  26          HD1       LYS  26 -14.516  -6.950  -2.880
  208   1HE   LYS  26          HE2       LYS  26 -13.964  -9.287  -2.738
  209   2HE   LYS  26          HE1       LYS  26 -15.664  -9.724  -2.571
  210   1HZ   LYS  26          HZ1       LYS  26 -16.024  -8.714  -4.794
  211   2HZ   LYS  26          HZ2       LYS  26 -15.022 -10.087  -4.820
  212   3HZ   LYS  26          HZ3       LYS  26 -14.346  -8.533  -4.947
  213    H    GLU  27           HN       GLU  27 -13.601  -4.816   1.078
  214    HA   GLU  27           HA       GLU  27 -15.098  -2.591   2.147
  215   1HB   GLU  27          HB2       GLU  27 -13.837  -4.259   3.535
  216   2HB   GLU  27          HB1       GLU  27 -12.334  -3.587   2.907
  217   1HG   GLU  27          HG2       GLU  27 -12.798  -2.585   5.069
  218   2HG   GLU  27          HG1       GLU  27 -13.002  -1.358   3.821
  219    H    ILE  28           HN       ILE  28 -12.474  -2.938  -0.072
  220    HA   ILE  28           HA       ILE  28 -11.514  -0.177   0.279
  221    HB   ILE  28           HB       ILE  28 -10.809  -2.269  -1.792
  222   1HG1  ILE  28          HG12      ILE  28 -10.276  -3.098   0.428
  223   2HG1  ILE  28          HG11      ILE  28  -8.783  -2.619  -0.368
  224   1HG2  ILE  28          HG21      ILE  28 -10.222  -0.067  -2.537
  225   2HG2  ILE  28          HG22      ILE  28  -8.748  -0.847  -1.986
  226   3HG2  ILE  28          HG23      ILE  28  -9.547   0.339  -0.961
  227   1HD1  ILE  28          HD11      ILE  28  -9.229  -0.314   0.836
  228   2HD1  ILE  28          HD12      ILE  28  -8.525  -1.656   1.735
  229   3HD1  ILE  28          HD13      ILE  28 -10.242  -1.295   1.892
  230    H    LEU  29           HN       LEU  29 -12.352  -1.921  -2.704
  231    HA   LEU  29           HA       LEU  29 -12.859   0.228  -4.326
  232   1HB   LEU  29          HB2       LEU  29 -14.561  -2.281  -4.295
  233   2HB   LEU  29          HB1       LEU  29 -14.321  -1.194  -5.664
  234    HG   LEU  29           HG       LEU  29 -12.127  -2.768  -4.279
  235   1HD1  LEU  29          HD11      LEU  29 -13.679  -3.208  -6.835
  236   2HD1  LEU  29          HD12      LEU  29 -13.443  -4.330  -5.495
  237   3HD1  LEU  29          HD13      LEU  29 -12.096  -3.937  -6.564
  238   1HD2  LEU  29          HD21      LEU  29 -11.036  -0.897  -5.182
  239   2HD2  LEU  29          HD22      LEU  29 -12.169  -0.754  -6.528
  240   3HD2  LEU  29          HD23      LEU  29 -10.955  -2.033  -6.527
  241    H    ASP  30           HN       ASP  30 -15.058  -0.993  -1.825
  242    HA   ASP  30           HA       ASP  30 -17.208   0.794  -2.688
  243   1HB   ASP  30          HB2       ASP  30 -18.388   0.104  -0.720
  244   2HB   ASP  30          HB1       ASP  30 -17.552  -1.330  -1.312
  245    H    ALA  31           HN       ALA  31 -14.817   0.795  -0.024
  246    HA   ALA  31           HA       ALA  31 -15.371   3.221   1.204
  247   1HB   ALA  31          HB1       ALA  31 -12.999   3.399   1.702
  248   2HB   ALA  31          HB2       ALA  31 -12.635   2.209   0.450
  249   3HB   ALA  31          HB3       ALA  31 -13.552   1.738   1.881
  250    H    PHE  32           HN       PHE  32 -13.915   2.708  -1.962
  251    HA   PHE  32           HA       PHE  32 -13.210   5.499  -2.331
  252   1HB   PHE  32          HB2       PHE  32 -13.474   3.110  -4.163
  253   2HB   PHE  32          HB1       PHE  32 -13.305   4.724  -4.849
  254    HD1  PHE  32           HD1      PHE  32 -11.654   2.079  -2.878
  255    HD2  PHE  32           HD2      PHE  32 -11.253   6.020  -4.546
  256    HE1  PHE  32           HE1      PHE  32  -9.195   2.000  -2.512
  257    HE2  PHE  32           HE2      PHE  32  -8.806   5.935  -4.166
  258    HZ   PHE  32           HZ       PHE  32  -7.780   3.918  -3.148
  259    H    ASP  33           HN       ASP  33 -16.039   3.471  -3.057
  260    HA   ASP  33           HA       ASP  33 -17.465   5.567  -4.445
  261   1HB   ASP  33          HB2       ASP  33 -18.097   3.173  -4.651
  262   2HB   ASP  33          HB1       ASP  33 -18.552   3.157  -2.946
  263    H    LYS  34           HN       LYS  34 -16.347   5.432  -1.394
  264    HA   LYS  34           HA       LYS  34 -18.614   7.040  -0.242
  265   1HB   LYS  34          HB2       LYS  34 -16.570   5.190   1.013
  266   2HB   LYS  34          HB1       LYS  34 -17.418   6.390   1.979
  267   1HG   LYS  34          HG2       LYS  34 -19.274   5.091   2.103
  268   2HG   LYS  34          HG1       LYS  34 -19.329   4.875   0.355
  269   1HD   LYS  34          HD2       LYS  34 -19.094   2.697   1.363
  270   2HD   LYS  34          HD1       LYS  34 -17.543   3.096   0.637
  271   1HE   LYS  34          HE2       LYS  34 -16.851   2.383   2.739
  272   2HE   LYS  34          HE1       LYS  34 -17.042   4.112   3.031
  273   1HZ   LYS  34          HZ1       LYS  34 -18.168   2.339   4.575
  274   2HZ   LYS  34          HZ2       LYS  34 -19.378   2.386   3.384
  275   3HZ   LYS  34          HZ3       LYS  34 -18.941   3.804   4.213
  276    H    MET  35           HN       MET  35 -15.189   6.581   0.525
  277    HA   MET  35           HA       MET  35 -14.728   9.287   1.290
  278   1HB   MET  35          HB2       MET  35 -13.063   8.039   2.213
  279   2HB   MET  35          HB1       MET  35 -13.230   6.796   0.992
  280   1HG   MET  35          HG2       MET  35 -11.863   8.291  -0.568
  281   2HG   MET  35          HG1       MET  35 -11.579   9.333   0.825
  282   1HE   MET  35          HE1       MET  35 -11.616   5.122   0.946
  283   2HE   MET  35          HE2       MET  35 -10.236   5.146  -0.149
  284   3HE   MET  35          HE3       MET  35 -11.720   5.985  -0.595
  285    H    CYS  36           HN       CYS  36 -13.915   7.562  -1.742
  286    HA   CYS  36           HA       CYS  36 -13.047  10.090  -2.977
  287   1HB   CYS  36          HB2       CYS  36 -11.857   8.077  -3.613
  288   2HB   CYS  36          HB1       CYS  36 -13.351   7.266  -4.056
  289    H    SER  37           HN       SER  37 -15.873   9.404  -1.982
  290    HA   SER  37           HA       SER  37 -17.470   9.677  -4.457
  291   1HB   SER  37          HB2       SER  37 -19.291   9.059  -3.165
  292   2HB   SER  37          HB1       SER  37 -18.008   8.345  -2.194
  293    HG   SER  37           HG       SER  37 -19.527   9.704  -1.030
  294    H    LYS  38           HN       LYS  38 -17.060  11.421  -1.376
  295    HA   LYS  38           HA       LYS  38 -18.477  13.774  -2.096
  296   1HB   LYS  38          HB2       LYS  38 -17.133  14.845  -0.268
  297   2HB   LYS  38          HB1       LYS  38 -17.872  13.318   0.218
  298   1HG   LYS  38          HG2       LYS  38 -15.681  12.181  -0.401
  299   2HG   LYS  38          HG1       LYS  38 -14.986  13.792  -0.577
  300   1HD   LYS  38          HD2       LYS  38 -15.803  14.258   1.796
  301   2HD   LYS  38          HD1       LYS  38 -16.124  12.527   1.921
  302   1HE   LYS  38          HE2       LYS  38 -13.753  12.067   1.336
  303   2HE   LYS  38          HE1       LYS  38 -13.445  13.803   1.300
  304   1HZ   LYS  38          HZ1       LYS  38 -12.837  13.189   3.431
  305   2HZ   LYS  38          HZ2       LYS  38 -14.125  12.094   3.605
  306   3HZ   LYS  38          HZ3       LYS  38 -14.416  13.767   3.653
  307    H    LEU  39           HN       LEU  39 -15.291  12.673  -2.941
  308    HA   LEU  39           HA       LEU  39 -13.859  14.948  -3.468
  309   1HB   LEU  39          HB2       LEU  39 -13.809  12.241  -4.392
  310   2HB   LEU  39          HB1       LEU  39 -13.688  13.226  -5.829
  311    HG   LEU  39           HG       LEU  39 -11.863  14.398  -3.956
  312   1HD1  LEU  39          HD11      LEU  39 -11.404  11.425  -4.124
  313   2HD1  LEU  39          HD12      LEU  39 -12.127  12.211  -2.719
  314   3HD1  LEU  39          HD13      LEU  39 -10.478  12.615  -3.206
  315   1HD2  LEU  39          HD21      LEU  39 -11.243  12.497  -6.223
  316   2HD2  LEU  39          HD22      LEU  39 -10.195  13.762  -5.580
  317   3HD2  LEU  39          HD23      LEU  39 -11.672  14.193  -6.445
  318    HA   PRO  40           HA       PRO  40 -16.200  17.398  -6.363
  319   1HB   PRO  40          HB2       PRO  40 -13.873  18.085  -7.990
  320   2HB   PRO  40          HB1       PRO  40 -14.768  19.118  -6.867
  321   1HG   PRO  40          HG2       PRO  40 -12.155  17.997  -6.478
  322   2HG   PRO  40          HG1       PRO  40 -13.099  18.937  -5.313
  323   1HD   PRO  40          HD2       PRO  40 -12.533  16.099  -5.259
  324   2HD   PRO  40          HD1       PRO  40 -13.441  17.054  -4.070
  325    H    LYS  41           HN       LYS  41 -17.337  16.641  -8.108
  326    HA   LYS  41           HA       LYS  41 -17.156  14.244  -9.343
  327   1HB   LYS  41          HB2       LYS  41 -18.902  15.978  -9.752
  328   2HB   LYS  41          HB1       LYS  41 -17.784  16.769 -10.863
  329   1HG   LYS  41          HG2       LYS  41 -17.691  14.734 -12.231
  330   2HG   LYS  41          HG1       LYS  41 -18.780  13.922 -11.103
  331   1HD   LYS  41          HD2       LYS  41 -20.350  16.003 -11.581
  332   2HD   LYS  41          HD1       LYS  41 -19.371  16.149 -13.042
  333   1HE   LYS  41          HE2       LYS  41 -19.853  13.709 -13.487
  334   2HE   LYS  41          HE1       LYS  41 -21.005  13.771 -12.154
  335   1HZ   LYS  41          HZ1       LYS  41 -21.134  15.723 -14.364
  336   2HZ   LYS  41          HZ2       LYS  41 -22.358  15.257 -13.282
  337   3HZ   LYS  41          HZ3       LYS  41 -21.860  14.197 -14.513
  338    H    SER  42           HN       SER  42 -15.457  17.108 -10.555
  339    HA   SER  42           HA       SER  42 -14.268  16.010 -12.838
  340   1HB   SER  42          HB2       SER  42 -12.944  17.894 -10.867
  341   2HB   SER  42          HB1       SER  42 -12.498  17.680 -12.558
  342    HG   SER  42           HG       SER  42 -14.134  19.423 -11.723
  343    H    LEU  43           HN       LEU  43 -12.636  16.228  -9.653
  344    HA   LEU  43           HA       LEU  43 -10.700  14.210 -10.509
  345   1HB   LEU  43          HB2       LEU  43 -11.112  15.833  -8.007
  346   2HB   LEU  43          HB1       LEU  43 -10.022  14.445  -7.983
  347    HG   LEU  43           HG       LEU  43  -8.839  15.442  -9.975
  348   1HD1  LEU  43          HD11      LEU  43 -10.551  16.909 -10.818
  349   2HD1  LEU  43          HD12      LEU  43  -9.216  17.922 -10.263
  350   3HD1  LEU  43          HD13      LEU  43 -10.667  17.752  -9.272
  351   1HD2  LEU  43          HD21      LEU  43  -7.704  17.199  -8.579
  352   2HD2  LEU  43          HD22      LEU  43  -7.891  15.647  -7.760
  353   3HD2  LEU  43          HD23      LEU  43  -8.974  16.985  -7.372
  354    H    SER  44           HN       SER  44 -13.847  13.950  -9.476
  355    HA   SER  44           HA       SER  44 -13.444  11.612  -7.732
  356   1HB   SER  44          HB2       SER  44 -15.707  11.746  -7.278
  357   2HB   SER  44          HB1       SER  44 -15.500  13.389  -7.869
  358    HG   SER  44           HG       SER  44 -16.072  12.587  -9.959
  359    H    GLU  45           HN       GLU  45 -13.838  12.498 -11.011
  360    HA   GLU  45           HA       GLU  45 -14.561   9.829 -11.933
  361   1HB   GLU  45          HB2       GLU  45 -13.836  12.390 -13.365
  362   2HB   GLU  45          HB1       GLU  45 -14.184  10.884 -14.214
  363   1HG   GLU  45          HG2       GLU  45 -16.090  12.137 -12.223
  364   2HG   GLU  45          HG1       GLU  45 -16.168  12.444 -13.959
  365    H    GLU  46           HN       GLU  46 -11.729  11.948 -11.847
  366    HA   GLU  46           HA       GLU  46 -10.022   9.981 -13.177
  367   1HB   GLU  46          HB2       GLU  46  -9.500  12.618 -11.794
  368   2HB   GLU  46          HB1       GLU  46  -8.188  11.603 -12.394
  369   1HG   GLU  46          HG2       GLU  46  -8.831  13.290 -14.075
  370   2HG   GLU  46          HG1       GLU  46  -9.176  11.660 -14.655
  371    H    CYS  47           HN       CYS  47 -11.127  10.548  -9.980
  372    HA   CYS  47           HA       CYS  47  -8.842   9.321  -8.627
  373   1HB   CYS  47          HB2       CYS  47 -10.009  10.801  -7.233
  374   2HB   CYS  47          HB1       CYS  47 -11.573  10.264  -7.825
  375    H    GLN  48           HN       GLN  48 -12.043   8.322  -9.784
  376    HA   GLN  48           HA       GLN  48 -11.770   5.620  -8.686
  377   1HB   GLN  48          HB2       GLN  48 -13.774   7.014 -10.474
  378   2HB   GLN  48          HB1       GLN  48 -13.829   5.267 -10.236
  379   1HG   GLN  48          HG2       GLN  48 -13.755   7.192  -7.907
  380   2HG   GLN  48          HG1       GLN  48 -15.271   6.689  -8.654
  381   1HE2  GLN  48          HE21      GLN  48 -15.518   5.747  -6.309
  382   2HE2  GLN  48          HE22      GLN  48 -14.937   4.171  -6.068
  383    H    GLU  49           HN       GLU  49 -10.767   7.414 -11.389
  384    HA   GLU  49           HA       GLU  49 -10.659   5.315 -13.318
  385   1HB   GLU  49          HB2       GLU  49 -10.509   7.775 -13.826
  386   2HB   GLU  49          HB1       GLU  49  -8.889   7.764 -13.128
  387   1HG   GLU  49          HG2       GLU  49  -8.645   7.513 -15.506
  388   2HG   GLU  49          HG1       GLU  49  -8.288   5.952 -14.771
  389    H    VAL  50           HN       VAL  50  -8.194   6.749 -11.159
  390    HA   VAL  50           HA       VAL  50  -6.132   4.891 -11.843
  391    HB   VAL  50           HB       VAL  50  -6.489   6.293  -9.185
  392   1HG1  VAL  50          HG11      VAL  50  -4.168   5.006 -10.648
  393   2HG1  VAL  50          HG12      VAL  50  -4.804   4.610  -9.049
  394   3HG1  VAL  50          HG13      VAL  50  -3.939   6.126  -9.301
  395   1HG2  VAL  50          HG21      VAL  50  -6.553   8.022 -10.819
  396   2HG2  VAL  50          HG22      VAL  50  -5.368   7.206 -11.844
  397   3HG2  VAL  50          HG23      VAL  50  -4.862   7.944 -10.325
  398    H    VAL  51           HN       VAL  51  -8.636   4.837  -9.299
  399    HA   VAL  51           HA       VAL  51  -7.878   2.605  -7.789
  400    HB   VAL  51           HB       VAL  51 -10.622   3.406  -8.838
  401   1HG1  VAL  51          HG11      VAL  51 -10.801   1.071  -8.275
  402   2HG1  VAL  51          HG12      VAL  51 -11.479   1.985  -6.928
  403   3HG1  VAL  51          HG13      VAL  51  -9.860   1.302  -6.801
  404   1HG2  VAL  51          HG21      VAL  51  -9.268   4.910  -7.257
  405   2HG2  VAL  51          HG22      VAL  51  -9.493   3.649  -6.046
  406   3HG2  VAL  51          HG23      VAL  51 -10.893   4.477  -6.728
  407    H    ASP  52           HN       ASP  52  -9.786   2.481 -10.838
  408    HA   ASP  52           HA       ASP  52  -9.798  -0.321 -11.152
  409   1HB   ASP  52          HB2       ASP  52  -9.476   1.792 -13.315
  410   2HB   ASP  52          HB1       ASP  52  -9.965   0.119 -13.588
  411    H    THR  53           HN       THR  53  -7.282   2.072 -11.766
  412    HA   THR  53           HA       THR  53  -5.429   0.080 -12.831
  413    HB   THR  53           HB       THR  53  -4.991   2.959 -12.159
  414    HG1  THR  53           HG1      THR  53  -4.887   2.883 -14.584
  415   1HG2  THR  53          HG21      THR  53  -3.268   1.073 -13.773
  416   2HG2  THR  53          HG22      THR  53  -2.908   1.548 -12.116
  417   3HG2  THR  53          HG23      THR  53  -2.910   2.756 -13.397
  418    H    TYR  54           HN       TYR  54  -6.240   1.442  -9.777
  419    HA   TYR  54           HA       TYR  54  -4.056  -0.167  -8.501
  420   1HB   TYR  54          HB2       TYR  54  -5.008   2.609  -7.767
  421   2HB   TYR  54          HB1       TYR  54  -4.058   1.595  -6.683
  422    HD1  TYR  54           HD1      TYR  54  -1.721   1.791  -6.766
  423    HD2  TYR  54           HD2      TYR  54  -4.047   2.786 -10.193
  424    HE1  TYR  54           HE1      TYR  54   0.329   2.583  -7.921
  425    HE2  TYR  54           HE2      TYR  54  -2.043   3.596 -11.372
  426    HH   TYR  54           HH       TYR  54   1.121   3.670  -9.723
  427    H    GLY  55           HN       GLY  55  -5.967  -1.719  -8.451
  428   1HA   GLY  55          HA2       GLY  55  -7.566  -1.237  -5.976
  429   2HA   GLY  55          HA1       GLY  55  -8.385  -1.762  -7.451
  430    H    SER  56           HN       SER  56  -7.541  -3.880  -8.397
  431    HA   SER  56           HA       SER  56  -7.408  -5.827  -6.241
  432   1HB   SER  56          HB2       SER  56  -7.014  -7.405  -8.292
  433   2HB   SER  56          HB1       SER  56  -8.572  -6.605  -8.122
  434    HG   SER  56           HG       SER  56  -7.907  -6.227 -10.186
  435    H    SER  57           HN       SER  57  -5.061  -4.074  -8.031
  436    HA   SER  57           HA       SER  57  -2.906  -6.038  -7.544
  437   1HB   SER  57          HB2       SER  57  -2.878  -3.273  -8.794
  438   2HB   SER  57          HB1       SER  57  -1.438  -4.266  -8.568
  439    HG   SER  57           HG       SER  57  -2.743  -5.921  -9.746
  440    H    ILE  58           HN       ILE  58  -3.049  -2.534  -6.944
  441    HA   ILE  58           HA       ILE  58  -1.245  -2.069  -5.013
  442    HB   ILE  58           HB       ILE  58  -2.969  -0.476  -5.765
  443   1HG1  ILE  58          HG12      ILE  58  -2.578  -0.787  -2.776
  444   2HG1  ILE  58          HG11      ILE  58  -1.683   0.269  -3.878
  445   1HG2  ILE  58          HG21      ILE  58  -4.847  -2.245  -5.255
  446   2HG2  ILE  58          HG22      ILE  58  -5.183  -0.522  -5.096
  447   3HG2  ILE  58          HG23      ILE  58  -4.828  -1.467  -3.666
  448   1HD1  ILE  58          HD11      ILE  58  -3.998   1.367  -4.361
  449   2HD1  ILE  58          HD12      ILE  58  -3.215   1.735  -2.821
  450   3HD1  ILE  58          HD13      ILE  58  -4.523   0.548  -2.886
  451    H    LEU  59           HN       LEU  59  -4.364  -3.607  -4.296
  452    HA   LEU  59           HA       LEU  59  -3.667  -4.050  -1.510
  453   1HB   LEU  59          HB2       LEU  59  -5.780  -5.596  -3.034
  454   2HB   LEU  59          HB1       LEU  59  -5.711  -5.279  -1.303
  455    HG   LEU  59           HG       LEU  59  -6.022  -3.156  -3.401
  456   1HD1  LEU  59          HD11      LEU  59  -7.969  -4.574  -3.440
  457   2HD1  LEU  59          HD12      LEU  59  -8.380  -3.057  -2.633
  458   3HD1  LEU  59          HD13      LEU  59  -8.082  -4.511  -1.677
  459   1HD2  LEU  59          HD21      LEU  59  -6.798  -1.851  -1.339
  460   2HD2  LEU  59          HD22      LEU  59  -5.075  -2.181  -1.449
  461   3HD2  LEU  59          HD23      LEU  59  -6.095  -3.158  -0.389
  462    H    SER  60           HN       SER  60  -3.656  -6.080  -4.451
  463    HA   SER  60           HA       SER  60  -2.596  -8.378  -2.893
  464   1HB   SER  60          HB2       SER  60  -3.145  -8.173  -5.861
  465   2HB   SER  60          HB1       SER  60  -2.879  -9.647  -4.934
  466    HG   SER  60           HG       SER  60  -5.152  -8.373  -5.364
  467    H    ILE  61           HN       ILE  61  -1.219  -5.689  -4.197
  468    HA   ILE  61           HA       ILE  61   1.028  -6.955  -5.550
  469    HB   ILE  61           HB       ILE  61  -0.114  -4.549  -5.814
  470   1HG1  ILE  61          HG12      ILE  61   1.610  -5.572  -7.276
  471   2HG1  ILE  61          HG11      ILE  61   1.774  -3.833  -7.120
  472   1HG2  ILE  61          HG21      ILE  61   1.259  -2.761  -4.914
  473   2HG2  ILE  61          HG22      ILE  61   2.237  -3.918  -4.028
  474   3HG2  ILE  61          HG23      ILE  61   0.530  -3.701  -3.621
  475   1HD1  ILE  61          HD11      ILE  61   3.945  -5.041  -6.959
  476   2HD1  ILE  61          HD12      ILE  61   3.348  -5.861  -5.522
  477   3HD1  ILE  61          HD13      ILE  61   3.573  -4.114  -5.506
  478    H    LEU  62           HN       LEU  62   0.965  -4.927  -2.576
  479    HA   LEU  62           HA       LEU  62   3.570  -5.716  -1.743
  480   1HB   LEU  62          HB2       LEU  62   1.245  -4.827  -0.038
  481   2HB   LEU  62          HB1       LEU  62   2.930  -4.896   0.485
  482    HG   LEU  62           HG       LEU  62   1.926  -3.265  -1.847
  483   1HD1  LEU  62          HD11      LEU  62   1.070  -2.383   0.277
  484   2HD1  LEU  62          HD12      LEU  62   2.306  -1.309  -0.378
  485   3HD1  LEU  62          HD13      LEU  62   2.700  -2.403   0.948
  486   1HD2  LEU  62          HD21      LEU  62   4.127  -3.539  -2.376
  487   2HD2  LEU  62          HD22      LEU  62   4.626  -3.777  -0.699
  488   3HD2  LEU  62          HD23      LEU  62   4.279  -2.155  -1.298
  489    H    LEU  63           HN       LEU  63   0.819  -7.576  -2.016
  490    HA   LEU  63           HA       LEU  63   1.325  -9.313   0.279
  491   1HB   LEU  63          HB2       LEU  63  -0.540  -9.401  -2.092
  492   2HB   LEU  63          HB1       LEU  63  -0.494 -10.663  -0.867
  493    HG   LEU  63           HG       LEU  63  -2.228  -8.727  -0.645
  494   1HD1  LEU  63          HD11      LEU  63  -2.168  -8.897   1.788
  495   2HD1  LEU  63          HD12      LEU  63  -0.499  -9.459   1.726
  496   3HD1  LEU  63          HD13      LEU  63  -1.792 -10.461   1.068
  497   1HD2  LEU  63          HD21      LEU  63  -1.514  -6.777   0.592
  498   2HD2  LEU  63          HD22      LEU  63  -0.593  -6.868  -0.902
  499   3HD2  LEU  63          HD23      LEU  63   0.149  -7.351   0.626
  500    H    GLU  64           HN       GLU  64   1.539  -9.676  -3.312
  501    HA   GLU  64           HA       GLU  64   3.509 -11.893  -2.833
  502   1HB   GLU  64          HB2       GLU  64   1.262 -11.814  -4.852
  503   2HB   GLU  64          HB1       GLU  64   2.491 -13.077  -4.758
  504   1HG   GLU  64          HG2       GLU  64   0.646 -12.349  -2.465
  505   2HG   GLU  64          HG1       GLU  64   0.336 -13.672  -3.591
  506    H    GLU  65           HN       GLU  65   2.239  -9.910  -5.560
  507    HA   GLU  65           HA       GLU  65   4.427 -10.263  -7.259
  508   1HB   GLU  65          HB2       GLU  65   2.958  -7.644  -6.877
  509   2HB   GLU  65          HB1       GLU  65   3.811  -8.167  -8.328
  510   1HG   GLU  65          HG2       GLU  65   1.423  -9.584  -7.118
  511   2HG   GLU  65          HG1       GLU  65   1.346  -8.492  -8.501
  512    H    VAL  66           HN       VAL  66   4.325  -8.857  -4.272
  513    HA   VAL  66           HA       VAL  66   7.127  -7.917  -4.466
  514    HB   VAL  66           HB       VAL  66   4.658  -6.419  -3.720
  515   1HG1  VAL  66          HG11      VAL  66   6.080  -4.723  -2.537
  516   2HG1  VAL  66          HG12      VAL  66   7.356  -5.941  -2.480
  517   3HG1  VAL  66          HG13      VAL  66   5.822  -6.225  -1.654
  518   1HG2  VAL  66          HG21      VAL  66   7.209  -5.621  -5.090
  519   2HG2  VAL  66          HG22      VAL  66   5.757  -4.630  -4.937
  520   3HG2  VAL  66          HG23      VAL  66   5.715  -6.122  -5.884
  521    H    SER  67           HN       SER  67   8.289  -8.420  -2.608
  522    HA   SER  67           HA       SER  67   6.876 -10.047  -0.563
  523   1HB   SER  67          HB2       SER  67   8.811 -11.250  -0.731
  524   2HB   SER  67          HB1       SER  67   9.550  -9.993  -1.713
  525    HG   SER  67           HG       SER  67  10.614 -10.390   0.317
  526    HA   PRO  68           HA       PRO  68   6.887  -6.903   2.514
  527   1HB   PRO  68          HB2       PRO  68   8.131  -8.289   4.666
  528   2HB   PRO  68          HB1       PRO  68   6.397  -8.178   4.314
  529   1HG   PRO  68          HG2       PRO  68   8.229 -10.459   3.910
  530   2HG   PRO  68          HG1       PRO  68   6.458 -10.442   3.925
  531   1HD   PRO  68          HD2       PRO  68   8.092 -10.699   1.630
  532   2HD   PRO  68          HD1       PRO  68   6.354 -10.337   1.647
  533    H    GLU  69           HN       GLU  69  10.004  -8.696   2.752
  534    HA   GLU  69           HA       GLU  69  11.485  -6.459   3.694
  535   1HB   GLU  69          HB2       GLU  69  13.498  -7.720   2.739
  536   2HB   GLU  69          HB1       GLU  69  12.527  -8.584   3.927
  537   1HG   GLU  69          HG2       GLU  69  11.921  -8.870   0.986
  538   2HG   GLU  69          HG1       GLU  69  13.219  -9.808   1.717
  539    H    LEU  70           HN       LEU  70  10.420  -7.269   0.467
  540    HA   LEU  70           HA       LEU  70  12.319  -5.606  -0.926
  541   1HB   LEU  70          HB2       LEU  70  11.134  -7.247  -2.213
  542   2HB   LEU  70          HB1       LEU  70   9.575  -6.658  -1.653
  543    HG   LEU  70           HG       LEU  70   9.857  -4.581  -2.880
  544   1HD1  LEU  70          HD11      LEU  70  12.186  -4.132  -2.739
  545   2HD1  LEU  70          HD12      LEU  70  11.908  -4.459  -4.446
  546   3HD1  LEU  70          HD13      LEU  70  12.614  -5.702  -3.413
  547   1HD2  LEU  70          HD21      LEU  70   9.080  -6.730  -4.035
  548   2HD2  LEU  70          HD22      LEU  70  10.695  -6.817  -4.735
  549   3HD2  LEU  70          HD23      LEU  70   9.650  -5.442  -5.093
  550    H    VAL  71           HN       VAL  71   8.976  -5.057   0.218
  551    HA   VAL  71           HA       VAL  71   8.577  -2.446  -0.669
  552    HB   VAL  71           HB       VAL  71   7.852  -3.130   2.178
  553   1HG1  VAL  71          HG11      VAL  71   5.796  -1.984   1.592
  554   2HG1  VAL  71          HG12      VAL  71   6.261  -1.937  -0.108
  555   3HG1  VAL  71          HG13      VAL  71   7.153  -0.985   1.074
  556   1HG2  VAL  71          HG21      VAL  71   5.896  -4.409   1.150
  557   2HG2  VAL  71          HG22      VAL  71   7.462  -5.210   1.118
  558   3HG2  VAL  71          HG23      VAL  71   6.839  -4.452  -0.342
  559    H    CYS  72           HN       CYS  72  10.093  -3.374   2.438
  560    HA   CYS  72           HA       CYS  72  10.847  -0.784   3.267
  561   1HB   CYS  72          HB2       CYS  72  11.238  -2.935   4.585
  562   2HB   CYS  72          HB1       CYS  72  12.676  -3.183   3.588
  563    H    SER  73           HN       SER  73  12.224  -2.847   0.784
  564    HA   SER  73           HA       SER  73  14.566  -1.177   0.355
  565   1HB   SER  73          HB2       SER  73  13.610  -3.675  -0.624
  566   2HB   SER  73          HB1       SER  73  13.833  -2.642  -2.032
  567    HG   SER  73           HG       SER  73  15.697  -3.372  -0.032
  568    H    MET  74           HN       MET  74  11.540  -1.647  -1.574
  569    HA   MET  74           HA       MET  74  11.917   0.491  -3.368
  570   1HB   MET  74          HB2       MET  74   9.264  -0.203  -2.068
  571   2HB   MET  74          HB1       MET  74   9.509   0.560  -3.637
  572   1HG   MET  74          HG2       MET  74  10.855  -1.591  -4.221
  573   2HG   MET  74          HG1       MET  74  10.027  -2.288  -2.831
  574   1HE   MET  74          HE1       MET  74   6.466  -2.746  -3.746
  575   2HE   MET  74          HE2       MET  74   7.213  -1.646  -2.581
  576   3HE   MET  74          HE3       MET  74   7.884  -3.259  -2.815
  577    H    LEU  75           HN       LEU  75  10.513   0.557  -0.101
  578    HA   LEU  75           HA       LEU  75   9.931   3.361  -0.065
  579   1HB   LEU  75          HB2       LEU  75  10.607   1.531   2.261
  580   2HB   LEU  75          HB1       LEU  75   9.808   3.095   2.383
  581    HG   LEU  75           HG       LEU  75   8.658   0.882   0.672
  582   1HD1  LEU  75          HD11      LEU  75   8.504   1.233   3.657
  583   2HD1  LEU  75          HD12      LEU  75   8.660  -0.248   2.714
  584   3HD1  LEU  75          HD13      LEU  75   7.112   0.590   2.786
  585   1HD2  LEU  75          HD21      LEU  75   7.555   3.385   1.984
  586   2HD2  LEU  75          HD22      LEU  75   6.530   2.138   1.277
  587   3HD2  LEU  75          HD23      LEU  75   7.660   3.026   0.261
  588    H    HIS  76           HN       HIS  76  12.884   1.742  -0.146
  589    HA   HIS  76           HA       HIS  76  15.081   2.347   0.435
  590   1HB   HIS  76          HB2       HIS  76  15.708   4.512  -0.503
  591   2HB   HIS  76          HB1       HIS  76  14.561   3.706  -1.574
  592    HD1  HIS  76           HD1      HIS  76  14.883   6.608   0.782
  593    HD2  HIS  76           HD2      HIS  76  11.983   4.909  -1.680
  594    HE1  HIS  76           HE1      HIS  76  12.993   8.288   0.640
  595    H    LEU  77           HN       LEU  77  13.738   2.261   2.807
  596    HA   LEU  77           HA       LEU  77  14.017   4.818   4.198
  597   1HB   LEU  77          HB2       LEU  77  12.351   2.678   4.609
  598   2HB   LEU  77          HB1       LEU  77  13.623   2.294   5.767
  599    HG   LEU  77           HG       LEU  77  13.371   4.824   6.439
  600   1HD1  LEU  77          HD11      LEU  77  10.548   4.326   5.502
  601   2HD1  LEU  77          HD12      LEU  77  11.724   5.124   4.460
  602   3HD1  LEU  77          HD13      LEU  77  11.286   5.845   6.009
  603   1HD2  LEU  77          HD21      LEU  77  11.711   4.206   8.133
  604   2HD2  LEU  77          HD22      LEU  77  12.831   2.867   7.887
  605   3HD2  LEU  77          HD23      LEU  77  11.220   2.812   7.169
  606    H    CYS  78           HN       CYS  78  15.852   1.884   3.716
  607    HA   CYS  78           HA       CYS  78  17.646   2.145   5.937
  608   1HB   CYS  78          HB2       CYS  78  18.224   0.963   3.204
  609   2HB   CYS  78          HB1       CYS  78  19.105   0.634   4.696
  610    H    SER  79           HN       SER  79  17.235   4.057   3.156
  611    HA   SER  79           HA       SER  79  19.811   4.870   2.444
  612   1HB   SER  79          HB2       SER  79  17.557   5.676   1.511
  613   2HB   SER  79          HB1       SER  79  17.557   6.845   2.828
  614    HG   SER  79           HG       SER  79  19.318   6.580   0.644
  615    H    GLY  80           HN       GLY  80  21.396   5.262   3.928
  616   1HA   GLY  80          HA2       GLY  80  20.846   6.502   6.512
  617   2HA   GLY  80          HA1       GLY  80  22.445   6.117   5.867
  618    H    LEU  81           HN       LEU  81  21.634   7.525   3.355
  619    HA   LEU  81           HA       LEU  81  21.875  10.358   4.237
  620   1HB   LEU  81          HB2       LEU  81  23.213  10.592   2.017
  621   2HB   LEU  81          HB1       LEU  81  24.043   9.922   3.413
  622    HG   LEU  81           HG       LEU  81  24.434   8.664   1.269
  623   1HD1  LEU  81          HD11      LEU  81  24.135   7.645   3.821
  624   2HD1  LEU  81          HD12      LEU  81  24.774   6.763   2.440
  625   3HD1  LEU  81          HD13      LEU  81  23.079   6.593   2.878
  626   1HD2  LEU  81          HD21      LEU  81  22.713   7.389   0.230
  627   2HD2  LEU  81          HD22      LEU  81  22.012   8.983   0.480
  628   3HD2  LEU  81          HD23      LEU  81  21.593   7.655   1.561
  629    H    VAL  82           HN       VAL  82  21.540  11.625   1.894
  630    HA   VAL  82           HA       VAL  82  18.801  10.877   1.229
  631    HB   VAL  82           HB       VAL  82  19.069  12.845  -0.456
  632   1HG1  VAL  82          HG11      VAL  82  19.292  13.319   2.531
  633   2HG1  VAL  82          HG12      VAL  82  17.802  12.954   1.656
  634   3HG1  VAL  82          HG13      VAL  82  18.661  14.465   1.347
  635   1HG2  VAL  82          HG21      VAL  82  20.887  14.379   0.051
  636   2HG2  VAL  82          HG22      VAL  82  21.585  12.797  -0.295
  637   3HG2  VAL  82          HG23      VAL  82  21.441  13.352   1.372
  638    HA   PRO  83           HA       PRO  83  20.066   8.061  -1.965
  639   1HB   PRO  83          HB2       PRO  83  17.710   8.933  -3.538
  640   2HB   PRO  83          HB1       PRO  83  18.129   7.320  -2.940
  641   1HG   PRO  83          HG2       PRO  83  16.162   8.986  -1.829
  642   2HG   PRO  83          HG1       PRO  83  16.909   7.598  -1.026
  643   1HD   PRO  83          HD2       PRO  83  17.272  10.449  -0.424
  644   2HD   PRO  83          HD1       PRO  83  17.822   9.023   0.496
  645    H    ARG  84           HN       ARG  84  21.315   8.336  -3.874
  646    HA   ARG  84           HA       ARG  84  21.806  11.105  -4.721
  647   1HB   ARG  84          HB2       ARG  84  22.994   8.428  -5.503
  648   2HB   ARG  84          HB1       ARG  84  23.415   9.911  -6.352
  649   1HG   ARG  84          HG2       ARG  84  25.099   9.790  -4.730
  650   2HG   ARG  84          HG1       ARG  84  23.930  10.847  -3.949
  651   1HD   ARG  84          HD2       ARG  84  24.741   9.086  -2.411
  652   2HD   ARG  84          HD1       ARG  84  23.010   8.937  -2.705
  653    HE   ARG  84           HE       ARG  84  24.137   7.282  -4.613
  654   1HH1  ARG  84          HH21      ARG  84  24.386   7.685  -1.198
  655   2HH1  ARG  84          HH22      ARG  84  24.715   6.012  -0.890
  656   1HH2  ARG  84          HH11      ARG  84  24.564   5.094  -4.231
  657   2HH2  ARG  84          HH12      ARG  84  24.815   4.546  -2.607
  Start of MODEL   18
    1   1H    SER   1           HT1      SER   1  22.588   7.002   7.609
    2   2H    SER   1           HT2      SER   1  22.619   5.357   7.183
    3   3H    SER   1           HT3      SER   1  23.269   5.866   8.669
    4    HA   SER   1           HA       SER   1  21.260   6.078   9.668
    5   1HB   SER   1          HB2       SER   1  20.010   6.447   6.930
    6   2HB   SER   1          HB1       SER   1  19.221   6.686   8.487
    7    HG   SER   1           HG       SER   1  20.760   8.378   7.068
    8    H    ASP   2           HN       ASP   2  19.883   4.364  10.245
    9    HA   ASP   2           HA       ASP   2  19.238   2.239   8.356
   10   1HB   ASP   2          HB2       ASP   2  20.455   0.472   9.698
   11   2HB   ASP   2          HB1       ASP   2  21.512   1.552   8.788
   12    H    VAL   3           HN       VAL   3  17.691   3.922  10.022
   13    HA   VAL   3           HA       VAL   3  16.776   2.161  12.239
   14    HB   VAL   3           HB       VAL   3  15.992   4.993  11.611
   15   1HG1  VAL   3          HG11      VAL   3  15.651   3.335  14.122
   16   2HG1  VAL   3          HG12      VAL   3  14.362   3.709  12.978
   17   3HG1  VAL   3          HG13      VAL   3  15.121   5.002  13.903
   18   1HG2  VAL   3          HG21      VAL   3  18.378   4.877  12.132
   19   2HG2  VAL   3          HG22      VAL   3  18.035   3.900  13.559
   20   3HG2  VAL   3          HG23      VAL   3  17.510   5.582  13.495
   21    H    TYR   4           HN       TYR   4  15.132   4.380   9.990
   22    HA   TYR   4           HA       TYR   4  12.685   2.889  10.028
   23   1HB   TYR   4          HB2       TYR   4  13.815   5.163   8.446
   24   2HB   TYR   4          HB1       TYR   4  12.444   4.317   7.737
   25    HD1  TYR   4           HD1      TYR   4  10.644   5.819   8.023
   26    HD2  TYR   4           HD2      TYR   4  13.208   4.900  11.339
   27    HE1  TYR   4           HE1      TYR   4   9.104   7.022   9.540
   28    HE2  TYR   4           HE2      TYR   4  11.679   6.104  12.866
   29    HH   TYR   4           HH       TYR   4   9.948   7.952  12.654
   30    H    CYS   5           HN       CYS   5  15.629   2.172   8.501
   31    HA   CYS   5           HA       CYS   5  14.392   0.852   6.177
   32   1HB   CYS   5          HB2       CYS   5  17.241   0.362   7.018
   33   2HB   CYS   5          HB1       CYS   5  16.558   0.464   5.399
   34    H    GLU   6           HN       GLU   6  16.063  -0.149   9.173
   35    HA   GLU   6           HA       GLU   6  15.443  -2.971   8.693
   36   1HB   GLU   6          HB2       GLU   6  16.525  -1.549  11.147
   37   2HB   GLU   6          HB1       GLU   6  16.431  -3.299  10.946
   38   1HG   GLU   6          HG2       GLU   6  17.922  -3.183   9.002
   39   2HG   GLU   6          HG1       GLU   6  17.982  -1.425   9.135
   40    H    VAL   7           HN       VAL   7  14.172  -0.316  10.655
   41    HA   VAL   7           HA       VAL   7  12.359  -1.879  12.229
   42    HB   VAL   7           HB       VAL   7  12.211   1.016  11.339
   43   1HG1  VAL   7          HG11      VAL   7  10.593  -0.571  13.342
   44   2HG1  VAL   7          HG12      VAL   7   9.998   0.373  11.976
   45   3HG1  VAL   7          HG13      VAL   7  10.690   1.189  13.378
   46   1HG2  VAL   7          HG21      VAL   7  13.258   1.545  13.402
   47   2HG2  VAL   7          HG22      VAL   7  14.172   0.165  12.793
   48   3HG2  VAL   7          HG23      VAL   7  12.967  -0.067  14.058
   49    H    CYS   8           HN       CYS   8  11.924  -0.137   9.137
   50    HA   CYS   8           HA       CYS   8   9.165  -0.740   8.811
   51   1HB   CYS   8          HB2       CYS   8   9.458  -0.153   6.496
   52   2HB   CYS   8          HB1       CYS   8  10.511   0.899   7.438
   53    H    GLU   9           HN       GLU   9  12.012  -2.465   7.500
   54    HA   GLU   9           HA       GLU   9  10.723  -4.557   6.167
   55   1HB   GLU   9          HB2       GLU   9  13.255  -4.729   7.853
   56   2HB   GLU   9          HB1       GLU   9  12.634  -6.084   6.920
   57   1HG   GLU   9          HG2       GLU   9  12.650  -4.494   4.887
   58   2HG   GLU   9          HG1       GLU   9  13.658  -3.438   5.873
   59    H    PHE  10           HN       PHE  10  11.294  -4.321   9.669
   60    HA   PHE  10           HA       PHE  10  10.116  -6.899  10.246
   61   1HB   PHE  10          HB2       PHE  10  11.667  -5.902  11.826
   62   2HB   PHE  10          HB1       PHE  10  10.633  -4.485  12.004
   63    HD1  PHE  10           HD1      PHE  10  11.027  -8.065  12.795
   64    HD2  PHE  10           HD2      PHE  10   8.557  -4.584  13.275
   65    HE1  PHE  10           HE1      PHE  10   9.755  -9.214  14.588
   66    HE2  PHE  10           HE2      PHE  10   7.286  -5.732  15.068
   67    HZ   PHE  10           HZ       PHE  10   7.884  -8.047  15.724
   68    H    LEU  11           HN       LEU  11   8.810  -3.680   9.789
   69    HA   LEU  11           HA       LEU  11   6.254  -4.327  11.068
   70   1HB   LEU  11          HB2       LEU  11   7.147  -2.002   9.343
   71   2HB   LEU  11          HB1       LEU  11   5.541  -2.128  10.057
   72    HG   LEU  11           HG       LEU  11   8.127  -2.195  11.643
   73   1HD1  LEU  11          HD11      LEU  11   7.512   0.110  12.318
   74   2HD1  LEU  11          HD12      LEU  11   6.149   0.062  11.201
   75   3HD1  LEU  11          HD13      LEU  11   7.799  -0.005  10.582
   76   1HD2  LEU  11          HD21      LEU  11   6.580  -3.210  13.059
   77   2HD2  LEU  11          HD22      LEU  11   5.203  -2.373  12.344
   78   3HD2  LEU  11          HD23      LEU  11   6.274  -1.523  13.456
   79    H    VAL  12           HN       VAL  12   7.420  -3.994   7.707
   80    HA   VAL  12           HA       VAL  12   4.856  -4.474   6.524
   81    HB   VAL  12           HB       VAL  12   7.521  -5.165   5.275
   82   1HG1  VAL  12          HG11      VAL  12   6.354  -4.737   3.199
   83   2HG1  VAL  12          HG12      VAL  12   4.937  -4.146   4.061
   84   3HG1  VAL  12          HG13      VAL  12   5.370  -5.852   4.142
   85   1HG2  VAL  12          HG21      VAL  12   7.599  -2.845   4.489
   86   2HG2  VAL  12          HG22      VAL  12   7.539  -2.860   6.250
   87   3HG2  VAL  12          HG23      VAL  12   6.087  -2.487   5.325
   88    H    LYS  13           HN       LYS  13   7.269  -6.647   7.850
   89    HA   LYS  13           HA       LYS  13   6.171  -9.028   6.543
   90   1HB   LYS  13          HB2       LYS  13   8.526  -8.899   7.171
   91   2HB   LYS  13          HB1       LYS  13   8.082  -8.712   8.863
   92   1HG   LYS  13          HG2       LYS  13   6.743 -11.077   7.903
   93   2HG   LYS  13          HG1       LYS  13   8.406 -11.169   7.343
   94   1HD   LYS  13          HD2       LYS  13   8.432 -12.202   9.472
   95   2HD   LYS  13          HD1       LYS  13   9.079 -10.589   9.763
   96   1HE   LYS  13          HE2       LYS  13   6.902  -9.816  10.555
   97   2HE   LYS  13          HE1       LYS  13   6.176 -11.374  10.158
   98   1HZ   LYS  13          HZ1       LYS  13   6.669 -11.895  12.255
   99   2HZ   LYS  13          HZ2       LYS  13   7.770 -10.614  12.431
  100   3HZ   LYS  13          HZ3       LYS  13   8.265 -12.072  11.711
  101    H    GLU  14           HN       GLU  14   5.849  -7.453   9.724
  102    HA   GLU  14           HA       GLU  14   4.292  -9.603  10.893
  103   1HB   GLU  14          HB2       GLU  14   5.493  -7.837  12.221
  104   2HB   GLU  14          HB1       GLU  14   4.304  -6.665  11.656
  105   1HG   GLU  14          HG2       GLU  14   2.497  -7.941  12.690
  106   2HG   GLU  14          HG1       GLU  14   3.633  -9.199  13.180
  107    H    VAL  15           HN       VAL  15   3.333  -6.352   9.780
  108    HA   VAL  15           HA       VAL  15   0.569  -6.599   9.867
  109    HB   VAL  15           HB       VAL  15   1.874  -4.562   9.121
  110   1HG1  VAL  15          HG11      VAL  15   2.546  -4.364   6.828
  111   2HG1  VAL  15          HG12      VAL  15   1.785  -5.898   6.406
  112   3HG1  VAL  15          HG13      VAL  15   3.222  -5.878   7.426
  113   1HG2  VAL  15          HG21      VAL  15   0.127  -3.911   7.388
  114   2HG2  VAL  15          HG22      VAL  15  -0.514  -4.503   8.920
  115   3HG2  VAL  15          HG23      VAL  15  -0.485  -5.560   7.509
  116    H    THR  16           HN       THR  16   2.790  -7.848   7.392
  117    HA   THR  16           HA       THR  16   0.923  -8.845   5.555
  118    HB   THR  16           HB       THR  16   2.976 -10.831   5.871
  119    HG1  THR  16           HG1      THR  16   4.130  -8.311   5.829
  120   1HG2  THR  16          HG21      THR  16   3.881  -9.703   3.821
  121   2HG2  THR  16          HG22      THR  16   2.670  -8.436   4.048
  122   3HG2  THR  16          HG23      THR  16   2.156 -10.097   3.713
  123    H    LYS  17           HN       LYS  17   2.167 -10.374   8.531
  124    HA   LYS  17           HA       LYS  17   0.852 -12.821   8.473
  125   1HB   LYS  17          HB2       LYS  17   1.200 -10.957  10.845
  126   2HB   LYS  17          HB1       LYS  17   0.714 -12.645  10.971
  127   1HG   LYS  17          HG2       LYS  17   2.795 -13.377   9.940
  128   2HG   LYS  17          HG1       LYS  17   3.270 -11.708   9.639
  129   1HD   LYS  17          HD2       LYS  17   4.456 -12.223  11.598
  130   2HD   LYS  17          HD1       LYS  17   3.023 -11.414  12.227
  131   1HE   LYS  17          HE2       LYS  17   3.542 -13.501  13.473
  132   2HE   LYS  17          HE1       LYS  17   1.971 -13.584  12.683
  133   1HZ   LYS  17          HZ1       LYS  17   2.761 -15.009  11.068
  134   2HZ   LYS  17          HZ2       LYS  17   3.593 -15.547  12.448
  135   3HZ   LYS  17          HZ3       LYS  17   4.381 -14.567  11.305
  136    H    LEU  18           HN       LEU  18  -0.518  -9.649   9.306
  137    HA   LEU  18           HA       LEU  18  -3.200 -10.884   9.674
  138   1HB   LEU  18          HB2       LEU  18  -3.611  -9.077  10.999
  139   2HB   LEU  18          HB1       LEU  18  -1.899  -8.714  10.839
  140    HG   LEU  18           HG       LEU  18  -2.507  -7.371   8.752
  141   1HD1  LEU  18          HD11      LEU  18  -5.244  -6.833   9.588
  142   2HD1  LEU  18          HD12      LEU  18  -5.061  -8.551   9.232
  143   3HD1  LEU  18          HD13      LEU  18  -4.644  -7.349   8.013
  144   1HD2  LEU  18          HD21      LEU  18  -1.978  -6.372  10.949
  145   2HD2  LEU  18          HD22      LEU  18  -3.675  -6.501  11.413
  146   3HD2  LEU  18          HD23      LEU  18  -3.201  -5.432  10.093
  147    H    ILE  19           HN       ILE  19  -1.509  -8.764   7.405
  148    HA   ILE  19           HA       ILE  19  -3.776  -8.230   5.711
  149    HB   ILE  19           HB       ILE  19  -0.921  -7.678   5.859
  150   1HG1  ILE  19          HG12      ILE  19  -2.931  -6.188   4.192
  151   2HG1  ILE  19          HG11      ILE  19  -2.888  -6.050   5.950
  152   1HG2  ILE  19          HG21      ILE  19  -0.653  -9.015   3.862
  153   2HG2  ILE  19          HG22      ILE  19  -0.526  -7.313   3.432
  154   3HG2  ILE  19          HG23      ILE  19  -2.013  -8.196   3.093
  155   1HD1  ILE  19          HD11      ILE  19  -1.335  -4.432   5.642
  156   2HD1  ILE  19          HD12      ILE  19  -1.122  -4.855   3.948
  157   3HD1  ILE  19          HD13      ILE  19  -0.201  -5.708   5.189
  158    H    ASP  20           HN       ASP  20  -1.808 -10.977   6.225
  159    HA   ASP  20           HA       ASP  20  -1.426 -12.252   3.839
  160   1HB   ASP  20          HB2       ASP  20  -2.512 -13.360   6.436
  161   2HB   ASP  20          HB1       ASP  20  -2.165 -14.408   5.063
  162    H    ASN  21           HN       ASN  21  -4.605 -12.099   5.520
  163    HA   ASN  21           HA       ASN  21  -5.959 -12.256   2.930
  164   1HB   ASN  21          HB2       ASN  21  -6.194 -14.491   4.951
  165   2HB   ASN  21          HB1       ASN  21  -7.332 -14.246   3.622
  166   1HD2  ASN  21          HD21      ASN  21  -6.698 -14.955   1.532
  167   2HD2  ASN  21          HD22      ASN  21  -5.184 -15.645   1.192
  168    H    ASN  22           HN       ASN  22  -5.834 -10.445   5.273
  169    HA   ASN  22           HA       ASN  22  -8.691 -10.545   6.185
  170   1HB   ASN  22          HB2       ASN  22  -6.386  -8.960   7.348
  171   2HB   ASN  22          HB1       ASN  22  -7.986  -9.182   8.057
  172   1HD2  ASN  22          HD21      ASN  22  -5.747 -11.597   6.546
  173   2HD2  ASN  22          HD22      ASN  22  -5.691 -12.602   7.913
  174    H    LYS  23           HN       LYS  23  -6.134  -8.350   5.092
  175    HA   LYS  23           HA       LYS  23  -7.830  -6.098   4.670
  176   1HB   LYS  23          HB2       LYS  23  -5.131  -6.585   4.751
  177   2HB   LYS  23          HB1       LYS  23  -5.355  -6.406   3.021
  178   1HG   LYS  23          HG2       LYS  23  -6.311  -4.410   5.091
  179   2HG   LYS  23          HG1       LYS  23  -4.794  -4.254   4.220
  180   1HD   LYS  23          HD2       LYS  23  -7.461  -4.549   2.832
  181   2HD   LYS  23          HD1       LYS  23  -6.800  -2.982   3.275
  182   1HE   LYS  23          HE2       LYS  23  -6.149  -4.637   0.963
  183   2HE   LYS  23          HE1       LYS  23  -5.669  -2.979   1.295
  184   1HZ   LYS  23          HZ1       LYS  23  -3.700  -3.617   2.163
  185   2HZ   LYS  23          HZ2       LYS  23  -3.937  -4.935   1.117
  186   3HZ   LYS  23          HZ3       LYS  23  -4.286  -5.085   2.769
  187    H    THR  24           HN       THR  24  -9.482  -7.745   3.606
  188    HA   THR  24           HA       THR  24  -9.064  -8.701   0.960
  189    HB   THR  24           HB       THR  24 -11.580  -8.688   0.824
  190    HG1  THR  24           HG1      THR  24 -12.641  -7.529   2.201
  191   1HG2  THR  24          HG21      THR  24 -10.208 -10.525   1.875
  192   2HG2  THR  24          HG22      THR  24 -11.849 -10.394   2.509
  193   3HG2  THR  24          HG23      THR  24 -10.492  -9.758   3.438
  194    H    GLU  25           HN       GLU  25 -10.470  -7.806  -0.940
  195    HA   GLU  25           HA       GLU  25  -9.802  -4.904  -1.209
  196   1HB   GLU  25          HB2       GLU  25 -10.569  -6.824  -3.414
  197   2HB   GLU  25          HB1       GLU  25  -9.781  -5.255  -3.573
  198   1HG   GLU  25          HG2       GLU  25  -8.011  -6.816  -3.793
  199   2HG   GLU  25          HG1       GLU  25  -7.894  -6.263  -2.123
  200    H    LYS  26           HN       LYS  26 -12.499  -6.820  -0.585
  201    HA   LYS  26           HA       LYS  26 -14.402  -5.298  -2.204
  202   1HB   LYS  26          HB2       LYS  26 -14.762  -7.214   0.125
  203   2HB   LYS  26          HB1       LYS  26 -16.099  -6.485  -0.761
  204   1HG   LYS  26          HG2       LYS  26 -15.623  -7.661  -2.730
  205   2HG   LYS  26          HG1       LYS  26 -13.947  -7.959  -2.275
  206   1HD   LYS  26          HD2       LYS  26 -16.158  -9.146  -0.602
  207   2HD   LYS  26          HD1       LYS  26 -15.722  -9.914  -2.127
  208   1HE   LYS  26          HE2       LYS  26 -13.354 -10.034  -1.365
  209   2HE   LYS  26          HE1       LYS  26 -13.837  -9.345   0.184
  210   1HZ   LYS  26          HZ1       LYS  26 -14.810 -11.249   0.834
  211   2HZ   LYS  26          HZ2       LYS  26 -13.749 -11.953  -0.290
  212   3HZ   LYS  26          HZ3       LYS  26 -15.364 -11.643  -0.720
  213    H    GLU  27           HN       GLU  27 -13.197  -5.360   1.092
  214    HA   GLU  27           HA       GLU  27 -14.945  -3.284   2.061
  215   1HB   GLU  27          HB2       GLU  27 -13.757  -4.989   3.495
  216   2HB   GLU  27          HB1       GLU  27 -12.253  -4.132   3.162
  217   1HG   GLU  27          HG2       GLU  27 -13.109  -3.334   5.273
  218   2HG   GLU  27          HG1       GLU  27 -13.322  -2.049   4.083
  219    H    ILE  28           HN       ILE  28 -11.943  -3.371   0.312
  220    HA   ILE  28           HA       ILE  28 -11.169  -0.649   0.942
  221    HB   ILE  28           HB       ILE  28 -10.247  -2.554  -1.222
  222   1HG1  ILE  28          HG12      ILE  28  -9.976  -3.276   1.214
  223   2HG1  ILE  28          HG11      ILE  28  -8.508  -3.229   0.247
  224   1HG2  ILE  28          HG21      ILE  28  -9.542  -0.441  -1.925
  225   2HG2  ILE  28          HG22      ILE  28  -8.157  -1.033  -1.013
  226   3HG2  ILE  28          HG23      ILE  28  -9.260   0.126  -0.279
  227   1HD1  ILE  28          HD11      ILE  28  -7.583  -1.630   1.542
  228   2HD1  ILE  28          HD12      ILE  28  -8.846  -2.022   2.705
  229   3HD1  ILE  28          HD13      ILE  28  -9.055  -0.672   1.605
  230    H    LEU  29           HN       LEU  29 -11.736  -2.067  -2.277
  231    HA   LEU  29           HA       LEU  29 -12.173   0.266  -3.679
  232   1HB   LEU  29          HB2       LEU  29 -13.761  -2.293  -4.028
  233   2HB   LEU  29          HB1       LEU  29 -13.553  -1.038  -5.248
  234    HG   LEU  29           HG       LEU  29 -11.207  -2.460  -3.967
  235   1HD1  LEU  29          HD11      LEU  29 -11.183  -3.756  -6.178
  236   2HD1  LEU  29          HD12      LEU  29 -12.850  -3.220  -6.384
  237   3HD1  LEU  29          HD13      LEU  29 -12.410  -4.224  -5.001
  238   1HD2  LEU  29          HD21      LEU  29 -10.470  -0.475  -5.048
  239   2HD2  LEU  29          HD22      LEU  29 -11.592  -0.684  -6.392
  240   3HD2  LEU  29          HD23      LEU  29 -10.191  -1.742  -6.241
  241    H    ASP  30           HN       ASP  30 -14.374  -1.265  -1.420
  242    HA   ASP  30           HA       ASP  30 -16.684   0.331  -2.145
  243   1HB   ASP  30          HB2       ASP  30 -16.819  -1.768  -0.779
  244   2HB   ASP  30          HB1       ASP  30 -16.007  -0.923   0.538
  245    H    ALA  31           HN       ALA  31 -14.286   0.544   0.492
  246    HA   ALA  31           HA       ALA  31 -15.016   2.925   1.713
  247   1HB   ALA  31          HB1       ALA  31 -12.597   3.299   2.142
  248   2HB   ALA  31          HB2       ALA  31 -12.220   2.027   0.976
  249   3HB   ALA  31          HB3       ALA  31 -13.088   1.635   2.461
  250    H    PHE  32           HN       PHE  32 -13.078   2.595  -1.281
  251    HA   PHE  32           HA       PHE  32 -12.654   5.364  -1.738
  252   1HB   PHE  32          HB2       PHE  32 -13.005   3.003  -3.624
  253   2HB   PHE  32          HB1       PHE  32 -12.784   4.635  -4.249
  254    HD1  PHE  32           HD1      PHE  32 -10.641   5.727  -4.162
  255    HD2  PHE  32           HD2      PHE  32 -11.221   1.940  -2.217
  256    HE1  PHE  32           HE1      PHE  32  -8.198   5.529  -3.823
  257    HE2  PHE  32           HE2      PHE  32  -8.768   1.744  -1.888
  258    HZ   PHE  32           HZ       PHE  32  -7.262   3.535  -2.688
  259    H    ASP  33           HN       ASP  33 -15.485   3.290  -2.394
  260    HA   ASP  33           HA       ASP  33 -17.004   5.296  -3.777
  261   1HB   ASP  33          HB2       ASP  33 -18.187   3.160  -1.984
  262   2HB   ASP  33          HB1       ASP  33 -18.899   3.885  -3.425
  263    H    LYS  34           HN       LYS  34 -15.816   5.144  -0.670
  264    HA   LYS  34           HA       LYS  34 -17.933   6.985   0.416
  265   1HB   LYS  34          HB2       LYS  34 -15.857   5.547   2.089
  266   2HB   LYS  34          HB1       LYS  34 -17.409   6.216   2.599
  267   1HG   LYS  34          HG2       LYS  34 -18.598   4.465   1.372
  268   2HG   LYS  34          HG1       LYS  34 -17.072   3.849   0.748
  269   1HD   LYS  34          HD2       LYS  34 -16.476   3.755   3.387
  270   2HD   LYS  34          HD1       LYS  34 -18.225   3.624   3.510
  271   1HE   LYS  34          HE2       LYS  34 -17.029   1.807   1.491
  272   2HE   LYS  34          HE1       LYS  34 -16.531   1.490   3.144
  273   1HZ   LYS  34          HZ1       LYS  34 -18.789   0.581   2.083
  274   2HZ   LYS  34          HZ2       LYS  34 -19.355   2.031   2.761
  275   3HZ   LYS  34          HZ3       LYS  34 -18.589   0.874   3.741
  276    H    MET  35           HN       MET  35 -14.504   6.372   1.176
  277    HA   MET  35           HA       MET  35 -13.979   9.087   1.864
  278   1HB   MET  35          HB2       MET  35 -12.300   7.947   2.851
  279   2HB   MET  35          HB1       MET  35 -12.564   6.575   1.804
  280   1HG   MET  35          HG2       MET  35 -11.023   9.011   0.898
  281   2HG   MET  35          HG1       MET  35 -10.253   7.665   1.719
  282   1HE   MET  35          HE1       MET  35 -10.423   5.404   1.179
  283   2HE   MET  35          HE2       MET  35 -10.423   4.721  -0.443
  284   3HE   MET  35          HE3       MET  35 -11.945   5.014   0.382
  285    H    CYS  36           HN       CYS  36 -13.447   7.312  -1.188
  286    HA   CYS  36           HA       CYS  36 -12.345   9.778  -2.406
  287   1HB   CYS  36          HB2       CYS  36 -11.416   7.560  -3.034
  288   2HB   CYS  36          HB1       CYS  36 -12.979   7.102  -3.696
  289    H    SER  37           HN       SER  37 -15.203   9.169  -1.368
  290    HA   SER  37           HA       SER  37 -16.828   9.659  -3.783
  291   1HB   SER  37          HB2       SER  37 -18.632   9.041  -2.479
  292   2HB   SER  37          HB1       SER  37 -17.364   8.293  -1.514
  293    HG   SER  37           HG       SER  37 -18.995  10.391  -0.936
  294    H    LYS  38           HN       LYS  38 -16.054  11.261  -0.705
  295    HA   LYS  38           HA       LYS  38 -17.369  13.747  -1.360
  296   1HB   LYS  38          HB2       LYS  38 -16.268  14.610   0.619
  297   2HB   LYS  38          HB1       LYS  38 -16.787  12.962   0.964
  298   1HG   LYS  38          HG2       LYS  38 -14.353  12.332   0.090
  299   2HG   LYS  38          HG1       LYS  38 -14.004  14.014   0.481
  300   1HD   LYS  38          HD2       LYS  38 -13.460  12.671   2.412
  301   2HD   LYS  38          HD1       LYS  38 -14.910  13.602   2.791
  302   1HE   LYS  38          HE2       LYS  38 -16.254  11.725   2.832
  303   2HE   LYS  38          HE1       LYS  38 -15.329  10.899   1.581
  304   1HZ   LYS  38          HZ1       LYS  38 -15.072   9.889   3.785
  305   2HZ   LYS  38          HZ2       LYS  38 -14.401  11.337   4.368
  306   3HZ   LYS  38          HZ3       LYS  38 -13.598  10.450   3.162
  307    H    LEU  39           HN       LEU  39 -14.324  12.344  -2.190
  308    HA   LEU  39           HA       LEU  39 -12.666  14.513  -2.453
  309   1HB   LEU  39          HB2       LEU  39 -12.728  11.870  -3.528
  310   2HB   LEU  39          HB1       LEU  39 -12.450  12.921  -4.898
  311    HG   LEU  39           HG       LEU  39 -10.668  13.920  -2.940
  312   1HD1  LEU  39          HD11      LEU  39  -9.549  12.111  -1.943
  313   2HD1  LEU  39          HD12      LEU  39 -10.343  10.928  -2.984
  314   3HD1  LEU  39          HD13      LEU  39 -11.258  11.737  -1.709
  315   1HD2  LEU  39          HD21      LEU  39 -10.089  11.905  -5.122
  316   2HD2  LEU  39          HD22      LEU  39  -8.938  13.029  -4.397
  317   3HD2  LEU  39          HD23      LEU  39 -10.276  13.640  -5.368
  318    HA   PRO  40           HA       PRO  40 -14.825  17.326  -5.188
  319   1HB   PRO  40          HB2       PRO  40 -12.250  18.045  -6.445
  320   2HB   PRO  40          HB1       PRO  40 -13.347  19.062  -5.498
  321   1HG   PRO  40          HG2       PRO  40 -10.861  17.997  -4.612
  322   2HG   PRO  40          HG1       PRO  40 -12.081  18.786  -3.602
  323   1HD   PRO  40          HD2       PRO  40 -11.363  15.974  -3.653
  324   2HD   PRO  40          HD1       PRO  40 -12.543  16.777  -2.594
  325    H    LYS  41           HN       LYS  41 -15.796  16.787  -7.082
  326    HA   LYS  41           HA       LYS  41 -15.638  14.530  -8.517
  327   1HB   LYS  41          HB2       LYS  41 -17.194  16.424  -8.959
  328   2HB   LYS  41          HB1       LYS  41 -15.906  17.214  -9.865
  329   1HG   LYS  41          HG2       LYS  41 -15.841  15.471 -11.486
  330   2HG   LYS  41          HG1       LYS  41 -16.868  14.425 -10.506
  331   1HD   LYS  41          HD2       LYS  41 -18.811  15.513 -11.117
  332   2HD   LYS  41          HD1       LYS  41 -18.033  17.093 -11.186
  333   1HE   LYS  41          HE2       LYS  41 -18.699  16.398 -13.431
  334   2HE   LYS  41          HE1       LYS  41 -16.941  16.444 -13.311
  335   1HZ   LYS  41          HZ1       LYS  41 -18.577  13.994 -12.959
  336   2HZ   LYS  41          HZ2       LYS  41 -16.882  14.087 -13.019
  337   3HZ   LYS  41          HZ3       LYS  41 -17.804  14.422 -14.406
  338    H    SER  42           HN       SER  42 -13.716  17.348  -9.489
  339    HA   SER  42           HA       SER  42 -12.329  16.276 -11.646
  340   1HB   SER  42          HB2       SER  42 -12.159  18.620 -10.564
  341   2HB   SER  42          HB1       SER  42 -10.912  17.911  -9.536
  342    HG   SER  42           HG       SER  42  -9.709  17.459 -11.346
  343    H    LEU  43           HN       LEU  43 -10.978  16.340  -8.346
  344    HA   LEU  43           HA       LEU  43  -8.999  14.336  -9.049
  345   1HB   LEU  43          HB2       LEU  43  -9.796  15.622  -6.428
  346   2HB   LEU  43          HB1       LEU  43  -8.476  14.459  -6.569
  347    HG   LEU  43           HG       LEU  43  -8.548  16.879  -8.372
  348   1HD1  LEU  43          HD11      LEU  43  -8.786  17.855  -6.178
  349   2HD1  LEU  43          HD12      LEU  43  -7.099  18.029  -6.660
  350   3HD1  LEU  43          HD13      LEU  43  -7.562  16.775  -5.510
  351   1HD2  LEU  43          HD21      LEU  43  -6.051  16.582  -8.156
  352   2HD2  LEU  43          HD22      LEU  43  -6.865  15.206  -8.894
  353   3HD2  LEU  43          HD23      LEU  43  -6.353  15.128  -7.208
  354    H    SER  44           HN       SER  44 -12.246  14.028  -8.488
  355    HA   SER  44           HA       SER  44 -12.061  11.553  -6.879
  356   1HB   SER  44          HB2       SER  44 -14.354  11.728  -6.590
  357   2HB   SER  44          HB1       SER  44 -14.002  13.421  -6.916
  358    HG   SER  44           HG       SER  44 -14.278  12.607  -9.242
  359    H    GLU  45           HN       GLU  45 -12.449  12.703 -10.150
  360    HA   GLU  45           HA       GLU  45 -13.175  10.089 -11.178
  361   1HB   GLU  45          HB2       GLU  45 -13.412  11.109 -13.261
  362   2HB   GLU  45          HB1       GLU  45 -13.695  12.473 -12.185
  363   1HG   GLU  45          HG2       GLU  45 -12.156  13.363 -13.709
  364   2HG   GLU  45          HG1       GLU  45 -11.113  12.849 -12.389
  365    H    GLU  46           HN       GLU  46 -10.287  11.977 -10.665
  366    HA   GLU  46           HA       GLU  46  -8.578  10.130 -12.172
  367   1HB   GLU  46          HB2       GLU  46  -8.051  12.533 -10.415
  368   2HB   GLU  46          HB1       GLU  46  -6.737  11.527 -11.028
  369   1HG   GLU  46          HG2       GLU  46  -7.583  11.903 -13.347
  370   2HG   GLU  46          HG1       GLU  46  -8.801  12.998 -12.694
  371    H    CYS  47           HN       CYS  47  -9.739  10.494  -8.908
  372    HA   CYS  47           HA       CYS  47  -7.663   8.865  -7.675
  373   1HB   CYS  47          HB2       CYS  47  -8.672  10.156  -6.035
  374   2HB   CYS  47          HB1       CYS  47 -10.226  10.140  -6.848
  375    H    GLN  48           HN       GLN  48 -10.758   8.279  -9.220
  376    HA   GLN  48           HA       GLN  48 -10.779   5.445  -8.401
  377   1HB   GLN  48          HB2       GLN  48 -12.596   7.242 -10.011
  378   2HB   GLN  48          HB1       GLN  48 -12.775   5.489 -10.109
  379   1HG   GLN  48          HG2       GLN  48 -12.697   6.944  -7.459
  380   2HG   GLN  48          HG1       GLN  48 -14.202   6.691  -8.343
  381   1HE2  GLN  48          HE21      GLN  48 -14.375   5.412  -6.043
  382   2HE2  GLN  48          HE22      GLN  48 -14.008   3.758  -6.154
  383    H    GLU  49           HN       GLU  49  -9.553   7.499 -10.831
  384    HA   GLU  49           HA       GLU  49  -9.456   5.606 -12.980
  385   1HB   GLU  49          HB2       GLU  49  -9.240   8.100 -13.230
  386   2HB   GLU  49          HB1       GLU  49  -7.644   7.982 -12.491
  387   1HG   GLU  49          HG2       GLU  49  -7.333   7.967 -14.875
  388   2HG   GLU  49          HG1       GLU  49  -7.033   6.330 -14.296
  389    H    VAL  50           HN       VAL  50  -7.012   6.752 -10.618
  390    HA   VAL  50           HA       VAL  50  -5.012   4.879 -11.465
  391    HB   VAL  50           HB       VAL  50  -5.280   6.056  -8.691
  392   1HG1  VAL  50          HG11      VAL  50  -3.029   4.862 -10.335
  393   2HG1  VAL  50          HG12      VAL  50  -3.629   4.343  -8.757
  394   3HG1  VAL  50          HG13      VAL  50  -2.733   5.853  -8.902
  395   1HG2  VAL  50          HG21      VAL  50  -5.324   7.962 -10.079
  396   2HG2  VAL  50          HG22      VAL  50  -4.269   7.226 -11.288
  397   3HG2  VAL  50          HG23      VAL  50  -3.607   7.760  -9.742
  398    H    VAL  51           HN       VAL  51  -7.475   4.749  -8.874
  399    HA   VAL  51           HA       VAL  51  -6.807   2.374  -7.562
  400    HB   VAL  51           HB       VAL  51  -9.510   3.416  -8.487
  401   1HG1  VAL  51          HG11      VAL  51  -9.853   1.056  -8.187
  402   2HG1  VAL  51          HG12      VAL  51 -10.448   1.847  -6.729
  403   3HG1  VAL  51          HG13      VAL  51  -8.880   1.045  -6.717
  404   1HG2  VAL  51          HG21      VAL  51  -8.495   3.271  -5.652
  405   2HG2  VAL  51          HG22      VAL  51  -9.680   4.372  -6.354
  406   3HG2  VAL  51          HG23      VAL  51  -7.967   4.579  -6.709
  407    H    ASP  52           HN       ASP  52  -8.760   2.565 -10.579
  408    HA   ASP  52           HA       ASP  52  -8.896  -0.204 -11.098
  409   1HB   ASP  52          HB2       ASP  52 -10.037   1.573 -12.458
  410   2HB   ASP  52          HB1       ASP  52  -8.474   1.982 -13.165
  411    H    THR  53           HN       THR  53  -6.294   2.128 -11.616
  412    HA   THR  53           HA       THR  53  -4.549   0.139 -12.847
  413    HB   THR  53           HB       THR  53  -3.961   2.942 -12.002
  414    HG1  THR  53           HG1      THR  53  -5.223   1.862 -14.100
  415   1HG2  THR  53          HG21      THR  53  -2.384   1.097 -13.801
  416   2HG2  THR  53          HG22      THR  53  -1.955   1.424 -12.124
  417   3HG2  THR  53          HG23      THR  53  -1.929   2.727 -13.311
  418    H    TYR  54           HN       TYR  54  -5.227   1.333  -9.697
  419    HA   TYR  54           HA       TYR  54  -3.108  -0.468  -8.581
  420   1HB   TYR  54          HB2       TYR  54  -3.874   2.301  -7.642
  421   2HB   TYR  54          HB1       TYR  54  -2.952   1.163  -6.663
  422    HD1  TYR  54           HD1      TYR  54  -2.986   2.607 -10.076
  423    HD2  TYR  54           HD2      TYR  54  -0.609   1.200  -6.831
  424    HE1  TYR  54           HE1      TYR  54  -0.976   3.378 -11.269
  425    HE2  TYR  54           HE2      TYR  54   1.448   1.944  -8.012
  426    HH   TYR  54           HH       TYR  54   1.730   4.011 -10.076
  427    H    GLY  55           HN       GLY  55  -4.962  -1.965  -8.484
  428   1HA   GLY  55          HA2       GLY  55  -6.487  -1.592  -5.972
  429   2HA   GLY  55          HA1       GLY  55  -7.415  -1.895  -7.447
  430    H    SER  56           HN       SER  56  -7.474  -4.022  -8.269
  431    HA   SER  56           HA       SER  56  -7.147  -6.163  -6.533
  432   1HB   SER  56          HB2       SER  56  -6.540  -6.535  -9.458
  433   2HB   SER  56          HB1       SER  56  -7.424  -7.597  -8.366
  434    HG   SER  56           HG       SER  56  -8.231  -5.222  -9.630
  435    H    SER  57           HN       SER  57  -4.621  -4.351  -8.014
  436    HA   SER  57           HA       SER  57  -2.622  -6.514  -7.569
  437   1HB   SER  57          HB2       SER  57  -2.394  -3.750  -8.793
  438   2HB   SER  57          HB1       SER  57  -0.994  -4.769  -8.444
  439    HG   SER  57           HG       SER  57  -2.719  -6.300  -9.678
  440    H    ILE  58           HN       ILE  58  -2.231  -3.037  -6.948
  441    HA   ILE  58           HA       ILE  58  -0.571  -2.910  -4.842
  442    HB   ILE  58           HB       ILE  58  -1.883  -1.004  -5.739
  443   1HG1  ILE  58          HG12      ILE  58  -1.756  -1.381  -2.739
  444   2HG1  ILE  58          HG11      ILE  58  -0.648  -0.459  -3.762
  445   1HG2  ILE  58          HG21      ILE  58  -4.035  -1.730  -3.802
  446   2HG2  ILE  58          HG22      ILE  58  -4.076  -2.310  -5.472
  447   3HG2  ILE  58          HG23      ILE  58  -4.100  -0.588  -5.131
  448   1HD1  ILE  58          HD11      ILE  58  -2.004   1.203  -2.742
  449   2HD1  ILE  58          HD12      ILE  58  -3.472   0.235  -2.931
  450   3HD1  ILE  58          HD13      ILE  58  -2.727   0.994  -4.340
  451    H    LEU  59           HN       LEU  59  -3.968  -3.827  -4.497
  452    HA   LEU  59           HA       LEU  59  -3.704  -4.307  -1.648
  453   1HB   LEU  59          HB2       LEU  59  -5.876  -5.576  -3.322
  454   2HB   LEU  59          HB1       LEU  59  -5.944  -5.058  -1.642
  455    HG   LEU  59           HG       LEU  59  -5.608  -3.140  -3.933
  456   1HD1  LEU  59          HD11      LEU  59  -8.132  -3.959  -2.532
  457   2HD1  LEU  59          HD12      LEU  59  -7.710  -4.345  -4.202
  458   3HD1  LEU  59          HD13      LEU  59  -7.996  -2.669  -3.724
  459   1HD2  LEU  59          HD21      LEU  59  -6.530  -2.720  -1.088
  460   2HD2  LEU  59          HD22      LEU  59  -6.291  -1.465  -2.306
  461   3HD2  LEU  59          HD23      LEU  59  -4.908  -2.350  -1.677
  462    H    SER  60           HN       SER  60  -3.996  -6.549  -4.465
  463    HA   SER  60           HA       SER  60  -3.359  -8.837  -2.714
  464   1HB   SER  60          HB2       SER  60  -5.042  -8.841  -4.653
  465   2HB   SER  60          HB1       SER  60  -3.639  -8.923  -5.714
  466    HG   SER  60           HG       SER  60  -4.417 -10.738  -3.677
  467    H    ILE  61           HN       ILE  61  -1.436  -6.590  -4.178
  468    HA   ILE  61           HA       ILE  61   0.623  -8.423  -5.203
  469    HB   ILE  61           HB       ILE  61  -0.061  -6.008  -5.989
  470   1HG1  ILE  61          HG12      ILE  61   1.769  -7.455  -6.907
  471   2HG1  ILE  61          HG11      ILE  61   1.998  -5.734  -7.112
  472   1HG2  ILE  61          HG21      ILE  61   2.021  -5.311  -3.920
  473   2HG2  ILE  61          HG22      ILE  61   0.311  -4.886  -3.875
  474   3HG2  ILE  61          HG23      ILE  61   1.346  -4.226  -5.129
  475   1HD1  ILE  61          HD11      ILE  61   4.062  -6.901  -6.380
  476   2HD1  ILE  61          HD12      ILE  61   3.242  -7.379  -4.897
  477   3HD1  ILE  61          HD13      ILE  61   3.538  -5.672  -5.230
  478    H    LEU  62           HN       LEU  62   0.451  -6.067  -2.532
  479    HA   LEU  62           HA       LEU  62   2.875  -6.683  -1.271
  480   1HB   LEU  62          HB2       LEU  62   0.282  -6.036   0.116
  481   2HB   LEU  62          HB1       LEU  62   1.908  -5.811   0.768
  482    HG   LEU  62           HG       LEU  62   0.866  -4.490  -1.740
  483   1HD1  LEU  62          HD11      LEU  62  -0.266  -3.638   0.273
  484   2HD1  LEU  62          HD12      LEU  62   0.821  -2.422  -0.396
  485   3HD1  LEU  62          HD13      LEU  62   1.301  -3.344   1.028
  486   1HD2  LEU  62          HD21      LEU  62   2.975  -3.011  -1.159
  487   2HD2  LEU  62          HD22      LEU  62   3.161  -4.518  -2.053
  488   3HD2  LEU  62          HD23      LEU  62   3.499  -4.470  -0.323
  489    H    LEU  63           HN       LEU  63   0.405  -8.838  -1.876
  490    HA   LEU  63           HA       LEU  63   0.647 -10.428   0.546
  491   1HB   LEU  63          HB2       LEU  63  -0.632 -10.820  -2.153
  492   2HB   LEU  63          HB1       LEU  63  -0.700 -12.043  -0.892
  493    HG   LEU  63           HG       LEU  63  -2.667 -10.368  -1.123
  494   1HD1  LEU  63          HD11      LEU  63  -2.347 -11.968   0.755
  495   2HD1  LEU  63          HD12      LEU  63  -3.108 -10.464   1.268
  496   3HD1  LEU  63          HD13      LEU  63  -1.400 -10.742   1.598
  497   1HD2  LEU  63          HD21      LEU  63  -1.296  -8.298  -1.167
  498   2HD2  LEU  63          HD22      LEU  63  -0.797  -8.622   0.499
  499   3HD2  LEU  63          HD23      LEU  63  -2.484  -8.298   0.132
  500    H    GLU  64           HN       GLU  64   1.484 -11.087  -2.904
  501    HA   GLU  64           HA       GLU  64   3.645 -12.937  -1.902
  502   1HB   GLU  64          HB2       GLU  64   1.667 -13.366  -4.147
  503   2HB   GLU  64          HB1       GLU  64   3.032 -14.431  -3.795
  504   1HG   GLU  64          HG2       GLU  64   2.142 -14.870  -1.550
  505   2HG   GLU  64          HG1       GLU  64   0.802 -13.763  -1.850
  506    H    GLU  65           HN       GLU  65   2.475 -11.512  -4.974
  507    HA   GLU  65           HA       GLU  65   4.704 -11.764  -6.529
  508   1HB   GLU  65          HB2       GLU  65   3.249  -9.135  -6.411
  509   2HB   GLU  65          HB1       GLU  65   3.994  -9.890  -7.816
  510   1HG   GLU  65          HG2       GLU  65   1.537 -10.849  -6.325
  511   2HG   GLU  65          HG1       GLU  65   1.598 -10.215  -7.968
  512    H    VAL  66           HN       VAL  66   4.523  -9.931  -3.700
  513    HA   VAL  66           HA       VAL  66   7.342  -9.029  -4.091
  514    HB   VAL  66           HB       VAL  66   5.645  -7.241  -4.699
  515   1HG1  VAL  66          HG11      VAL  66   5.200  -6.914  -1.749
  516   2HG1  VAL  66          HG12      VAL  66   4.174  -7.989  -2.684
  517   3HG1  VAL  66          HG13      VAL  66   4.252  -6.278  -3.093
  518   1HG2  VAL  66          HG21      VAL  66   7.780  -6.940  -2.612
  519   2HG2  VAL  66          HG22      VAL  66   6.794  -5.543  -3.013
  520   3HG2  VAL  66          HG23      VAL  66   7.746  -6.330  -4.264
  521    H    SER  67           HN       SER  67   8.541  -9.465  -2.279
  522    HA   SER  67           HA       SER  67   7.249 -10.623   0.050
  523   1HB   SER  67          HB2       SER  67   9.901 -10.567  -0.982
  524   2HB   SER  67          HB1       SER  67   9.990  -9.850   0.622
  525    HG   SER  67           HG       SER  67   9.716 -11.770   1.395
  526    HA   PRO  68           HA       PRO  68   6.503  -7.039   2.467
  527   1HB   PRO  68          HB2       PRO  68   7.668  -7.776   4.951
  528   2HB   PRO  68          HB1       PRO  68   6.006  -8.093   4.426
  529   1HG   PRO  68          HG2       PRO  68   8.281  -9.978   4.603
  530   2HG   PRO  68          HG1       PRO  68   6.548 -10.328   4.504
  531   1HD   PRO  68          HD2       PRO  68   8.416 -10.646   2.403
  532   2HD   PRO  68          HD1       PRO  68   6.648 -10.637   2.236
  533    H    GLU  69           HN       GLU  69   9.826  -8.236   3.179
  534    HA   GLU  69           HA       GLU  69  10.868  -5.691   3.935
  535   1HB   GLU  69          HB2       GLU  69  13.079  -6.683   3.620
  536   2HB   GLU  69          HB1       GLU  69  12.010  -7.844   4.404
  537   1HG   GLU  69          HG2       GLU  69  11.555  -8.856   2.150
  538   2HG   GLU  69          HG1       GLU  69  12.775  -7.777   1.471
  539    H    LEU  70           HN       LEU  70  10.436  -7.153   0.752
  540    HA   LEU  70           HA       LEU  70  12.128  -5.327  -0.674
  541   1HB   LEU  70          HB2       LEU  70  11.474  -7.314  -1.808
  542   2HB   LEU  70          HB1       LEU  70   9.771  -7.036  -1.474
  543    HG   LEU  70           HG       LEU  70   9.729  -5.134  -3.004
  544   1HD1  LEU  70          HD11      LEU  70  11.886  -4.148  -2.720
  545   2HD1  LEU  70          HD12      LEU  70  11.869  -4.731  -4.379
  546   3HD1  LEU  70          HD13      LEU  70  12.712  -5.648  -3.131
  547   1HD2  LEU  70          HD21      LEU  70   9.939  -6.322  -5.042
  548   2HD2  LEU  70          HD22      LEU  70   9.650  -7.590  -3.851
  549   3HD2  LEU  70          HD23      LEU  70  11.282  -7.295  -4.444
  550    H    VAL  71           HN       VAL  71   8.600  -5.296  -0.045
  551    HA   VAL  71           HA       VAL  71   7.847  -2.976  -1.361
  552    HB   VAL  71           HB       VAL  71   6.928  -3.257   1.492
  553   1HG1  VAL  71          HG11      VAL  71   4.799  -2.683   0.561
  554   2HG1  VAL  71          HG12      VAL  71   5.354  -3.010  -1.080
  555   3HG1  VAL  71          HG13      VAL  71   5.977  -1.615  -0.201
  556   1HG2  VAL  71          HG21      VAL  71   5.438  -5.138   0.696
  557   2HG2  VAL  71          HG22      VAL  71   7.133  -5.542   0.872
  558   3HG2  VAL  71          HG23      VAL  71   6.471  -5.252  -0.727
  559    H    CYS  72           HN       CYS  72   9.106  -3.056   1.994
  560    HA   CYS  72           HA       CYS  72   9.295  -0.272   2.378
  561   1HB   CYS  72          HB2       CYS  72   9.866  -1.924   4.156
  562   2HB   CYS  72          HB1       CYS  72  11.370  -2.292   3.305
  563    H    SER  73           HN       SER  73  11.330  -2.409   0.470
  564    HA   SER  73           HA       SER  73  13.353  -0.380  -0.057
  565   1HB   SER  73          HB2       SER  73  13.027  -3.167  -0.585
  566   2HB   SER  73          HB1       SER  73  13.293  -2.380  -2.136
  567    HG   SER  73           HG       SER  73  15.298  -2.633  -1.403
  568    H    MET  74           HN       MET  74  10.802  -1.854  -2.146
  569    HA   MET  74           HA       MET  74  11.028  -0.061  -4.307
  570   1HB   MET  74          HB2       MET  74   8.591  -1.426  -3.130
  571   2HB   MET  74          HB1       MET  74   8.509  -0.460  -4.601
  572   1HG   MET  74          HG2       MET  74  10.478  -1.983  -5.416
  573   2HG   MET  74          HG1       MET  74   9.940  -3.066  -4.133
  574   1HE   MET  74          HE1       MET  74   7.659  -3.516  -3.651
  575   2HE   MET  74          HE2       MET  74   6.535  -4.152  -4.856
  576   3HE   MET  74          HE3       MET  74   6.449  -2.454  -4.384
  577    H    LEU  75           HN       LEU  75   9.092   0.279  -1.337
  578    HA   LEU  75           HA       LEU  75   7.955   2.812  -1.972
  579   1HB   LEU  75          HB2       LEU  75   8.727   1.706   0.749
  580   2HB   LEU  75          HB1       LEU  75   7.635   3.060   0.475
  581    HG   LEU  75           HG       LEU  75   7.135   0.340  -0.751
  582   1HD1  LEU  75          HD11      LEU  75   5.439   0.160   1.218
  583   2HD1  LEU  75          HD12      LEU  75   6.475   1.344   2.014
  584   3HD1  LEU  75          HD13      LEU  75   7.131  -0.221   1.533
  585   1HD2  LEU  75          HD21      LEU  75   5.468   2.815  -0.243
  586   2HD2  LEU  75          HD22      LEU  75   4.736   1.250  -0.587
  587   3HD2  LEU  75          HD23      LEU  75   5.788   2.008  -1.778
  588    H    HIS  76           HN       HIS  76  11.149   1.879  -0.968
  589    HA   HIS  76           HA       HIS  76  13.060   3.152  -0.476
  590   1HB   HIS  76          HB2       HIS  76  11.593   4.635  -2.654
  591   2HB   HIS  76          HB1       HIS  76  13.104   5.280  -2.015
  592    HD1  HIS  76           HD1      HIS  76  15.090   3.272  -1.912
  593    HD2  HIS  76           HD2      HIS  76  12.042   2.890  -4.730
  594    HE1  HIS  76           HE1      HIS  76  15.939   1.661  -3.672
  595    H    LEU  77           HN       LEU  77  10.944   3.545   1.419
  596    HA   LEU  77           HA       LEU  77  10.720   6.434   1.888
  597   1HB   LEU  77          HB2       LEU  77   9.340   5.878   3.743
  598   2HB   LEU  77          HB1       LEU  77   8.952   4.693   2.503
  599    HG   LEU  77           HG       LEU  77  11.004   3.393   3.825
  600   1HD1  LEU  77          HD11      LEU  77   9.457   4.999   5.893
  601   2HD1  LEU  77          HD12      LEU  77  11.195   5.044   5.604
  602   3HD1  LEU  77          HD13      LEU  77  10.450   3.592   6.266
  603   1HD2  LEU  77          HD21      LEU  77   9.159   2.136   5.012
  604   2HD2  LEU  77          HD22      LEU  77   8.916   2.314   3.273
  605   3HD2  LEU  77          HD23      LEU  77   8.026   3.340   4.396
  606    H    CYS  78           HN       CYS  78  13.101   4.144   2.349
  607    HA   CYS  78           HA       CYS  78  14.282   5.608   4.689
  608   1HB   CYS  78          HB2       CYS  78  13.861   2.892   4.431
  609   2HB   CYS  78          HB1       CYS  78  15.532   3.033   3.890
  610    H    SER  79           HN       SER  79  14.390   5.613   1.422
  611    HA   SER  79           HA       SER  79  17.116   5.380   0.720
  612   1HB   SER  79          HB2       SER  79  14.999   7.255  -0.367
  613   2HB   SER  79          HB1       SER  79  16.569   6.991  -1.123
  614    HG   SER  79           HG       SER  79  14.420   5.197  -0.761
  615    H    GLY  80           HN       GLY  80  18.554   6.282   2.199
  616   1HA   GLY  80          HA2       GLY  80  18.211   9.044   3.139
  617   2HA   GLY  80          HA1       GLY  80  19.562   7.976   3.522
  618    H    LEU  81           HN       LEU  81  19.909   7.319   0.666
  619    HA   LEU  81           HA       LEU  81  21.080   9.859  -0.357
  620   1HB   LEU  81          HB2       LEU  81  22.836   8.256  -1.407
  621   2HB   LEU  81          HB1       LEU  81  23.007   8.662   0.293
  622    HG   LEU  81           HG       LEU  81  23.310   6.220  -0.223
  623   1HD1  LEU  81          HD11      LEU  81  22.589   5.681   1.848
  624   2HD1  LEU  81          HD12      LEU  81  20.919   6.122   1.509
  625   3HD1  LEU  81          HD13      LEU  81  22.081   7.362   1.972
  626   1HD2  LEU  81          HD21      LEU  81  21.452   6.229  -1.998
  627   2HD2  LEU  81          HD22      LEU  81  20.314   6.124  -0.656
  628   3HD2  LEU  81          HD23      LEU  81  21.495   4.844  -0.912
  629    H    VAL  82           HN       VAL  82  21.769   9.163  -2.832
  630    HA   VAL  82           HA       VAL  82  19.182   8.533  -4.018
  631    HB   VAL  82           HB       VAL  82  20.598   8.691  -6.214
  632   1HG1  VAL  82          HG11      VAL  82  20.273  11.097  -4.395
  633   2HG1  VAL  82          HG12      VAL  82  19.008  10.407  -5.413
  634   3HG1  VAL  82          HG13      VAL  82  20.434  11.141  -6.152
  635   1HG2  VAL  82          HG21      VAL  82  22.699   9.869  -5.983
  636   2HG2  VAL  82          HG22      VAL  82  22.762   8.466  -4.917
  637   3HG2  VAL  82          HG23      VAL  82  22.455  10.069  -4.248
  638    HA   PRO  83           HA       PRO  83  19.864   4.154  -3.941
  639   1HB   PRO  83          HB2       PRO  83  18.592   4.006  -6.617
  640   2HB   PRO  83          HB1       PRO  83  18.126   3.215  -5.101
  641   1HG   PRO  83          HG2       PRO  83  16.826   5.439  -6.209
  642   2HG   PRO  83          HG1       PRO  83  16.704   4.912  -4.525
  643   1HD   PRO  83          HD2       PRO  83  18.053   7.293  -5.582
  644   2HD   PRO  83          HD1       PRO  83  17.725   6.847  -3.887
  645    H    ARG  84           HN       ARG  84  21.790   3.174  -4.473
  646    HA   ARG  84           HA       ARG  84  23.453   4.265  -6.604
  647   1HB   ARG  84          HB2       ARG  84  23.875   1.758  -4.948
  648   2HB   ARG  84          HB1       ARG  84  25.099   2.607  -5.887
  649   1HG   ARG  84          HG2       ARG  84  23.565   4.022  -3.701
  650   2HG   ARG  84          HG1       ARG  84  24.990   3.056  -3.328
  651   1HD   ARG  84          HD2       ARG  84  24.868   5.442  -5.198
  652   2HD   ARG  84          HD1       ARG  84  25.671   5.369  -3.632
  653    HE   ARG  84           HE       ARG  84  26.871   3.333  -5.066
  654   1HH1  ARG  84          HH21      ARG  84  26.242   6.688  -5.543
  655   2HH1  ARG  84          HH22      ARG  84  27.646   6.950  -6.521
  656   1HH2  ARG  84          HH11      ARG  84  28.708   3.654  -6.345
  657   2HH2  ARG  84          HH12      ARG  84  29.043   5.232  -6.976
  Start of MODEL   19
    1   1H    SER   1           HT1      SER   1  25.703   1.112  13.915
    2   2H    SER   1           HT2      SER   1  25.113  -0.480  13.957
    3   3H    SER   1           HT3      SER   1  24.105   0.814  14.402
    4    HA   SER   1           HA       SER   1  23.855   1.560  12.234
    5   1HB   SER   1          HB2       SER   1  25.303   0.755  10.400
    6   2HB   SER   1          HB1       SER   1  26.254   1.512  11.674
    7    HG   SER   1           HG       SER   1  26.869  -0.686  10.775
    8    H    ASP   2           HN       ASP   2  23.034   0.252  10.238
    9    HA   ASP   2           HA       ASP   2  21.516  -1.386   9.511
   10   1HB   ASP   2          HB2       ASP   2  23.670  -2.679   9.518
   11   2HB   ASP   2          HB1       ASP   2  23.286  -3.222  11.151
   12    H    VAL   3           HN       VAL   3  20.645   0.033  11.764
   13    HA   VAL   3           HA       VAL   3  19.572  -1.961  13.668
   14    HB   VAL   3           HB       VAL   3  19.246   1.022  13.634
   15   1HG1  VAL   3          HG11      VAL   3  17.557   0.103  15.022
   16   2HG1  VAL   3          HG12      VAL   3  18.852   0.545  16.134
   17   3HG1  VAL   3          HG13      VAL   3  18.643  -1.137  15.649
   18   1HG2  VAL   3          HG21      VAL   3  21.243  -0.716  15.103
   19   2HG2  VAL   3          HG22      VAL   3  21.035   1.017  15.356
   20   3HG2  VAL   3          HG23      VAL   3  21.616   0.415  13.804
   21    H    TYR   4           HN       TYR   4  18.325   0.656  11.579
   22    HA   TYR   4           HA       TYR   4  15.580  -0.261  11.904
   23   1HB   TYR   4          HB2       TYR   4  16.986   1.921  10.417
   24   2HB   TYR   4          HB1       TYR   4  15.410   1.434   9.795
   25    HD1  TYR   4           HD1      TYR   4  16.464   1.329  13.372
   26    HD2  TYR   4           HD2      TYR   4  14.126   3.350  10.386
   27    HE1  TYR   4           HE1      TYR   4  15.344   2.640  15.142
   28    HE2  TYR   4           HE2      TYR   4  13.001   4.663  12.154
   29    HH   TYR   4           HH       TYR   4  13.413   5.384  14.456
   30    H    CYS   5           HN       CYS   5  18.028  -0.526   9.318
   31    HA   CYS   5           HA       CYS   5  16.456  -1.630   7.293
   32   1HB   CYS   5          HB2       CYS   5  19.190  -2.676   8.068
   33   2HB   CYS   5          HB1       CYS   5  18.449  -2.709   6.467
   34    H    GLU   6           HN       GLU   6  17.808  -3.292  10.140
   35    HA   GLU   6           HA       GLU   6  16.661  -5.865   9.374
   36   1HB   GLU   6          HB2       GLU   6  17.737  -4.911  12.047
   37   2HB   GLU   6          HB1       GLU   6  17.375  -6.584  11.626
   38   1HG   GLU   6          HG2       GLU   6  19.039  -6.475   9.795
   39   2HG   GLU   6          HG1       GLU   6  19.419  -4.813  10.250
   40    H    VAL   7           HN       VAL   7  15.976  -3.657  12.113
   41    HA   VAL   7           HA       VAL   7  13.579  -4.861  12.973
   42    HB   VAL   7           HB       VAL   7  14.210  -1.892  12.925
   43   1HG1  VAL   7          HG11      VAL   7  11.889  -2.292  13.479
   44   2HG1  VAL   7          HG12      VAL   7  12.746  -1.901  14.969
   45   3HG1  VAL   7          HG13      VAL   7  12.333  -3.576  14.605
   46   1HG2  VAL   7          HG21      VAL   7  15.369  -2.169  14.965
   47   2HG2  VAL   7          HG22      VAL   7  15.935  -3.519  13.984
   48   3HG2  VAL   7          HG23      VAL   7  14.713  -3.785  15.226
   49    H    CYS   8           HN       CYS   8  14.232  -3.042  10.120
   50    HA   CYS   8           HA       CYS   8  11.444  -2.297   9.617
   51   1HB   CYS   8          HB2       CYS   8  13.191  -0.827   8.805
   52   2HB   CYS   8          HB1       CYS   8  13.949  -2.150   7.919
   53    H    GLU   9           HN       GLU   9  13.596  -4.938   8.757
   54    HA   GLU   9           HA       GLU   9  11.702  -5.914   6.683
   55   1HB   GLU   9          HB2       GLU   9  14.230  -7.242   7.756
   56   2HB   GLU   9          HB1       GLU   9  13.235  -7.846   6.438
   57   1HG   GLU   9          HG2       GLU   9  13.769  -6.033   5.020
   58   2HG   GLU   9          HG1       GLU   9  14.391  -5.058   6.348
   59    H    PHE  10           HN       PHE  10  12.401  -6.440  10.053
   60    HA   PHE  10           HA       PHE  10  10.970  -8.980  10.199
   61   1HB   PHE  10          HB2       PHE  10  12.750  -8.474  11.805
   62   2HB   PHE  10          HB1       PHE  10  11.856  -7.064  12.374
   63    HD1  PHE  10           HD1      PHE  10  10.161  -7.279  14.021
   64    HD2  PHE  10           HD2      PHE  10  11.671 -10.776  12.036
   65    HE1  PHE  10           HE1      PHE  10   8.904  -8.717  15.600
   66    HE2  PHE  10           HE2      PHE  10  10.412 -12.215  13.616
   67    HZ   PHE  10           HZ       PHE  10   9.028 -11.186  15.398
   68    H    LEU  11           HN       LEU  11  10.177  -5.575  10.706
   69    HA   LEU  11           HA       LEU  11   7.566  -6.190  11.865
   70   1HB   LEU  11          HB2       LEU  11   8.760  -3.623  10.789
   71   2HB   LEU  11          HB1       LEU  11   7.174  -3.725  11.550
   72    HG   LEU  11           HG       LEU  11   9.772  -4.565  12.868
   73   1HD1  LEU  11          HD11      LEU  11   9.484  -2.493  14.208
   74   2HD1  LEU  11          HD12      LEU  11   8.100  -2.057  13.203
   75   3HD1  LEU  11          HD13      LEU  11   9.711  -2.144  12.493
   76   1HD2  LEU  11          HD21      LEU  11   6.875  -4.598  13.688
   77   2HD2  LEU  11          HD22      LEU  11   8.080  -4.224  14.921
   78   3HD2  LEU  11          HD23      LEU  11   8.158  -5.752  14.052
   79    H    VAL  12           HN       VAL  12   8.724  -5.074   8.678
   80    HA   VAL  12           HA       VAL  12   6.098  -4.850   7.559
   81    HB   VAL  12           HB       VAL  12   8.653  -5.470   6.063
   82   1HG1  VAL  12          HG11      VAL  12   6.048  -4.157   5.241
   83   2HG1  VAL  12          HG12      VAL  12   6.608  -5.753   4.744
   84   3HG1  VAL  12          HG13      VAL  12   7.473  -4.313   4.215
   85   1HG2  VAL  12          HG21      VAL  12   8.592  -3.389   7.673
   86   2HG2  VAL  12          HG22      VAL  12   7.496  -2.707   6.476
   87   3HG2  VAL  12          HG23      VAL  12   9.136  -3.158   6.013
   88    H    LYS  13           HN       LYS  13   8.232  -7.630   8.018
   89    HA   LYS  13           HA       LYS  13   6.673  -9.303   6.191
   90   1HB   LYS  13          HB2       LYS  13   8.170 -11.028   6.659
   91   2HB   LYS  13          HB1       LYS  13   9.151  -9.579   6.776
   92   1HG   LYS  13          HG2       LYS  13   9.791 -10.217   8.826
   93   2HG   LYS  13          HG1       LYS  13   8.160 -10.017   9.400
   94   1HD   LYS  13          HD2       LYS  13   9.072 -12.572   8.058
   95   2HD   LYS  13          HD1       LYS  13   9.307 -12.296   9.780
   96   1HE   LYS  13          HE2       LYS  13   6.869 -11.862  10.007
   97   2HE   LYS  13          HE1       LYS  13   6.667 -12.290   8.310
   98   1HZ   LYS  13          HZ1       LYS  13   7.632 -14.463   8.799
   99   2HZ   LYS  13          HZ2       LYS  13   6.228 -14.187   9.713
  100   3HZ   LYS  13          HZ3       LYS  13   7.758 -14.047  10.438
  101    H    GLU  14           HN       GLU  14   6.649  -8.584   9.623
  102    HA   GLU  14           HA       GLU  14   4.852 -10.757  10.350
  103   1HB   GLU  14          HB2       GLU  14   6.374  -9.582  11.973
  104   2HB   GLU  14          HB1       GLU  14   5.348  -8.154  11.825
  105   1HG   GLU  14          HG2       GLU  14   3.429  -9.378  12.671
  106   2HG   GLU  14          HG1       GLU  14   4.346 -10.885  12.679
  107    H    VAL  15           HN       VAL  15   4.341  -7.221  10.225
  108    HA   VAL  15           HA       VAL  15   1.576  -7.121  10.445
  109    HB   VAL  15           HB       VAL  15   3.141  -5.147  10.142
  110   1HG1  VAL  15          HG11      VAL  15   3.731  -4.443   7.924
  111   2HG1  VAL  15          HG12      VAL  15   2.730  -5.695   7.190
  112   3HG1  VAL  15          HG13      VAL  15   4.200  -6.137   8.057
  113   1HG2  VAL  15          HG21      VAL  15   1.427  -3.836   8.792
  114   2HG2  VAL  15          HG22      VAL  15   0.773  -4.739  10.160
  115   3HG2  VAL  15          HG23      VAL  15   0.589  -5.365   8.522
  116    H    THR  16           HN       THR  16   3.511  -7.977   7.615
  117    HA   THR  16           HA       THR  16   1.425  -8.243   5.727
  118    HB   THR  16           HB       THR  16   3.304 -10.394   5.344
  119    HG1  THR  16           HG1      THR  16   4.937  -9.755   6.383
  120   1HG2  THR  16          HG21      THR  16   4.120  -8.948   3.525
  121   2HG2  THR  16          HG22      THR  16   3.308  -7.559   4.251
  122   3HG2  THR  16          HG23      THR  16   2.350  -8.891   3.588
  123    H    LYS  17           HN       LYS  17   2.682 -10.582   8.131
  124    HA   LYS  17           HA       LYS  17   1.163 -12.832   7.556
  125   1HB   LYS  17          HB2       LYS  17   1.724 -11.654  10.300
  126   2HB   LYS  17          HB1       LYS  17   1.106 -13.280  10.021
  127   1HG   LYS  17          HG2       LYS  17   3.093 -13.834   8.686
  128   2HG   LYS  17          HG1       LYS  17   3.709 -12.200   8.908
  129   1HD   LYS  17          HD2       LYS  17   4.851 -13.391  10.576
  130   2HD   LYS  17          HD1       LYS  17   3.490 -12.712  11.465
  131   1HE   LYS  17          HE2       LYS  17   2.277 -14.810  11.328
  132   2HE   LYS  17          HE1       LYS  17   3.496 -15.495  10.254
  133   1HZ   LYS  17          HZ1       LYS  17   4.519 -14.453  12.747
  134   2HZ   LYS  17          HZ2       LYS  17   4.877 -15.907  11.945
  135   3HZ   LYS  17          HZ3       LYS  17   3.487 -15.790  12.914
  136    H    LEU  18           HN       LEU  18   0.069  -9.838   9.088
  137    HA   LEU  18           HA       LEU  18  -2.711 -10.931   9.244
  138   1HB   LEU  18          HB2       LEU  18  -2.546  -8.101   9.977
  139   2HB   LEU  18          HB1       LEU  18  -3.039  -9.469  10.961
  140    HG   LEU  18           HG       LEU  18  -0.136  -8.774  10.445
  141   1HD1  LEU  18          HD11      LEU  18  -0.268  -7.906  12.825
  142   2HD1  LEU  18          HD12      LEU  18  -2.024  -7.950  12.652
  143   3HD1  LEU  18          HD13      LEU  18  -1.060  -6.907  11.604
  144   1HD2  LEU  18          HD21      LEU  18  -1.328 -10.365  12.722
  145   2HD2  LEU  18          HD22      LEU  18   0.329 -10.383  12.120
  146   3HD2  LEU  18          HD23      LEU  18  -0.959 -11.144  11.184
  147    H    ILE  19           HN       ILE  19  -1.099  -7.999   7.930
  148    HA   ILE  19           HA       ILE  19  -3.152  -7.056   6.302
  149    HB   ILE  19           HB       ILE  19  -0.220  -6.939   6.407
  150   1HG1  ILE  19          HG12      ILE  19  -2.138  -4.797   5.509
  151   2HG1  ILE  19          HG11      ILE  19  -1.857  -5.185   7.206
  152   1HG2  ILE  19          HG21      ILE  19  -1.569  -6.556   3.742
  153   2HG2  ILE  19          HG22      ILE  19  -0.211  -7.615   4.125
  154   3HG2  ILE  19          HG23      ILE  19   0.006  -5.868   4.136
  155   1HD1  ILE  19          HD11      ILE  19   0.739  -4.939   6.223
  156   2HD1  ILE  19          HD12      ILE  19  -0.158  -3.679   7.077
  157   3HD1  ILE  19          HD13      ILE  19  -0.150  -3.709   5.318
  158    H    ASP  20           HN       ASP  20  -1.278  -9.950   6.032
  159    HA   ASP  20           HA       ASP  20  -1.512 -10.507   3.269
  160   1HB   ASP  20          HB2       ASP  20  -0.060 -11.886   4.574
  161   2HB   ASP  20          HB1       ASP  20  -1.360 -12.333   5.680
  162    H    ASN  21           HN       ASN  21  -3.887 -10.619   5.839
  163    HA   ASN  21           HA       ASN  21  -5.928 -11.513   3.882
  164   1HB   ASN  21          HB2       ASN  21  -5.634 -12.604   6.678
  165   2HB   ASN  21          HB1       ASN  21  -6.973 -12.957   5.583
  166   1HD2  ASN  21          HD21      ASN  21  -5.615 -13.325   3.143
  167   2HD2  ASN  21          HD22      ASN  21  -4.574 -14.661   3.270
  168    H    ASN  22           HN       ASN  22  -6.136 -10.955   7.310
  169    HA   ASN  22           HA       ASN  22  -8.342  -9.772   7.948
  170   1HB   ASN  22          HB2       ASN  22  -5.946  -8.010   8.427
  171   2HB   ASN  22          HB1       ASN  22  -7.289  -8.366   9.510
  172   1HD2  ASN  22          HD21      ASN  22  -5.029 -10.549   7.652
  173   2HD2  ASN  22          HD22      ASN  22  -4.540 -11.416   9.039
  174    H    LYS  23           HN       LYS  23  -5.987  -7.837   6.127
  175    HA   LYS  23           HA       LYS  23  -7.925  -5.727   5.625
  176   1HB   LYS  23          HB2       LYS  23  -5.132  -5.944   5.605
  177   2HB   LYS  23          HB1       LYS  23  -5.525  -5.768   3.901
  178   1HG   LYS  23          HG2       LYS  23  -6.449  -3.930   6.131
  179   2HG   LYS  23          HG1       LYS  23  -5.145  -3.573   5.004
  180   1HD   LYS  23          HD2       LYS  23  -7.712  -4.328   3.698
  181   2HD   LYS  23          HD1       LYS  23  -7.788  -2.839   4.624
  182   1HE   LYS  23          HE2       LYS  23  -5.494  -3.252   2.721
  183   2HE   LYS  23          HE1       LYS  23  -7.068  -2.770   2.093
  184   1HZ   LYS  23          HZ1       LYS  23  -5.618  -1.362   4.267
  185   2HZ   LYS  23          HZ2       LYS  23  -7.068  -0.871   3.531
  186   3HZ   LYS  23          HZ3       LYS  23  -5.620  -0.877   2.642
  187    H    THR  24           HN       THR  24  -9.629  -6.523   4.385
  188    HA   THR  24           HA       THR  24  -9.024  -8.089   1.933
  189    HB   THR  24           HB       THR  24 -11.554  -8.232   1.813
  190    HG1  THR  24           HG1      THR  24 -12.704  -7.441   3.484
  191   1HG2  THR  24          HG21      THR  24 -10.018  -9.204   4.227
  192   2HG2  THR  24          HG22      THR  24 -10.374 -10.085   2.741
  193   3HG2  THR  24          HG23      THR  24 -11.668  -9.724   3.882
  194    H    GLU  25           HN       GLU  25 -10.595  -7.396   0.020
  195    HA   GLU  25           HA       GLU  25 -10.070  -4.490  -0.458
  196   1HB   GLU  25          HB2       GLU  25 -10.916  -6.510  -2.540
  197   2HB   GLU  25          HB1       GLU  25 -10.053  -4.988  -2.769
  198   1HG   GLU  25          HG2       GLU  25  -8.162  -6.001  -1.388
  199   2HG   GLU  25          HG1       GLU  25  -9.002  -7.544  -1.535
  200    H    LYS  26           HN       LYS  26 -12.541  -6.060   0.843
  201    HA   LYS  26           HA       LYS  26 -14.705  -5.087  -0.907
  202   1HB   LYS  26          HB2       LYS  26 -14.728  -6.391   1.837
  203   2HB   LYS  26          HB1       LYS  26 -16.175  -5.962   0.928
  204   1HG   LYS  26          HG2       LYS  26 -15.740  -7.544  -0.764
  205   2HG   LYS  26          HG1       LYS  26 -14.045  -7.706  -0.311
  206   1HD   LYS  26          HD2       LYS  26 -16.177  -8.461   1.684
  207   2HD   LYS  26          HD1       LYS  26 -15.786  -9.578   0.379
  208   1HE   LYS  26          HE2       LYS  26 -13.387  -9.486   1.057
  209   2HE   LYS  26          HE1       LYS  26 -13.834  -8.454   2.414
  210   1HZ   LYS  26          HZ1       LYS  26 -14.551 -10.194   3.565
  211   2HZ   LYS  26          HZ2       LYS  26 -13.807 -11.183   2.401
  212   3HZ   LYS  26          HZ3       LYS  26 -15.455 -10.797   2.263
  213    H    GLU  27           HN       GLU  27 -13.326  -4.410   2.287
  214    HA   GLU  27           HA       GLU  27 -15.037  -2.164   2.823
  215   1HB   GLU  27          HB2       GLU  27 -12.333  -2.952   3.946
  216   2HB   GLU  27          HB1       GLU  27 -13.316  -1.630   4.579
  217   1HG   GLU  27          HG2       GLU  27 -14.302  -4.483   4.341
  218   2HG   GLU  27          HG1       GLU  27 -13.608  -3.810   5.814
  219    H    ILE  28           HN       ILE  28 -12.372  -2.624   0.743
  220    HA   ILE  28           HA       ILE  28 -11.508   0.189   0.792
  221    HB   ILE  28           HB       ILE  28 -10.734  -2.140  -0.979
  222   1HG1  ILE  28          HG12      ILE  28 -10.071  -2.499   1.350
  223   2HG1  ILE  28          HG11      ILE  28  -8.652  -2.147   0.372
  224   1HG2  ILE  28          HG21      ILE  28  -8.730  -0.557  -1.385
  225   2HG2  ILE  28          HG22      ILE  28  -9.794   0.713  -0.788
  226   3HG2  ILE  28          HG23      ILE  28 -10.243  -0.221  -2.216
  227   1HD1  ILE  28          HD11      ILE  28  -9.141   0.348   1.137
  228   2HD1  ILE  28          HD12      ILE  28  -8.272  -0.763   2.188
  229   3HD1  ILE  28          HD13      ILE  28  -9.987  -0.462   2.453
  230    H    LEU  29           HN       LEU  29 -12.273  -1.878  -2.011
  231    HA   LEU  29           HA       LEU  29 -12.959   0.149  -3.774
  232   1HB   LEU  29          HB2       LEU  29 -14.234  -2.593  -3.545
  233   2HB   LEU  29          HB1       LEU  29 -14.379  -1.539  -4.951
  234    HG   LEU  29           HG       LEU  29 -11.643  -2.253  -3.884
  235   1HD1  LEU  29          HD11      LEU  29 -12.597  -4.419  -4.151
  236   2HD1  LEU  29          HD12      LEU  29 -11.661  -4.119  -5.616
  237   3HD1  LEU  29          HD13      LEU  29 -13.418  -3.954  -5.642
  238   1HD2  LEU  29          HD21      LEU  29 -11.688  -0.535  -5.596
  239   2HD2  LEU  29          HD22      LEU  29 -12.760  -1.498  -6.609
  240   3HD2  LEU  29          HD23      LEU  29 -11.096  -2.015  -6.345
  241    H    ASP  30           HN       ASP  30 -14.661  -0.849  -0.971
  242    HA   ASP  30           HA       ASP  30 -17.243   0.283  -1.775
  243   1HB   ASP  30          HB2       ASP  30 -16.079  -0.660   0.856
  244   2HB   ASP  30          HB1       ASP  30 -17.643   0.154   0.780
  245    H    ALA  31           HN       ALA  31 -14.552   1.191   0.369
  246    HA   ALA  31           HA       ALA  31 -15.437   3.717   1.175
  247   1HB   ALA  31          HB1       ALA  31 -13.233   4.187   1.750
  248   2HB   ALA  31          HB2       ALA  31 -12.575   3.272   0.389
  249   3HB   ALA  31          HB3       ALA  31 -13.277   2.427   1.770
  250    H    PHE  32           HN       PHE  32 -13.609   2.903  -1.788
  251    HA   PHE  32           HA       PHE  32 -13.573   5.547  -2.847
  252   1HB   PHE  32          HB2       PHE  32 -13.920   3.062  -4.536
  253   2HB   PHE  32          HB1       PHE  32 -13.112   4.561  -4.970
  254    HD1  PHE  32           HD1      PHE  32 -11.979   1.747  -5.176
  255    HD2  PHE  32           HD2      PHE  32 -11.665   4.693  -2.067
  256    HE1  PHE  32           HE1      PHE  32  -9.803   0.801  -4.493
  257    HE2  PHE  32           HE2      PHE  32  -9.501   3.737  -1.381
  258    HZ   PHE  32           HZ       PHE  32  -8.562   1.794  -2.594
  259    H    ASP  33           HN       ASP  33 -16.113   3.089  -2.775
  260    HA   ASP  33           HA       ASP  33 -17.835   4.629  -4.567
  261   1HB   ASP  33          HB2       ASP  33 -18.505   2.351  -2.669
  262   2HB   ASP  33          HB1       ASP  33 -19.584   3.002  -3.904
  263    H    LYS  34           HN       LYS  34 -16.731   5.191  -1.555
  264    HA   LYS  34           HA       LYS  34 -19.213   6.669  -0.708
  265   1HB   LYS  34          HB2       LYS  34 -17.027   5.394   0.974
  266   2HB   LYS  34          HB1       LYS  34 -18.333   6.384   1.622
  267   1HG   LYS  34          HG2       LYS  34 -19.929   4.734   1.322
  268   2HG   LYS  34          HG1       LYS  34 -19.130   4.061  -0.098
  269   1HD   LYS  34          HD2       LYS  34 -19.094   2.612   2.010
  270   2HD   LYS  34          HD1       LYS  34 -17.537   2.882   1.240
  271   1HE   LYS  34          HE2       LYS  34 -16.766   4.234   2.962
  272   2HE   LYS  34          HE1       LYS  34 -18.384   4.825   3.354
  273   1HZ   LYS  34          HZ1       LYS  34 -17.176   2.216   4.048
  274   2HZ   LYS  34          HZ2       LYS  34 -18.851   2.489   4.134
  275   3HZ   LYS  34          HZ3       LYS  34 -17.789   3.402   5.094
  276    H    MET  35           HN       MET  35 -15.841   6.610   0.307
  277    HA   MET  35           HA       MET  35 -15.560   9.369   0.803
  278   1HB   MET  35          HB2       MET  35 -13.924   8.054   1.777
  279   2HB   MET  35          HB1       MET  35 -13.780   7.039   0.357
  280   1HG   MET  35          HG2       MET  35 -12.522   8.841  -0.807
  281   2HG   MET  35          HG1       MET  35 -12.700   9.869   0.617
  282   1HE   MET  35          HE1       MET  35 -10.327   6.066  -0.022
  283   2HE   MET  35          HE2       MET  35 -11.815   6.618  -0.788
  284   3HE   MET  35          HE3       MET  35 -11.886   5.804   0.775
  285    H    CYS  36           HN       CYS  36 -14.659   7.513  -2.147
  286    HA   CYS  36           HA       CYS  36 -14.010  10.051  -3.521
  287   1HB   CYS  36          HB2       CYS  36 -12.663   7.967  -3.911
  288   2HB   CYS  36          HB1       CYS  36 -14.082   7.236  -4.654
  289    H    SER  37           HN       SER  37 -16.786   9.058  -2.568
  290    HA   SER  37           HA       SER  37 -18.280   9.033  -5.123
  291   1HB   SER  37          HB2       SER  37 -18.841   7.608  -3.035
  292   2HB   SER  37          HB1       SER  37 -19.492   9.095  -2.358
  293    HG   SER  37           HG       SER  37 -21.199   8.425  -3.433
  294    H    LYS  38           HN       LYS  38 -17.502  11.139  -2.442
  295    HA   LYS  38           HA       LYS  38 -19.403  13.226  -3.342
  296   1HB   LYS  38          HB2       LYS  38 -18.606  14.456  -1.354
  297   2HB   LYS  38          HB1       LYS  38 -19.122  12.825  -0.923
  298   1HG   LYS  38          HG2       LYS  38 -16.673  12.130  -1.202
  299   2HG   LYS  38          HG1       LYS  38 -16.295  13.851  -1.246
  300   1HD   LYS  38          HD2       LYS  38 -17.550  14.068   0.953
  301   2HD   LYS  38          HD1       LYS  38 -17.588  12.305   1.011
  302   1HE   LYS  38          HE2       LYS  38 -15.127  12.240   0.898
  303   2HE   LYS  38          HE1       LYS  38 -15.080  14.002   0.825
  304   1HZ   LYS  38          HZ1       LYS  38 -16.556  12.770   3.026
  305   2HZ   LYS  38          HZ2       LYS  38 -15.650  14.208   2.995
  306   3HZ   LYS  38          HZ3       LYS  38 -14.862  12.705   3.088
  307    H    LEU  39           HN       LEU  39 -16.143  12.312  -3.860
  308    HA   LEU  39           HA       LEU  39 -14.752  14.694  -4.111
  309   1HB   LEU  39          HB2       LEU  39 -14.462  12.018  -5.127
  310   2HB   LEU  39          HB1       LEU  39 -14.222  13.083  -6.487
  311    HG   LEU  39           HG       LEU  39 -12.662  14.283  -4.475
  312   1HD1  LEU  39          HD11      LEU  39 -12.129  11.320  -4.387
  313   2HD1  LEU  39          HD12      LEU  39 -13.076  12.155  -3.154
  314   3HD1  LEU  39          HD13      LEU  39 -11.384  12.589  -3.413
  315   1HD2  LEU  39          HD21      LEU  39 -12.127  13.910  -6.903
  316   2HD2  LEU  39          HD22      LEU  39 -11.714  12.244  -6.504
  317   3HD2  LEU  39          HD23      LEU  39 -10.781  13.574  -5.817
  318    HA   PRO  40           HA       PRO  40 -16.979  17.132  -7.109
  319   1HB   PRO  40          HB2       PRO  40 -14.511  17.849  -8.548
  320   2HB   PRO  40          HB1       PRO  40 -15.583  18.892  -7.602
  321   1HG   PRO  40          HG2       PRO  40 -13.001  17.967  -6.824
  322   2HG   PRO  40          HG1       PRO  40 -14.170  18.812  -5.798
  323   1HD   PRO  40          HD2       PRO  40 -13.383  16.024  -5.675
  324   2HD   PRO  40          HD1       PRO  40 -14.493  16.893  -4.599
  325    H    LYS  41           HN       LYS  41 -17.374  17.082  -9.532
  326    HA   LYS  41           HA       LYS  41 -17.406  14.443 -10.527
  327   1HB   LYS  41          HB2       LYS  41 -18.890  16.249 -11.325
  328   2HB   LYS  41          HB1       LYS  41 -17.509  16.994 -12.130
  329   1HG   LYS  41          HG2       LYS  41 -17.212  15.116 -13.566
  330   2HG   LYS  41          HG1       LYS  41 -18.364  14.146 -12.646
  331   1HD   LYS  41          HD2       LYS  41 -20.216  15.228 -13.539
  332   2HD   LYS  41          HD1       LYS  41 -19.355  16.748 -13.776
  333   1HE   LYS  41          HE2       LYS  41 -18.165  15.839 -15.680
  334   2HE   LYS  41          HE1       LYS  41 -18.871  14.246 -15.411
  335   1HZ   LYS  41          HZ1       LYS  41 -20.574  16.621 -15.835
  336   2HZ   LYS  41          HZ2       LYS  41 -20.970  14.981 -16.035
  337   3HZ   LYS  41          HZ3       LYS  41 -19.946  15.753 -17.150
  338    H    SER  42           HN       SER  42 -15.412  17.129 -11.678
  339    HA   SER  42           HA       SER  42 -13.834  15.856 -13.562
  340   1HB   SER  42          HB2       SER  42 -12.766  17.795 -11.504
  341   2HB   SER  42          HB1       SER  42 -12.141  17.525 -13.130
  342    HG   SER  42           HG       SER  42 -13.471  19.331 -13.153
  343    H    LEU  43           HN       LEU  43 -12.721  16.316 -10.202
  344    HA   LEU  43           HA       LEU  43 -10.630  14.356 -10.547
  345   1HB   LEU  43          HB2       LEU  43 -11.693  15.814  -8.124
  346   2HB   LEU  43          HB1       LEU  43 -10.318  14.710  -8.055
  347    HG   LEU  43           HG       LEU  43 -10.340  16.947 -10.081
  348   1HD1  LEU  43          HD11      LEU  43  -9.108  18.336  -8.382
  349   2HD1  LEU  43          HD12      LEU  43  -9.594  17.170  -7.152
  350   3HD1  LEU  43          HD13      LEU  43 -10.817  18.105  -8.012
  351   1HD2  LEU  43          HD21      LEU  43  -8.548  15.312 -10.284
  352   2HD2  LEU  43          HD22      LEU  43  -8.179  15.440  -8.565
  353   3HD2  LEU  43          HD23      LEU  43  -7.863  16.801  -9.638
  354    H    SER  44           HN       SER  44 -13.891  13.852 -10.217
  355    HA   SER  44           HA       SER  44 -13.655  11.514  -8.411
  356   1HB   SER  44          HB2       SER  44 -15.750  12.561  -8.109
  357   2HB   SER  44          HB1       SER  44 -15.944  12.847  -9.832
  358    HG   SER  44           HG       SER  44 -15.639  10.211  -9.154
  359    H    GLU  45           HN       GLU  45 -13.607  12.437 -11.714
  360    HA   GLU  45           HA       GLU  45 -14.125   9.759 -12.749
  361   1HB   GLU  45          HB2       GLU  45 -13.171  12.321 -14.055
  362   2HB   GLU  45          HB1       GLU  45 -13.429  10.816 -14.939
  363   1HG   GLU  45          HG2       GLU  45 -15.783  10.786 -14.248
  364   2HG   GLU  45          HG1       GLU  45 -15.539  12.256 -13.304
  365    H    GLU  46           HN       GLU  46 -11.394  11.860 -12.041
  366    HA   GLU  46           HA       GLU  46  -9.435   9.996 -13.164
  367   1HB   GLU  46          HB2       GLU  46  -9.034  12.388 -11.339
  368   2HB   GLU  46          HB1       GLU  46  -7.769  11.544 -12.233
  369   1HG   GLU  46          HG2       GLU  46  -8.884  12.133 -14.361
  370   2HG   GLU  46          HG1       GLU  46 -10.129  13.000 -13.461
  371    H    CYS  47           HN       CYS  47 -11.010  10.536 -10.111
  372    HA   CYS  47           HA       CYS  47  -9.045   8.988  -8.567
  373   1HB   CYS  47          HB2       CYS  47 -10.106  10.628  -7.253
  374   2HB   CYS  47          HB1       CYS  47 -11.680  10.327  -7.979
  375    H    GLN  48           HN       GLN  48 -11.975   8.388 -10.367
  376    HA   GLN  48           HA       GLN  48 -12.305   5.698  -9.168
  377   1HB   GLN  48          HB2       GLN  48 -13.882   7.355 -11.147
  378   2HB   GLN  48          HB1       GLN  48 -14.190   5.628 -10.961
  379   1HG   GLN  48          HG2       GLN  48 -14.135   7.498  -8.586
  380   2HG   GLN  48          HG1       GLN  48 -15.608   7.221  -9.517
  381   1HE2  GLN  48          HE21      GLN  48 -13.761   4.412  -9.669
  382   2HE2  GLN  48          HE22      GLN  48 -14.479   3.557  -8.391
  383    H    GLU  49           HN       GLU  49 -11.080   7.377 -11.949
  384    HA   GLU  49           HA       GLU  49 -10.838   5.085 -13.657
  385   1HB   GLU  49          HB2       GLU  49 -10.782   7.361 -14.575
  386   2HB   GLU  49          HB1       GLU  49  -9.321   7.709 -13.652
  387   1HG   GLU  49          HG2       GLU  49  -8.059   6.074 -14.890
  388   2HG   GLU  49          HG1       GLU  49  -9.515   5.479 -15.687
  389    H    VAL  50           HN       VAL  50  -8.571   6.808 -11.497
  390    HA   VAL  50           HA       VAL  50  -6.385   5.023 -11.975
  391    HB   VAL  50           HB       VAL  50  -6.189   7.278 -10.848
  392   1HG1  VAL  50          HG11      VAL  50  -7.019   5.797  -8.350
  393   2HG1  VAL  50          HG12      VAL  50  -8.169   6.749  -9.289
  394   3HG1  VAL  50          HG13      VAL  50  -6.767   7.530  -8.558
  395   1HG2  VAL  50          HG21      VAL  50  -4.317   6.572  -9.528
  396   2HG2  VAL  50          HG22      VAL  50  -4.470   5.347 -10.792
  397   3HG2  VAL  50          HG23      VAL  50  -5.075   5.021  -9.168
  398    H    VAL  51           HN       VAL  51  -8.934   5.092  -9.493
  399    HA   VAL  51           HA       VAL  51  -8.241   3.030  -7.775
  400    HB   VAL  51           HB       VAL  51 -10.844   3.897  -9.030
  401   1HG1  VAL  51          HG11      VAL  51 -11.277   1.547  -8.807
  402   2HG1  VAL  51          HG12      VAL  51 -12.048   2.348  -7.443
  403   3HG1  VAL  51          HG13      VAL  51 -10.519   1.502  -7.216
  404   1HG2  VAL  51          HG21      VAL  51  -9.523   5.015  -7.051
  405   2HG2  VAL  51          HG22      VAL  51 -10.226   3.721  -6.087
  406   3HG2  VAL  51          HG23      VAL  51 -11.274   4.855  -6.940
  407    H    ASP  52           HN       ASP  52 -10.135   2.434 -10.784
  408    HA   ASP  52           HA       ASP  52  -9.906  -0.354 -10.854
  409   1HB   ASP  52          HB2       ASP  52  -9.757   1.593 -13.182
  410   2HB   ASP  52          HB1       ASP  52 -10.029  -0.143 -13.346
  411    H    THR  53           HN       THR  53  -7.534   2.122 -11.716
  412    HA   THR  53           HA       THR  53  -5.570   0.151 -12.579
  413    HB   THR  53           HB       THR  53  -5.255   3.088 -12.167
  414    HG1  THR  53           HG1      THR  53  -5.872   3.275 -14.161
  415   1HG2  THR  53          HG21      THR  53  -3.128   1.747 -12.018
  416   2HG2  THR  53          HG22      THR  53  -3.172   2.865 -13.378
  417   3HG2  THR  53          HG23      THR  53  -3.472   1.148 -13.639
  418    H    TYR  54           HN       TYR  54  -6.464   1.737  -9.672
  419    HA   TYR  54           HA       TYR  54  -4.246   0.316  -8.245
  420   1HB   TYR  54          HB2       TYR  54  -5.258   3.129  -7.788
  421   2HB   TYR  54          HB1       TYR  54  -4.296   2.246  -6.609
  422    HD1  TYR  54           HD1      TYR  54  -4.295   3.136 -10.203
  423    HD2  TYR  54           HD2      TYR  54  -1.957   2.422  -6.712
  424    HE1  TYR  54           HE1      TYR  54  -2.293   3.861 -11.444
  425    HE2  TYR  54           HE2      TYR  54   0.089   3.126  -7.932
  426    HH   TYR  54           HH       TYR  54   0.454   4.780 -10.100
  427    H    GLY  55           HN       GLY  55  -6.263  -1.211  -8.186
  428   1HA   GLY  55          HA2       GLY  55  -7.814  -0.588  -5.702
  429   2HA   GLY  55          HA1       GLY  55  -8.653  -1.165  -7.143
  430    H    SER  56           HN       SER  56  -7.327  -3.235  -8.087
  431    HA   SER  56           HA       SER  56  -7.390  -5.173  -5.840
  432   1HB   SER  56          HB2       SER  56  -8.580  -6.091  -7.612
  433   2HB   SER  56          HB1       SER  56  -7.548  -5.346  -8.829
  434    HG   SER  56           HG       SER  56  -7.172  -7.675  -7.315
  435    H    SER  57           HN       SER  57  -5.078  -3.474  -7.757
  436    HA   SER  57           HA       SER  57  -2.929  -5.446  -7.230
  437   1HB   SER  57          HB2       SER  57  -2.817  -2.710  -8.546
  438   2HB   SER  57          HB1       SER  57  -1.461  -3.832  -8.408
  439    HG   SER  57           HG       SER  57  -3.570  -5.128  -9.406
  440    H    ILE  58           HN       ILE  58  -3.200  -1.925  -6.740
  441    HA   ILE  58           HA       ILE  58  -1.338  -1.315  -4.885
  442    HB   ILE  58           HB       ILE  58  -3.158   0.171  -5.634
  443   1HG1  ILE  58          HG12      ILE  58  -2.716  -0.030  -2.644
  444   2HG1  ILE  58          HG11      ILE  58  -1.850   1.006  -3.788
  445   1HG2  ILE  58          HG21      ILE  58  -4.898  -0.876  -3.456
  446   2HG2  ILE  58          HG22      ILE  58  -4.931  -1.656  -5.046
  447   3HG2  ILE  58          HG23      ILE  58  -5.346   0.046  -4.877
  448   1HD1  ILE  58          HD11      ILE  58  -4.173   2.045  -4.310
  449   2HD1  ILE  58          HD12      ILE  58  -3.427   2.466  -2.766
  450   3HD1  ILE  58          HD13      ILE  58  -4.708   1.251  -2.829
  451    H    LEU  59           HN       LEU  59  -4.349  -3.002  -4.054
  452    HA   LEU  59           HA       LEU  59  -3.488  -3.374  -1.283
  453   1HB   LEU  59          HB2       LEU  59  -5.708  -5.021  -2.496
  454   2HB   LEU  59          HB1       LEU  59  -5.550  -4.408  -0.850
  455    HG   LEU  59           HG       LEU  59  -5.968  -2.658  -3.248
  456   1HD1  LEU  59          HD11      LEU  59  -8.001  -3.670  -1.277
  457   2HD1  LEU  59          HD12      LEU  59  -7.863  -4.179  -2.962
  458   3HD1  LEU  59          HD13      LEU  59  -8.310  -2.518  -2.575
  459   1HD2  LEU  59          HD21      LEU  59  -6.481  -0.927  -1.643
  460   2HD2  LEU  59          HD22      LEU  59  -4.948  -1.638  -1.168
  461   3HD2  LEU  59          HD23      LEU  59  -6.424  -2.083  -0.315
  462    H    SER  60           HN       SER  60  -3.575  -5.360  -4.221
  463    HA   SER  60           HA       SER  60  -2.546  -7.714  -2.734
  464   1HB   SER  60          HB2       SER  60  -3.083  -7.469  -5.696
  465   2HB   SER  60          HB1       SER  60  -2.931  -8.948  -4.753
  466    HG   SER  60           HG       SER  60  -4.806  -8.283  -3.602
  467    H    ILE  61           HN       ILE  61  -1.134  -5.027  -4.008
  468    HA   ILE  61           HA       ILE  61   1.069  -6.325  -5.404
  469    HB   ILE  61           HB       ILE  61  -0.033  -3.895  -5.637
  470   1HG1  ILE  61          HG12      ILE  61   1.647  -4.936  -7.131
  471   2HG1  ILE  61          HG11      ILE  61   1.852  -3.203  -6.961
  472   1HG2  ILE  61          HG21      ILE  61   0.658  -3.071  -3.451
  473   2HG2  ILE  61          HG22      ILE  61   1.389  -2.139  -4.748
  474   3HG2  ILE  61          HG23      ILE  61   2.353  -3.323  -3.879
  475   1HD1  ILE  61          HD11      ILE  61   3.665  -3.539  -5.374
  476   2HD1  ILE  61          HD12      ILE  61   3.996  -4.460  -6.841
  477   3HD1  ILE  61          HD13      ILE  61   3.401  -5.282  -5.404
  478    H    LEU  62           HN       LEU  62   1.093  -4.303  -2.424
  479    HA   LEU  62           HA       LEU  62   3.676  -5.175  -1.595
  480   1HB   LEU  62          HB2       LEU  62   1.378  -4.229   0.119
  481   2HB   LEU  62          HB1       LEU  62   3.065  -4.332   0.629
  482    HG   LEU  62           HG       LEU  62   2.084  -2.688  -1.704
  483   1HD1  LEU  62          HD11      LEU  62   2.504  -0.733  -0.245
  484   2HD1  LEU  62          HD12      LEU  62   2.858  -1.830   1.090
  485   3HD1  LEU  62          HD13      LEU  62   1.236  -1.774   0.401
  486   1HD2  LEU  62          HD21      LEU  62   4.454  -1.616  -1.168
  487   2HD2  LEU  62          HD22      LEU  62   4.282  -3.010  -2.227
  488   3HD2  LEU  62          HD23      LEU  62   4.771  -3.236  -0.547
  489    H    LEU  63           HN       LEU  63   0.878  -6.948  -1.892
  490    HA   LEU  63           HA       LEU  63   1.338  -8.720   0.392
  491   1HB   LEU  63          HB2       LEU  63  -0.560  -8.722  -1.957
  492   2HB   LEU  63          HB1       LEU  63  -0.549  -9.987  -0.735
  493    HG   LEU  63           HG       LEU  63  -2.200  -7.967  -0.503
  494   1HD1  LEU  63          HD11      LEU  63  -0.516  -9.038   1.753
  495   2HD1  LEU  63          HD12      LEU  63  -2.075  -9.639   1.188
  496   3HD1  LEU  63          HD13      LEU  63  -1.975  -8.078   2.002
  497   1HD2  LEU  63          HD21      LEU  63  -0.494  -6.179  -0.722
  498   2HD2  LEU  63          HD22      LEU  63   0.241  -6.729   0.787
  499   3HD2  LEU  63          HD23      LEU  63  -1.393  -6.083   0.787
  500    H    GLU  64           HN       GLU  64   1.493  -9.043  -3.205
  501    HA   GLU  64           HA       GLU  64   3.386 -11.334  -2.779
  502   1HB   GLU  64          HB2       GLU  64   1.078 -11.147  -4.718
  503   2HB   GLU  64          HB1       GLU  64   2.301 -12.418  -4.758
  504   1HG   GLU  64          HG2       GLU  64   1.695 -13.096  -2.471
  505   2HG   GLU  64          HG1       GLU  64   0.493 -11.808  -2.399
  506    H    GLU  65           HN       GLU  65   2.151  -9.277  -5.469
  507    HA   GLU  65           HA       GLU  65   4.314  -9.685  -7.190
  508   1HB   GLU  65          HB2       GLU  65   2.921  -7.029  -6.781
  509   2HB   GLU  65          HB1       GLU  65   3.745  -7.569  -8.243
  510   1HG   GLU  65          HG2       GLU  65   2.121  -9.419  -8.462
  511   2HG   GLU  65          HG1       GLU  65   1.292  -8.854  -7.011
  512    H    VAL  66           HN       VAL  66   4.303  -8.326  -4.183
  513    HA   VAL  66           HA       VAL  66   7.122  -7.455  -4.413
  514    HB   VAL  66           HB       VAL  66   4.708  -5.892  -3.613
  515   1HG1  VAL  66          HG11      VAL  66   7.441  -5.506  -2.421
  516   2HG1  VAL  66          HG12      VAL  66   5.914  -5.747  -1.570
  517   3HG1  VAL  66          HG13      VAL  66   6.204  -4.247  -2.446
  518   1HG2  VAL  66          HG21      VAL  66   7.254  -5.157  -5.027
  519   2HG2  VAL  66          HG22      VAL  66   5.836  -4.124  -4.835
  520   3HG2  VAL  66          HG23      VAL  66   5.731  -5.605  -5.794
  521    H    SER  67           HN       SER  67   8.280  -8.291  -2.703
  522    HA   SER  67           HA       SER  67   6.833  -9.793  -0.632
  523   1HB   SER  67          HB2       SER  67   9.423  -9.942  -1.808
  524   2HB   SER  67          HB1       SER  67   9.677  -9.612  -0.099
  525    HG   SER  67           HG       SER  67   7.808 -11.543  -0.952
  526    HA   PRO  68           HA       PRO  68   6.836  -6.725   2.498
  527   1HB   PRO  68          HB2       PRO  68   8.075  -8.122   4.655
  528   2HB   PRO  68          HB1       PRO  68   6.345  -8.038   4.292
  529   1HG   PRO  68          HG2       PRO  68   8.200 -10.290   3.876
  530   2HG   PRO  68          HG1       PRO  68   6.430 -10.292   3.850
  531   1HD   PRO  68          HD2       PRO  68   8.134 -10.482   1.586
  532   2HD   PRO  68          HD1       PRO  68   6.384 -10.183   1.565
  533    H    GLU  69           HN       GLU  69   9.942  -8.533   2.682
  534    HA   GLU  69           HA       GLU  69  11.461  -6.368   3.730
  535   1HB   GLU  69          HB2       GLU  69  13.438  -7.614   3.013
  536   2HB   GLU  69          HB1       GLU  69  12.250  -8.724   3.693
  537   1HG   GLU  69          HG2       GLU  69  11.448  -9.193   1.359
  538   2HG   GLU  69          HG1       GLU  69  12.789  -8.219   0.754
  539    H    LEU  70           HN       LEU  70  10.468  -7.084   0.430
  540    HA   LEU  70           HA       LEU  70  12.346  -5.376  -0.893
  541   1HB   LEU  70          HB2       LEU  70  11.061  -6.910  -2.229
  542   2HB   LEU  70          HB1       LEU  70   9.541  -6.268  -1.614
  543    HG   LEU  70           HG       LEU  70   9.901  -4.157  -2.753
  544   1HD1  LEU  70          HD11      LEU  70  11.958  -4.045  -4.323
  545   2HD1  LEU  70          HD12      LEU  70  12.619  -5.347  -3.335
  546   3HD1  LEU  70          HD13      LEU  70  12.238  -3.790  -2.603
  547   1HD2  LEU  70          HD21      LEU  70   9.062  -6.241  -4.012
  548   2HD2  LEU  70          HD22      LEU  70  10.664  -6.301  -4.744
  549   3HD2  LEU  70          HD23      LEU  70   9.630  -4.894  -4.994
  550    H    VAL  71           HN       VAL  71   9.021  -4.779   0.277
  551    HA   VAL  71           HA       VAL  71   8.700  -2.108  -0.431
  552    HB   VAL  71           HB       VAL  71   7.992  -2.976   2.373
  553   1HG1  VAL  71          HG11      VAL  71   6.059  -1.639   2.019
  554   2HG1  VAL  71          HG12      VAL  71   6.297  -1.620   0.271
  555   3HG1  VAL  71          HG13      VAL  71   7.390  -0.716   1.319
  556   1HG2  VAL  71          HG21      VAL  71   5.965  -4.088   1.260
  557   2HG2  VAL  71          HG22      VAL  71   7.493  -4.957   1.178
  558   3HG2  VAL  71          HG23      VAL  71   6.915  -4.070  -0.225
  559    H    CYS  72           HN       CYS  72  10.314  -3.347   2.488
  560    HA   CYS  72           HA       CYS  72  11.120  -0.858   3.567
  561   1HB   CYS  72          HB2       CYS  72  11.479  -3.150   4.643
  562   2HB   CYS  72          HB1       CYS  72  12.896  -3.315   3.599
  563    H    SER  73           HN       SER  73  12.333  -2.674   0.838
  564    HA   SER  73           HA       SER  73  14.715  -1.016   0.510
  565   1HB   SER  73          HB2       SER  73  13.734  -3.443  -0.615
  566   2HB   SER  73          HB1       SER  73  13.932  -2.320  -1.956
  567    HG   SER  73           HG       SER  73  15.805  -3.456  -0.261
  568    H    MET  74           HN       MET  74  11.621  -1.340  -1.322
  569    HA   MET  74           HA       MET  74  11.938   0.879  -3.025
  570   1HB   MET  74          HB2       MET  74   9.416  -0.045  -1.607
  571   2HB   MET  74          HB1       MET  74   9.446   1.083  -2.959
  572   1HG   MET  74          HG2       MET  74  10.769  -0.791  -4.195
  573   2HG   MET  74          HG1       MET  74  10.128  -1.847  -2.940
  574   1HE   MET  74          HE1       MET  74   7.962  -2.724  -2.738
  575   2HE   MET  74          HE2       MET  74   6.466  -2.157  -3.482
  576   3HE   MET  74          HE3       MET  74   7.261  -1.173  -2.245
  577    H    LEU  75           HN       LEU  75  10.631   0.795   0.280
  578    HA   LEU  75           HA       LEU  75  10.171   3.605   0.523
  579   1HB   LEU  75          HB2       LEU  75  10.881   1.608   2.698
  580   2HB   LEU  75          HB1       LEU  75  10.128   3.181   2.952
  581    HG   LEU  75           HG       LEU  75   8.830   1.164   1.112
  582   1HD1  LEU  75          HD11      LEU  75   7.417   0.609   3.241
  583   2HD1  LEU  75          HD12      LEU  75   8.839   1.165   4.124
  584   3HD1  LEU  75          HD13      LEU  75   8.967  -0.198   3.014
  585   1HD2  LEU  75          HD21      LEU  75   7.923   3.422   1.086
  586   2HD2  LEU  75          HD22      LEU  75   7.813   3.437   2.846
  587   3HD2  LEU  75          HD23      LEU  75   6.780   2.361   1.905
  588    H    HIS  76           HN       HIS  76  13.057   1.649   0.788
  589    HA   HIS  76           HA       HIS  76  15.275   2.212   1.351
  590   1HB   HIS  76          HB2       HIS  76  14.224   4.403  -0.435
  591   2HB   HIS  76          HB1       HIS  76  15.893   4.443   0.133
  592    HD1  HIS  76           HD1      HIS  76  17.011   1.791  -0.172
  593    HD2  HIS  76           HD2      HIS  76  14.133   3.139  -2.869
  594    HE1  HIS  76           HE1      HIS  76  17.256   0.368  -2.253
  595    H    LEU  77           HN       LEU  77  14.150   2.613   3.698
  596    HA   LEU  77           HA       LEU  77  14.407   5.461   4.483
  597   1HB   LEU  77          HB2       LEU  77  13.419   4.881   6.548
  598   2HB   LEU  77          HB1       LEU  77  12.579   3.875   5.379
  599    HG   LEU  77           HG       LEU  77  14.893   2.953   7.128
  600   1HD1  LEU  77          HD11      LEU  77  12.853   3.360   8.423
  601   2HD1  LEU  77          HD12      LEU  77  13.148   1.627   8.268
  602   3HD1  LEU  77          HD13      LEU  77  11.918   2.405   7.271
  603   1HD2  LEU  77          HD21      LEU  77  13.118   1.556   5.105
  604   2HD2  LEU  77          HD22      LEU  77  14.091   0.692   6.294
  605   3HD2  LEU  77          HD23      LEU  77  14.874   1.688   5.072
  606    H    CYS  78           HN       CYS  78  16.272   2.590   4.379
  607    HA   CYS  78           HA       CYS  78  18.109   3.153   6.536
  608   1HB   CYS  78          HB2       CYS  78  18.428   1.519   3.998
  609   2HB   CYS  78          HB1       CYS  78  19.654   1.616   5.259
  610    H    SER  79           HN       SER  79  19.309   2.956   3.252
  611    HA   SER  79           HA       SER  79  21.070   5.237   3.698
  612   1HB   SER  79          HB2       SER  79  20.566   3.704   1.135
  613   2HB   SER  79          HB1       SER  79  21.965   4.704   1.515
  614    HG   SER  79           HG       SER  79  22.749   3.152   2.732
  615    H    GLY  80           HN       GLY  80  20.948   7.251   2.654
  616   1HA   GLY  80          HA2       GLY  80  18.250   8.045   1.766
  617   2HA   GLY  80          HA1       GLY  80  19.620   9.125   2.029
  618    H    LEU  81           HN       LEU  81  21.323   7.248   0.436
  619    HA   LEU  81           HA       LEU  81  20.366   7.911  -2.311
  620   1HB   LEU  81          HB2       LEU  81  22.935   8.066  -2.770
  621   2HB   LEU  81          HB1       LEU  81  22.134   9.432  -2.004
  622    HG   LEU  81           HG       LEU  81  22.854   8.700   0.188
  623   1HD1  LEU  81          HD11      LEU  81  24.575   6.752   0.229
  624   2HD1  LEU  81          HD12      LEU  81  23.885   6.292  -1.323
  625   3HD1  LEU  81          HD13      LEU  81  22.870   6.330   0.116
  626   1HD2  LEU  81          HD21      LEU  81  25.289   8.991  -0.098
  627   2HD2  LEU  81          HD22      LEU  81  24.393  10.093  -1.142
  628   3HD2  LEU  81          HD23      LEU  81  25.126   8.638  -1.817
  629    H    VAL  82           HN       VAL  82  22.123   6.578  -3.805
  630    HA   VAL  82           HA       VAL  82  21.546   3.812  -3.096
  631    HB   VAL  82           HB       VAL  82  22.976   3.387  -5.248
  632   1HG1  VAL  82          HG11      VAL  82  20.513   3.191  -5.105
  633   2HG1  VAL  82          HG12      VAL  82  21.024   3.872  -6.652
  634   3HG1  VAL  82          HG13      VAL  82  20.365   4.925  -5.399
  635   1HG2  VAL  82          HG21      VAL  82  23.210   5.298  -6.707
  636   2HG2  VAL  82          HG22      VAL  82  23.918   5.743  -5.155
  637   3HG2  VAL  82          HG23      VAL  82  22.312   6.328  -5.593
  638    HA   PRO  83           HA       PRO  83  25.182   3.336  -0.615
  639   1HB   PRO  83          HB2       PRO  83  25.511   0.632  -1.795
  640   2HB   PRO  83          HB1       PRO  83  25.328   1.108  -0.098
  641   1HG   PRO  83          HG2       PRO  83  23.302  -0.036  -1.660
  642   2HG   PRO  83          HG1       PRO  83  23.051   0.872  -0.162
  643   1HD   PRO  83          HD2       PRO  83  22.384   1.681  -2.904
  644   2HD   PRO  83          HD1       PRO  83  21.947   2.464  -1.362
  645    H    ARG  84           HN       ARG  84  27.109   4.256  -1.202
  646    HA   ARG  84           HA       ARG  84  28.021   4.213  -3.967
  647   1HB   ARG  84          HB2       ARG  84  29.434   5.205  -1.470
  648   2HB   ARG  84          HB1       ARG  84  29.894   5.573  -3.130
  649   1HG   ARG  84          HG2       ARG  84  27.101   6.208  -2.176
  650   2HG   ARG  84          HG1       ARG  84  28.429   7.297  -1.785
  651   1HD   ARG  84          HD2       ARG  84  27.621   6.422  -4.577
  652   2HD   ARG  84          HD1       ARG  84  27.334   8.008  -3.864
  653    HE   ARG  84           HE       ARG  84  30.074   7.686  -3.653
  654   1HH1  ARG  84          HH21      ARG  84  27.719   7.457  -6.159
  655   2HH1  ARG  84          HH22      ARG  84  28.807   7.963  -7.409
  656   1HH2  ARG  84          HH11      ARG  84  31.508   8.348  -5.270
  657   2HH2  ARG  84          HH12      ARG  84  30.952   8.467  -6.905
  Start of MODEL   20
    1   1H    SER   1           HT1      SER   1  21.658   4.066  11.984
    2   2H    SER   1           HT2      SER   1  20.698   5.410  11.589
    3   3H    SER   1           HT3      SER   1  22.386   5.570  11.691
    4    HA   SER   1           HA       SER   1  21.475   5.464   9.377
    5   1HB   SER   1          HB2       SER   1  23.821   5.015   9.758
    6   2HB   SER   1          HB1       SER   1  23.464   3.401  10.364
    7    HG   SER   1           HG       SER   1  23.894   2.978   8.311
    8    H    ASP   2           HN       ASP   2  22.114   2.081  10.135
    9    HA   ASP   2           HA       ASP   2  19.823   1.247   8.553
   10   1HB   ASP   2          HB2       ASP   2  21.981  -0.045   8.741
   11   2HB   ASP   2          HB1       ASP   2  21.529  -0.446  10.399
   12    H    VAL   3           HN       VAL   3  18.885   2.884  10.592
   13    HA   VAL   3           HA       VAL   3  17.867   1.180  12.764
   14    HB   VAL   3           HB       VAL   3  17.324   4.066  12.130
   15   1HG1  VAL   3          HG11      VAL   3  15.565   3.136  13.522
   16   2HG1  VAL   3          HG12      VAL   3  16.608   4.131  14.534
   17   3HG1  VAL   3          HG13      VAL   3  16.758   2.373  14.574
   18   1HG2  VAL   3          HG21      VAL   3  19.253   2.782  14.080
   19   2HG2  VAL   3          HG22      VAL   3  18.939   4.513  13.958
   20   3HG2  VAL   3          HG23      VAL   3  19.697   3.658  12.615
   21    H    TYR   4           HN       TYR   4  16.374   3.321  10.320
   22    HA   TYR   4           HA       TYR   4  13.745   2.231  10.719
   23   1HB   TYR   4          HB2       TYR   4  15.041   4.033   8.699
   24   2HB   TYR   4          HB1       TYR   4  13.477   3.331   8.290
   25    HD1  TYR   4           HD1      TYR   4  14.663   4.274  11.702
   26    HD2  TYR   4           HD2      TYR   4  12.068   5.248   8.422
   27    HE1  TYR   4           HE1      TYR   4  13.531   5.957  13.108
   28    HE2  TYR   4           HE2      TYR   4  10.929   6.940   9.831
   29    HH   TYR   4           HH       TYR   4  12.165   7.852  12.967
   30    H    CYS   5           HN       CYS   5  16.486   1.077   8.996
   31    HA   CYS   5           HA       CYS   5  15.107  -0.438   6.971
   32   1HB   CYS   5          HB2       CYS   5  17.751  -1.164   8.250
   33   2HB   CYS   5          HB1       CYS   5  17.190  -1.571   6.629
   34    H    GLU   6           HN       GLU   6  16.219  -1.220  10.262
   35    HA   GLU   6           HA       GLU   6  15.208  -3.952  10.113
   36   1HB   GLU   6          HB2       GLU   6  16.140  -2.259  12.449
   37   2HB   GLU   6          HB1       GLU   6  15.709  -3.965  12.571
   38   1HG   GLU   6          HG2       GLU   6  17.454  -4.548  10.949
   39   2HG   GLU   6          HG1       GLU   6  17.866  -2.843  10.757
   40    H    VAL   7           HN       VAL   7  13.928  -0.842  11.050
   41    HA   VAL   7           HA       VAL   7  11.642  -2.010  12.492
   42    HB   VAL   7           HB       VAL   7  12.075   0.849  11.578
   43   1HG1  VAL   7          HG11      VAL   7   9.764   0.406  12.138
   44   2HG1  VAL   7          HG12      VAL   7  10.486   1.304  13.473
   45   3HG1  VAL   7          HG13      VAL   7  10.237  -0.437  13.613
   46   1HG2  VAL   7          HG21      VAL   7  12.595  -0.280  14.337
   47   2HG2  VAL   7          HG22      VAL   7  13.065   1.297  13.703
   48   3HG2  VAL   7          HG23      VAL   7  13.868  -0.160  13.124
   49    H    CYS   8           HN       CYS   8  12.320  -0.594   9.319
   50    HA   CYS   8           HA       CYS   8   9.552  -0.561   8.465
   51   1HB   CYS   8          HB2       CYS   8  10.408   0.027   6.310
   52   2HB   CYS   8          HB1       CYS   8  11.468   0.807   7.481
   53    H    GLU   9           HN       GLU   9  12.022  -2.999   8.604
   54    HA   GLU   9           HA       GLU   9  10.603  -4.752   6.669
   55   1HB   GLU   9          HB2       GLU   9  13.060  -5.354   8.367
   56   2HB   GLU   9          HB1       GLU   9  12.352  -6.433   7.173
   57   1HG   GLU   9          HG2       GLU   9  12.871  -4.985   5.369
   58   2HG   GLU   9          HG1       GLU   9  13.219  -3.634   6.441
   59    H    PHE  10           HN       PHE  10  10.998  -4.408  10.147
   60    HA   PHE  10           HA       PHE  10   9.716  -6.951  10.755
   61   1HB   PHE  10          HB2       PHE  10  11.274  -5.973  12.354
   62   2HB   PHE  10          HB1       PHE  10  10.283  -4.519  12.475
   63    HD1  PHE  10           HD1      PHE  10  10.538  -8.091  13.347
   64    HD2  PHE  10           HD2      PHE  10   8.160  -4.528  13.676
   65    HE1  PHE  10           HE1      PHE  10   9.176  -9.163  15.121
   66    HE2  PHE  10           HE2      PHE  10   6.799  -5.601  15.449
   67    HZ   PHE  10           HZ       PHE  10   7.306  -7.918  16.172
   68    H    LEU  11           HN       LEU  11   8.629  -3.677  10.167
   69    HA   LEU  11           HA       LEU  11   5.969  -4.169  11.322
   70   1HB   LEU  11          HB2       LEU  11   7.140  -1.863   9.749
   71   2HB   LEU  11          HB1       LEU  11   5.473  -1.896  10.321
   72    HG   LEU  11           HG       LEU  11   7.900  -2.199  12.117
   73   1HD1  LEU  11          HD11      LEU  11   7.525   0.116  12.769
   74   2HD1  LEU  11          HD12      LEU  11   6.120   0.222  11.709
   75   3HD1  LEU  11          HD13      LEU  11   7.733   0.044  11.020
   76   1HD2  LEU  11          HD21      LEU  11   4.920  -2.170  12.558
   77   2HD2  LEU  11          HD22      LEU  11   5.949  -1.430  13.785
   78   3HD2  LEU  11          HD23      LEU  11   6.165  -3.124  13.365
   79    H    VAL  12           HN       VAL  12   7.177  -3.449   8.015
   80    HA   VAL  12           HA       VAL  12   4.684  -3.946   6.749
   81    HB   VAL  12           HB       VAL  12   5.915  -4.057   4.682
   82   1HG1  VAL  12          HG11      VAL  12   7.120  -2.124   6.679
   83   2HG1  VAL  12          HG12      VAL  12   5.709  -1.848   5.659
   84   3HG1  VAL  12          HG13      VAL  12   7.309  -1.986   4.931
   85   1HG2  VAL  12          HG21      VAL  12   7.751  -5.450   4.904
   86   2HG2  VAL  12          HG22      VAL  12   8.177  -4.823   6.495
   87   3HG2  VAL  12          HG23      VAL  12   8.567  -3.898   5.045
   88    H    LYS  13           HN       LYS  13   7.128  -6.152   7.901
   89    HA   LYS  13           HA       LYS  13   6.155  -8.468   6.385
   90   1HB   LYS  13          HB2       LYS  13   8.489  -8.272   7.104
   91   2HB   LYS  13          HB1       LYS  13   7.974  -8.281   8.786
   92   1HG   LYS  13          HG2       LYS  13   6.774 -10.592   7.595
   93   2HG   LYS  13          HG1       LYS  13   8.426 -10.549   6.996
   94   1HD   LYS  13          HD2       LYS  13   8.578 -11.783   9.000
   95   2HD   LYS  13          HD1       LYS  13   9.115 -10.169   9.463
   96   1HE   LYS  13          HE2       LYS  13   6.898  -9.648  10.352
   97   2HE   LYS  13          HE1       LYS  13   6.284 -11.207   9.803
   98   1HZ   LYS  13          HZ1       LYS  13   7.299 -12.300  11.471
   99   2HZ   LYS  13          HZ2       LYS  13   7.216 -10.791  12.247
  100   3HZ   LYS  13          HZ3       LYS  13   8.653 -11.279  11.484
  101    H    GLU  14           HN       GLU  14   5.707  -7.199   9.691
  102    HA   GLU  14           HA       GLU  14   4.188  -9.500  10.586
  103   1HB   GLU  14          HB2       GLU  14   5.345  -7.647  12.008
  104   2HB   GLU  14          HB1       GLU  14   3.882  -6.711  11.714
  105   1HG   GLU  14          HG2       GLU  14   3.920  -9.499  12.909
  106   2HG   GLU  14          HG1       GLU  14   3.791  -8.012  13.847
  107    H    VAL  15           HN       VAL  15   3.139  -6.180   9.815
  108    HA   VAL  15           HA       VAL  15   0.388  -6.524   9.773
  109    HB   VAL  15           HB       VAL  15   1.663  -4.384   9.301
  110   1HG1  VAL  15          HG11      VAL  15   1.648  -5.394   6.447
  111   2HG1  VAL  15          HG12      VAL  15   3.069  -5.467   7.485
  112   3HG1  VAL  15          HG13      VAL  15   2.367  -3.906   7.059
  113   1HG2  VAL  15          HG21      VAL  15  -0.628  -5.222   7.503
  114   2HG2  VAL  15          HG22      VAL  15  -0.086  -3.553   7.684
  115   3HG2  VAL  15          HG23      VAL  15  -0.742  -4.424   9.071
  116    H    THR  16           HN       THR  16   2.724  -7.455   7.269
  117    HA   THR  16           HA       THR  16   0.902  -8.277   5.281
  118    HB   THR  16           HB       THR  16   3.021 -10.208   5.347
  119    HG1  THR  16           HG1      THR  16   3.719  -7.631   6.227
  120   1HG2  THR  16          HG21      THR  16   3.934  -8.742   3.515
  121   2HG2  THR  16          HG22      THR  16   2.657  -7.582   3.893
  122   3HG2  THR  16          HG23      THR  16   2.235  -9.196   3.305
  123    H    LYS  17           HN       LYS  17   2.166 -10.069   8.111
  124    HA   LYS  17           HA       LYS  17   0.978 -12.556   7.723
  125   1HB   LYS  17          HB2       LYS  17   1.251 -10.959  10.289
  126   2HB   LYS  17          HB1       LYS  17   0.691 -12.627  10.258
  127   1HG   LYS  17          HG2       LYS  17   3.262 -11.935   8.847
  128   2HG   LYS  17          HG1       LYS  17   3.267 -12.092  10.602
  129   1HD   LYS  17          HD2       LYS  17   2.315 -14.359  10.414
  130   2HD   LYS  17          HD1       LYS  17   2.297 -14.213   8.658
  131   1HE   LYS  17          HE2       LYS  17   4.833 -13.863  10.262
  132   2HE   LYS  17          HE1       LYS  17   4.303 -15.442   9.681
  133   1HZ   LYS  17          HZ1       LYS  17   5.318 -13.158   8.190
  134   2HZ   LYS  17          HZ2       LYS  17   4.055 -14.029   7.462
  135   3HZ   LYS  17          HZ3       LYS  17   5.498 -14.818   7.889
  136    H    LEU  18           HN       LEU  18  -0.556  -9.541   8.721
  137    HA   LEU  18           HA       LEU  18  -3.197 -10.926   8.885
  138   1HB   LEU  18          HB2       LEU  18  -3.309  -7.988   9.156
  139   2HB   LEU  18          HB1       LEU  18  -3.874  -9.235  10.259
  140    HG   LEU  18           HG       LEU  18  -0.969  -8.419   9.991
  141   1HD1  LEU  18          HD11      LEU  18  -1.349  -7.223  12.117
  142   2HD1  LEU  18          HD12      LEU  18  -3.068  -7.608  12.016
  143   3HD1  LEU  18          HD13      LEU  18  -2.326  -6.558  10.807
  144   1HD2  LEU  18          HD21      LEU  18  -0.602  -9.827  11.863
  145   2HD2  LEU  18          HD22      LEU  18  -1.731 -10.769  10.886
  146   3HD2  LEU  18          HD23      LEU  18  -2.312  -9.866  12.284
  147    H    ILE  19           HN       ILE  19  -1.779  -8.121   7.185
  148    HA   ILE  19           HA       ILE  19  -3.836  -7.677   5.346
  149    HB   ILE  19           HB       ILE  19  -0.969  -7.125   5.617
  150   1HG1  ILE  19          HG12      ILE  19  -3.066  -5.444   4.254
  151   2HG1  ILE  19          HG11      ILE  19  -2.907  -5.539   6.008
  152   1HG2  ILE  19          HG21      ILE  19  -2.115  -7.331   2.835
  153   2HG2  ILE  19          HG22      ILE  19  -0.671  -8.121   3.471
  154   3HG2  ILE  19          HG23      ILE  19  -0.684  -6.377   3.226
  155   1HD1  ILE  19          HD11      ILE  19  -0.284  -5.058   5.196
  156   2HD1  ILE  19          HD12      ILE  19  -1.420  -3.843   5.789
  157   3HD1  ILE  19          HD13      ILE  19  -1.243  -4.105   4.058
  158    H    ASP  20           HN       ASP  20  -1.648 -10.325   5.659
  159    HA   ASP  20           HA       ASP  20  -1.359 -11.353   3.097
  160   1HB   ASP  20          HB2       ASP  20  -0.410 -12.525   4.997
  161   2HB   ASP  20          HB1       ASP  20  -2.013 -12.845   5.662
  162    H    ASN  21           HN       ASN  21  -4.097 -12.190   5.293
  163    HA   ASN  21           HA       ASN  21  -5.977 -11.937   3.078
  164   1HB   ASN  21          HB2       ASN  21  -5.604 -14.642   4.372
  165   2HB   ASN  21          HB1       ASN  21  -6.781 -14.228   3.121
  166   1HD2  ASN  21          HD21      ASN  21  -5.829 -13.506   0.969
  167   2HD2  ASN  21          HD22      ASN  21  -4.328 -14.140   0.495
  168    H    ASN  22           HN       ASN  22  -5.835 -10.560   5.506
  169    HA   ASN  22           HA       ASN  22  -7.987 -11.737   7.198
  170   1HB   ASN  22          HB2       ASN  22  -6.292  -9.245   7.543
  171   2HB   ASN  22          HB1       ASN  22  -7.501  -9.813   8.697
  172   1HD2  ASN  22          HD21      ASN  22  -5.266 -11.908   6.826
  173   2HD2  ASN  22          HD22      ASN  22  -4.415 -12.471   8.195
  174    H    LYS  23           HN       LYS  23  -7.236  -8.535   5.828
  175    HA   LYS  23           HA       LYS  23 -10.147  -8.006   5.519
  176   1HB   LYS  23          HB2       LYS  23  -9.509  -5.702   5.136
  177   2HB   LYS  23          HB1       LYS  23  -8.653  -6.285   6.559
  178   1HG   LYS  23          HG2       LYS  23  -6.822  -5.383   5.493
  179   2HG   LYS  23          HG1       LYS  23  -6.817  -6.931   4.652
  180   1HD   LYS  23          HD2       LYS  23  -8.513  -5.657   3.020
  181   2HD   LYS  23          HD1       LYS  23  -7.718  -4.233   3.680
  182   1HE   LYS  23          HE2       LYS  23  -5.500  -5.421   3.117
  183   2HE   LYS  23          HE1       LYS  23  -6.477  -6.508   2.131
  184   1HZ   LYS  23          HZ1       LYS  23  -7.067  -3.722   1.727
  185   2HZ   LYS  23          HZ2       LYS  23  -6.784  -4.949   0.588
  186   3HZ   LYS  23          HZ3       LYS  23  -5.477  -4.139   1.311
  187    H    THR  24           HN       THR  24 -11.067  -8.489   3.583
  188    HA   THR  24           HA       THR  24  -9.361  -9.174   1.306
  189    HB   THR  24           HB       THR  24 -11.618  -9.536   0.171
  190    HG1  THR  24           HG1      THR  24 -12.943  -9.650   2.510
  191   1HG2  THR  24          HG21      THR  24 -10.288 -11.322   1.328
  192   2HG2  THR  24          HG22      THR  24 -12.028 -11.598   1.394
  193   3HG2  THR  24          HG23      THR  24 -11.182 -10.969   2.806
  194    H    GLU  25           HN       GLU  25 -10.669  -8.244  -0.902
  195    HA   GLU  25           HA       GLU  25  -9.991  -5.365  -0.805
  196   1HB   GLU  25          HB2       GLU  25 -10.863  -6.938  -3.234
  197   2HB   GLU  25          HB1       GLU  25  -9.909  -5.456  -3.179
  198   1HG   GLU  25          HG2       GLU  25  -8.122  -6.746  -1.950
  199   2HG   GLU  25          HG1       GLU  25  -9.051  -8.213  -2.258
  200    H    LYS  26           HN       LYS  26 -12.671  -6.814   0.104
  201    HA   LYS  26           HA       LYS  26 -14.617  -5.375  -1.577
  202   1HB   LYS  26          HB2       LYS  26 -15.305  -6.735   1.027
  203   2HB   LYS  26          HB1       LYS  26 -16.264  -6.603  -0.448
  204   1HG   LYS  26          HG2       LYS  26 -13.789  -8.301  -0.064
  205   2HG   LYS  26          HG1       LYS  26 -15.447  -8.877  -0.226
  206   1HD   LYS  26          HD2       LYS  26 -15.520  -7.728  -2.486
  207   2HD   LYS  26          HD1       LYS  26 -13.782  -7.470  -2.327
  208   1HE   LYS  26          HE2       LYS  26 -13.388  -9.850  -2.152
  209   2HE   LYS  26          HE1       LYS  26 -15.123 -10.171  -2.139
  210   1HZ   LYS  26          HZ1       LYS  26 -14.316  -8.585  -4.378
  211   2HZ   LYS  26          HZ2       LYS  26 -15.224 -10.020  -4.341
  212   3HZ   LYS  26          HZ3       LYS  26 -13.526 -10.086  -4.346
  213    H    GLU  27           HN       GLU  27 -13.364  -5.301   1.740
  214    HA   GLU  27           HA       GLU  27 -14.883  -2.967   2.492
  215   1HB   GLU  27          HB2       GLU  27 -12.340  -4.120   3.678
  216   2HB   GLU  27          HB1       GLU  27 -13.338  -2.879   4.435
  217   1HG   GLU  27          HG2       GLU  27 -14.360  -5.626   3.665
  218   2HG   GLU  27          HG1       GLU  27 -13.797  -5.202   5.281
  219    H    ILE  28           HN       ILE  28 -12.113  -3.504   0.581
  220    HA   ILE  28           HA       ILE  28 -10.936  -0.855   1.013
  221    HB   ILE  28           HB       ILE  28 -10.332  -3.057  -0.963
  222   1HG1  ILE  28          HG12      ILE  28  -9.861  -3.703   1.346
  223   2HG1  ILE  28          HG11      ILE  28  -8.358  -3.451   0.470
  224   1HG2  ILE  28          HG21      ILE  28  -8.156  -1.735  -1.167
  225   2HG2  ILE  28          HG22      ILE  28  -9.018  -0.410  -0.401
  226   3HG2  ILE  28          HG23      ILE  28  -9.572  -1.044  -1.949
  227   1HD1  ILE  28          HD11      ILE  28  -9.575  -1.827   2.661
  228   2HD1  ILE  28          HD12      ILE  28  -8.610  -0.979   1.454
  229   3HD1  ILE  28          HD13      ILE  28  -7.894  -2.276   2.402
  230    H    LEU  29           HN       LEU  29 -11.879  -2.435  -2.102
  231    HA   LEU  29           HA       LEU  29 -12.177  -0.149  -3.617
  232   1HB   LEU  29          HB2       LEU  29 -13.555  -2.798  -3.601
  233   2HB   LEU  29          HB1       LEU  29 -14.226  -1.545  -4.639
  234    HG   LEU  29           HG       LEU  29 -12.564  -3.009  -5.757
  235   1HD1  LEU  29          HD11      LEU  29 -12.967  -0.423  -6.230
  236   2HD1  LEU  29          HD12      LEU  29 -11.725  -1.325  -7.093
  237   3HD1  LEU  29          HD13      LEU  29 -11.279  -0.311  -5.727
  238   1HD2  LEU  29          HD21      LEU  29 -10.515  -1.670  -4.000
  239   2HD2  LEU  29          HD22      LEU  29 -10.211  -2.869  -5.254
  240   3HD2  LEU  29          HD23      LEU  29 -11.083  -3.326  -3.794
  241    H    ASP  30           HN       ASP  30 -14.178  -1.178  -0.976
  242    HA   ASP  30           HA       ASP  30 -16.446   0.536  -1.634
  243   1HB   ASP  30          HB2       ASP  30 -15.545  -0.884   0.883
  244   2HB   ASP  30          HB1       ASP  30 -16.944   0.191   0.878
  245    H    ALA  31           HN       ALA  31 -13.693   0.715   0.614
  246    HA   ALA  31           HA       ALA  31 -14.153   3.209   1.755
  247   1HB   ALA  31          HB1       ALA  31 -12.244   1.596   2.197
  248   2HB   ALA  31          HB2       ALA  31 -11.861   3.316   2.251
  249   3HB   ALA  31          HB3       ALA  31 -11.428   2.358   0.833
  250    H    PHE  32           HN       PHE  32 -12.913   2.492  -1.470
  251    HA   PHE  32           HA       PHE  32 -12.293   5.270  -2.037
  252   1HB   PHE  32          HB2       PHE  32 -12.681   2.832  -3.796
  253   2HB   PHE  32          HB1       PHE  32 -12.335   4.431  -4.456
  254    HD1  PHE  32           HD1      PHE  32 -10.109   5.207  -4.573
  255    HD2  PHE  32           HD2      PHE  32 -11.082   1.938  -1.956
  256    HE1  PHE  32           HE1      PHE  32  -7.701   4.876  -4.094
  257    HE2  PHE  32           HE2      PHE  32  -8.664   1.605  -1.488
  258    HZ   PHE  32           HZ       PHE  32  -6.981   3.076  -2.552
  259    H    ASP  33           HN       ASP  33 -15.124   3.169  -2.437
  260    HA   ASP  33           HA       ASP  33 -16.621   5.176  -3.912
  261   1HB   ASP  33          HB2       ASP  33 -17.642   2.811  -2.299
  262   2HB   ASP  33          HB1       ASP  33 -18.566   3.731  -3.486
  263    H    LYS  34           HN       LYS  34 -15.363   5.235  -0.959
  264    HA   LYS  34           HA       LYS  34 -17.615   6.829   0.234
  265   1HB   LYS  34          HB2       LYS  34 -15.503   5.091   1.564
  266   2HB   LYS  34          HB1       LYS  34 -16.589   6.164   2.446
  267   1HG   LYS  34          HG2       LYS  34 -18.465   4.848   2.029
  268   2HG   LYS  34          HG1       LYS  34 -17.805   4.183   0.537
  269   1HD   LYS  34          HD2       LYS  34 -17.936   2.566   2.505
  270   2HD   LYS  34          HD1       LYS  34 -16.361   2.689   1.731
  271   1HE   LYS  34          HE2       LYS  34 -15.417   3.832   3.526
  272   2HE   LYS  34          HE1       LYS  34 -16.963   4.500   4.047
  273   1HZ   LYS  34          HZ1       LYS  34 -16.122   2.738   5.518
  274   2HZ   LYS  34          HZ2       LYS  34 -16.221   1.632   4.232
  275   3HZ   LYS  34          HZ3       LYS  34 -17.631   2.358   4.843
  276    H    MET  35           HN       MET  35 -14.173   6.358   0.941
  277    HA   MET  35           HA       MET  35 -13.679   9.066   1.656
  278   1HB   MET  35          HB2       MET  35 -11.977   7.809   2.510
  279   2HB   MET  35          HB1       MET  35 -12.178   6.582   1.281
  280   1HG   MET  35          HG2       MET  35 -10.886   8.086  -0.316
  281   2HG   MET  35          HG1       MET  35 -10.579   9.149   1.058
  282   1HE   MET  35          HE1       MET  35  -9.169   4.982   0.086
  283   2HE   MET  35          HE2       MET  35 -10.684   5.782  -0.327
  284   3HE   MET  35          HE3       MET  35 -10.530   4.947   1.218
  285    H    CYS  36           HN       CYS  36 -12.995   7.320  -1.403
  286    HA   CYS  36           HA       CYS  36 -12.195   9.845  -2.688
  287   1HB   CYS  36          HB2       CYS  36 -11.029   7.800  -3.339
  288   2HB   CYS  36          HB1       CYS  36 -12.545   7.038  -3.794
  289    H    SER  37           HN       SER  37 -14.968   9.227  -1.576
  290    HA   SER  37           HA       SER  37 -16.640   9.489  -4.018
  291   1HB   SER  37          HB2       SER  37 -17.203   8.001  -1.958
  292   2HB   SER  37          HB1       SER  37 -17.670   9.507  -1.182
  293    HG   SER  37           HG       SER  37 -18.599   8.754  -3.748
  294    H    LYS  38           HN       LYS  38 -16.026  11.165  -0.939
  295    HA   LYS  38           HA       LYS  38 -17.540  13.522  -1.576
  296   1HB   LYS  38          HB2       LYS  38 -16.249  14.534   0.314
  297   2HB   LYS  38          HB1       LYS  38 -16.961  12.975   0.733
  298   1HG   LYS  38          HG2       LYS  38 -14.751  11.900   0.115
  299   2HG   LYS  38          HG1       LYS  38 -14.078  13.524  -0.028
  300   1HD   LYS  38          HD2       LYS  38 -14.896  13.938   2.349
  301   2HD   LYS  38          HD1       LYS  38 -15.217  12.205   2.445
  302   1HE   LYS  38          HE2       LYS  38 -12.836  11.768   1.839
  303   2HE   LYS  38          HE1       LYS  38 -12.538  13.506   1.874
  304   1HZ   LYS  38          HZ1       LYS  38 -13.355  11.761   4.125
  305   2HZ   LYS  38          HZ2       LYS  38 -13.410  13.457   4.204
  306   3HZ   LYS  38          HZ3       LYS  38 -11.927  12.663   3.975
  307    H    LEU  39           HN       LEU  39 -14.378  12.431  -2.462
  308    HA   LEU  39           HA       LEU  39 -12.896  14.700  -2.868
  309   1HB   LEU  39          HB2       LEU  39 -12.907  12.047  -3.937
  310   2HB   LEU  39          HB1       LEU  39 -12.777  13.104  -5.321
  311    HG   LEU  39           HG       LEU  39 -10.912  14.146  -3.417
  312   1HD1  LEU  39          HD11      LEU  39 -10.522  11.171  -3.704
  313   2HD1  LEU  39          HD12      LEU  39 -11.221  11.918  -2.266
  314   3HD1  LEU  39          HD13      LEU  39  -9.566  12.304  -2.745
  315   1HD2  LEU  39          HD21      LEU  39 -10.744  14.028  -5.916
  316   2HD2  LEU  39          HD22      LEU  39 -10.341  12.319  -5.757
  317   3HD2  LEU  39          HD23      LEU  39  -9.270  13.544  -5.076
  318    HA   PRO  40           HA       PRO  40 -15.205  17.346  -5.609
  319   1HB   PRO  40          HB2       PRO  40 -12.882  18.104  -7.206
  320   2HB   PRO  40          HB1       PRO  40 -13.747  19.073  -6.006
  321   1HG   PRO  40          HG2       PRO  40 -11.149  17.883  -5.725
  322   2HG   PRO  40          HG1       PRO  40 -12.060  18.766  -4.492
  323   1HD   PRO  40          HD2       PRO  40 -11.550  15.921  -4.623
  324   2HD   PRO  40          HD1       PRO  40 -12.422  16.817  -3.363
  325    H    LYS  41           HN       LYS  41 -16.351  16.730  -7.403
  326    HA   LYS  41           HA       LYS  41 -16.210  14.401  -8.778
  327   1HB   LYS  41          HB2       LYS  41 -17.909  16.237  -9.067
  328   2HB   LYS  41          HB1       LYS  41 -16.779  17.003 -10.184
  329   1HG   LYS  41          HG2       LYS  41 -16.796  15.043 -11.618
  330   2HG   LYS  41          HG1       LYS  41 -17.845  14.186 -10.488
  331   1HD   LYS  41          HD2       LYS  41 -19.733  15.333 -11.146
  332   2HD   LYS  41          HD1       LYS  41 -18.862  16.846 -11.381
  333   1HE   LYS  41          HE2       LYS  41 -19.654  16.014 -13.535
  334   2HE   LYS  41          HE1       LYS  41 -17.892  15.940 -13.478
  335   1HZ   LYS  41          HZ1       LYS  41 -19.423  13.889 -14.193
  336   2HZ   LYS  41          HZ2       LYS  41 -19.292  13.581 -12.527
  337   3HZ   LYS  41          HZ3       LYS  41 -17.893  13.705 -13.484
  338    H    SER  42           HN       SER  42 -14.436  17.301  -9.761
  339    HA   SER  42           HA       SER  42 -13.277  16.351 -12.129
  340   1HB   SER  42          HB2       SER  42 -13.050  18.672 -11.041
  341   2HB   SER  42          HB1       SER  42 -11.732  17.977 -10.099
  342    HG   SER  42           HG       SER  42 -11.570  17.365 -12.749
  343    H    LEU  43           HN       LEU  43 -11.642  16.298  -8.938
  344    HA   LEU  43           HA       LEU  43  -9.765  14.294  -9.944
  345   1HB   LEU  43          HB2       LEU  43 -10.112  15.763  -7.342
  346   2HB   LEU  43          HB1       LEU  43  -9.073  14.338  -7.407
  347    HG   LEU  43           HG       LEU  43  -7.865  15.419  -9.350
  348   1HD1  LEU  43          HD11      LEU  43  -9.539  17.013 -10.046
  349   2HD1  LEU  43          HD12      LEU  43  -8.138  17.918  -9.468
  350   3HD1  LEU  43          HD13      LEU  43  -9.568  17.756  -8.446
  351   1HD2  LEU  43          HD21      LEU  43  -6.633  17.002  -7.846
  352   2HD2  LEU  43          HD22      LEU  43  -6.902  15.413  -7.127
  353   3HD2  LEU  43          HD23      LEU  43  -7.906  16.782  -6.643
  354    H    SER  44           HN       SER  44 -12.912  14.059  -8.882
  355    HA   SER  44           HA       SER  44 -12.562  11.601  -7.307
  356   1HB   SER  44          HB2       SER  44 -14.823  11.754  -6.848
  357   2HB   SER  44          HB1       SER  44 -14.584  13.425  -7.341
  358    HG   SER  44           HG       SER  44 -16.258  11.841  -8.394
  359    H    GLU  45           HN       GLU  45 -12.976  12.711 -10.523
  360    HA   GLU  45           HA       GLU  45 -13.729  10.131 -11.623
  361   1HB   GLU  45          HB2       GLU  45 -12.904  12.761 -12.864
  362   2HB   GLU  45          HB1       GLU  45 -13.245  11.322 -13.826
  363   1HG   GLU  45          HG2       GLU  45 -15.199  12.471 -11.819
  364   2HG   GLU  45          HG1       GLU  45 -15.214  12.892 -13.533
  365    H    GLU  46           HN       GLU  46 -10.836  12.172 -11.421
  366    HA   GLU  46           HA       GLU  46  -9.169  10.253 -12.821
  367   1HB   GLU  46          HB2       GLU  46  -8.577  12.721 -11.186
  368   2HB   GLU  46          HB1       GLU  46  -7.290  11.704 -11.830
  369   1HG   GLU  46          HG2       GLU  46  -7.805  13.571 -13.367
  370   2HG   GLU  46          HG1       GLU  46  -8.169  12.013 -14.108
  371    H    CYS  47           HN       CYS  47 -10.180  10.747  -9.525
  372    HA   CYS  47           HA       CYS  47  -8.051   9.174  -8.318
  373   1HB   CYS  47          HB2       CYS  47  -9.101  10.641  -6.806
  374   2HB   CYS  47          HB1       CYS  47 -10.706  10.237  -7.395
  375    H    GLN  48           HN       GLN  48 -11.129   8.516  -9.841
  376    HA   GLN  48           HA       GLN  48 -11.215   5.754  -8.836
  377   1HB   GLN  48          HB2       GLN  48 -13.014   7.473 -10.540
  378   2HB   GLN  48          HB1       GLN  48 -13.236   5.723 -10.500
  379   1HG   GLN  48          HG2       GLN  48 -13.058   7.353  -7.958
  380   2HG   GLN  48          HG1       GLN  48 -14.591   7.115  -8.799
  381   1HE2  GLN  48          HE21      GLN  48 -13.230   5.953  -6.172
  382   2HE2  GLN  48          HE22      GLN  48 -13.589   4.297  -6.286
  383    H    GLU  49           HN       GLU  49  -9.833   7.558 -11.344
  384    HA   GLU  49           HA       GLU  49  -9.881   5.467 -13.353
  385   1HB   GLU  49          HB2       GLU  49  -8.393   8.068 -13.033
  386   2HB   GLU  49          HB1       GLU  49  -7.894   6.924 -14.278
  387   1HG   GLU  49          HG2       GLU  49  -9.991   7.040 -15.385
  388   2HG   GLU  49          HG1       GLU  49 -10.769   7.812 -14.005
  389    H    VAL  50           HN       VAL  50  -7.628   6.597 -10.855
  390    HA   VAL  50           HA       VAL  50  -5.616   4.619 -11.576
  391    HB   VAL  50           HB       VAL  50  -5.803   6.131  -8.968
  392   1HG1  VAL  50          HG11      VAL  50  -3.601   4.732 -10.519
  393   2HG1  VAL  50          HG12      VAL  50  -4.207   4.342  -8.908
  394   3HG1  VAL  50          HG13      VAL  50  -3.282   5.822  -9.165
  395   1HG2  VAL  50          HG21      VAL  50  -5.853   7.847 -10.607
  396   2HG2  VAL  50          HG22      VAL  50  -4.784   6.955 -11.695
  397   3HG2  VAL  50          HG23      VAL  50  -4.141   7.675 -10.218
  398    H    VAL  51           HN       VAL  51  -8.044   4.897  -8.924
  399    HA   VAL  51           HA       VAL  51  -7.329   2.598  -7.463
  400    HB   VAL  51           HB       VAL  51  -9.337   4.280  -7.126
  401   1HG1  VAL  51          HG11      VAL  51 -10.409   3.495  -9.306
  402   2HG1  VAL  51          HG12      VAL  51 -11.473   3.572  -7.906
  403   3HG1  VAL  51          HG13      VAL  51 -10.841   2.020  -8.454
  404   1HG2  VAL  51          HG21      VAL  51  -8.731   2.490  -5.543
  405   2HG2  VAL  51          HG22      VAL  51  -9.642   1.331  -6.508
  406   3HG2  VAL  51          HG23      VAL  51 -10.481   2.641  -5.688
  407    H    ASP  52           HN       ASP  52  -9.114   2.840 -10.522
  408    HA   ASP  52           HA       ASP  52  -9.661   0.035 -10.798
  409   1HB   ASP  52          HB2       ASP  52 -10.684   1.776 -12.263
  410   2HB   ASP  52          HB1       ASP  52  -9.098   2.086 -12.971
  411    H    THR  53           HN       THR  53  -6.894   2.108 -11.596
  412    HA   THR  53           HA       THR  53  -5.348  -0.122 -12.650
  413    HB   THR  53           HB       THR  53  -4.522   2.693 -12.087
  414    HG1  THR  53           HG1      THR  53  -6.118   1.995 -13.815
  415   1HG2  THR  53          HG21      THR  53  -2.613   1.093 -12.059
  416   2HG2  THR  53          HG22      THR  53  -2.552   2.173 -13.449
  417   3HG2  THR  53          HG23      THR  53  -3.117   0.515 -13.645
  418    H    TYR  54           HN       TYR  54  -5.879   1.314  -9.587
  419    HA   TYR  54           HA       TYR  54  -3.798  -0.485  -8.393
  420   1HB   TYR  54          HB2       TYR  54  -4.469   2.364  -7.629
  421   2HB   TYR  54          HB1       TYR  54  -3.551   1.273  -6.596
  422    HD1  TYR  54           HD1      TYR  54  -3.624   2.485 -10.101
  423    HD2  TYR  54           HD2      TYR  54  -1.215   1.255  -6.805
  424    HE1  TYR  54           HE1      TYR  54  -1.614   3.125 -11.378
  425    HE2  TYR  54           HE2      TYR  54   0.834   1.866  -8.068
  426    HH   TYR  54           HH       TYR  54   1.482   2.130 -10.505
  427    H    GLY  55           HN       GLY  55  -5.870  -1.852  -8.256
  428   1HA   GLY  55          HA2       GLY  55  -7.253  -1.237  -5.684
  429   2HA   GLY  55          HA1       GLY  55  -8.227  -1.618  -7.107
  430    H    SER  56           HN       SER  56  -7.259  -3.760  -8.250
  431    HA   SER  56           HA       SER  56  -7.432  -5.819  -6.145
  432   1HB   SER  56          HB2       SER  56  -7.046  -6.386  -9.079
  433   2HB   SER  56          HB1       SER  56  -7.889  -7.344  -7.865
  434    HG   SER  56           HG       SER  56  -9.151  -5.130  -7.810
  435    H    SER  57           HN       SER  57  -4.972  -4.204  -7.890
  436    HA   SER  57           HA       SER  57  -3.010  -6.404  -7.533
  437   1HB   SER  57          HB2       SER  57  -2.797  -3.664  -8.817
  438   2HB   SER  57          HB1       SER  57  -1.427  -4.756  -8.620
  439    HG   SER  57           HG       SER  57  -3.035  -6.311  -9.686
  440    H    ILE  58           HN       ILE  58  -2.794  -2.893  -6.955
  441    HA   ILE  58           HA       ILE  58  -0.886  -2.557  -5.104
  442    HB   ILE  58           HB       ILE  58  -2.524  -0.836  -5.751
  443   1HG1  ILE  58          HG12      ILE  58  -2.036  -1.217  -2.785
  444   2HG1  ILE  58          HG11      ILE  58  -1.111  -0.213  -3.911
  445   1HG2  ILE  58          HG21      ILE  58  -4.354  -1.740  -3.584
  446   2HG2  ILE  58          HG22      ILE  58  -4.494  -2.472  -5.191
  447   3HG2  ILE  58          HG23      ILE  58  -4.705  -0.737  -4.979
  448   1HD1  ILE  58          HD11      ILE  58  -3.333   1.071  -4.287
  449   2HD1  ILE  58          HD12      ILE  58  -2.502   1.331  -2.751
  450   3HD1  ILE  58          HD13      ILE  58  -3.899   0.252  -2.829
  451    H    LEU  59           HN       LEU  59  -4.043  -3.929  -4.285
  452    HA   LEU  59           HA       LEU  59  -3.201  -4.478  -1.537
  453   1HB   LEU  59          HB2       LEU  59  -5.566  -5.883  -2.774
  454   2HB   LEU  59          HB1       LEU  59  -5.342  -5.340  -1.116
  455    HG   LEU  59           HG       LEU  59  -5.593  -3.425  -3.410
  456   1HD1  LEU  59          HD11      LEU  59  -7.820  -4.362  -1.615
  457   2HD1  LEU  59          HD12      LEU  59  -7.597  -4.893  -3.284
  458   3HD1  LEU  59          HD13      LEU  59  -7.944  -3.203  -2.938
  459   1HD2  LEU  59          HD21      LEU  59  -4.643  -2.763  -1.092
  460   2HD2  LEU  59          HD22      LEU  59  -6.295  -2.964  -0.521
  461   3HD2  LEU  59          HD23      LEU  59  -5.925  -1.765  -1.763
  462    H    SER  60           HN       SER  60  -3.941  -6.523  -4.394
  463    HA   SER  60           HA       SER  60  -2.968  -8.933  -3.070
  464   1HB   SER  60          HB2       SER  60  -4.771  -8.810  -4.862
  465   2HB   SER  60          HB1       SER  60  -3.467  -8.576  -6.023
  466    HG   SER  60           HG       SER  60  -3.076 -10.630  -5.900
  467    H    ILE  61           HN       ILE  61  -1.243  -6.405  -4.271
  468    HA   ILE  61           HA       ILE  61   0.876  -8.066  -5.535
  469    HB   ILE  61           HB       ILE  61  -0.193  -5.798  -6.360
  470   1HG1  ILE  61          HG12      ILE  61   1.647  -7.125  -7.441
  471   2HG1  ILE  61          HG11      ILE  61   1.697  -5.401  -7.755
  472   1HG2  ILE  61          HG21      ILE  61   1.102  -3.827  -5.800
  473   2HG2  ILE  61          HG22      ILE  61   2.063  -4.746  -4.652
  474   3HG2  ILE  61          HG23      ILE  61   0.339  -4.501  -4.369
  475   1HD1  ILE  61          HD11      ILE  61   3.436  -5.117  -6.070
  476   2HD1  ILE  61          HD12      ILE  61   3.927  -6.348  -7.232
  477   3HD1  ILE  61          HD13      ILE  61   3.334  -6.827  -5.646
  478    H    LEU  62           HN       LEU  62   0.740  -5.511  -3.038
  479    HA   LEU  62           HA       LEU  62   3.364  -5.944  -2.062
  480   1HB   LEU  62          HB2       LEU  62   0.939  -4.926  -0.586
  481   2HB   LEU  62          HB1       LEU  62   2.603  -4.792  -0.014
  482    HG   LEU  62           HG       LEU  62   1.611  -3.690  -2.645
  483   1HD1  LEU  62          HD11      LEU  62   1.820  -1.469  -1.546
  484   2HD1  LEU  62          HD12      LEU  62   2.160  -2.287  -0.020
  485   3HD1  LEU  62          HD13      LEU  62   0.584  -2.477  -0.791
  486   1HD2  LEU  62          HD21      LEU  62   3.873  -2.331  -2.190
  487   2HD2  LEU  62          HD22      LEU  62   3.843  -3.871  -3.044
  488   3HD2  LEU  62          HD23      LEU  62   4.275  -3.821  -1.334
  489    H    LEU  63           HN       LEU  63   1.047  -8.238  -2.151
  490    HA   LEU  63           HA       LEU  63   1.642  -9.372   0.535
  491   1HB   LEU  63          HB2       LEU  63  -0.079 -10.833  -1.429
  492   2HB   LEU  63          HB1       LEU  63  -0.268 -10.653   0.313
  493    HG   LEU  63           HG       LEU  63  -0.971  -8.693  -1.871
  494   1HD1  LEU  63          HD11      LEU  63  -3.189  -8.813  -0.749
  495   2HD1  LEU  63          HD12      LEU  63  -2.519  -9.956   0.413
  496   3HD1  LEU  63          HD13      LEU  63  -2.635 -10.397  -1.290
  497   1HD2  LEU  63          HD21      LEU  63  -1.746  -7.401   0.432
  498   2HD2  LEU  63          HD22      LEU  63  -0.265  -7.042  -0.442
  499   3HD2  LEU  63          HD23      LEU  63  -0.224  -8.114   0.956
  500    H    GLU  64           HN       GLU  64   1.824 -10.417  -2.910
  501    HA   GLU  64           HA       GLU  64   3.952 -12.366  -2.056
  502   1HB   GLU  64          HB2       GLU  64   1.736 -12.756  -4.076
  503   2HB   GLU  64          HB1       GLU  64   3.041 -13.906  -3.780
  504   1HG   GLU  64          HG2       GLU  64   1.151 -12.945  -1.616
  505   2HG   GLU  64          HG1       GLU  64   0.891 -14.423  -2.543
  506    H    GLU  65           HN       GLU  65   2.595 -10.923  -5.063
  507    HA   GLU  65           HA       GLU  65   4.866 -11.363  -6.651
  508   1HB   GLU  65          HB2       GLU  65   3.179  -8.847  -6.733
  509   2HB   GLU  65          HB1       GLU  65   4.091  -9.554  -8.066
  510   1HG   GLU  65          HG2       GLU  65   2.661 -11.583  -7.937
  511   2HG   GLU  65          HG1       GLU  65   1.721 -10.814  -6.657
  512    H    VAL  66           HN       VAL  66   4.551  -9.574  -3.895
  513    HA   VAL  66           HA       VAL  66   7.236  -8.365  -4.199
  514    HB   VAL  66           HB       VAL  66   4.595  -7.068  -3.734
  515   1HG1  VAL  66          HG11      VAL  66   5.791  -5.059  -2.797
  516   2HG1  VAL  66          HG12      VAL  66   7.164  -6.127  -2.492
  517   3HG1  VAL  66          HG13      VAL  66   5.615  -6.426  -1.699
  518   1HG2  VAL  66          HG21      VAL  66   7.095  -6.176  -5.140
  519   2HG2  VAL  66          HG22      VAL  66   5.536  -5.354  -5.168
  520   3HG2  VAL  66          HG23      VAL  66   5.705  -6.957  -5.890
  521    H    SER  67           HN       SER  67   8.381  -9.186  -2.477
  522    HA   SER  67           HA       SER  67   7.042 -10.313  -0.168
  523   1HB   SER  67          HB2       SER  67   9.894  -9.871  -0.990
  524   2HB   SER  67          HB1       SER  67   9.556 -10.248   0.696
  525    HG   SER  67           HG       SER  67   8.608 -12.150   0.060
  526    HA   PRO  68           HA       PRO  68   6.557  -6.685   2.311
  527   1HB   PRO  68          HB2       PRO  68   7.714  -7.745   4.735
  528   2HB   PRO  68          HB1       PRO  68   5.998  -7.577   4.315
  529   1HG   PRO  68          HG2       PRO  68   7.633 -10.009   4.368
  530   2HG   PRO  68          HG1       PRO  68   5.882  -9.864   4.159
  531   1HD   PRO  68          HD2       PRO  68   7.755 -10.560   2.143
  532   2HD   PRO  68          HD1       PRO  68   6.052 -10.128   1.895
  533    H    GLU  69           HN       GLU  69   9.719  -8.316   2.661
  534    HA   GLU  69           HA       GLU  69  11.143  -6.028   3.605
  535   1HB   GLU  69          HB2       GLU  69  12.081  -8.298   3.716
  536   2HB   GLU  69          HB1       GLU  69  12.150  -8.373   1.957
  537   1HG   GLU  69          HG2       GLU  69  13.536  -6.142   3.445
  538   2HG   GLU  69          HG1       GLU  69  14.312  -7.714   3.269
  539    H    LEU  70           HN       LEU  70  10.662  -7.256   0.279
  540    HA   LEU  70           HA       LEU  70  12.199  -5.376  -1.114
  541   1HB   LEU  70          HB2       LEU  70  11.187  -7.162  -2.340
  542   2HB   LEU  70          HB1       LEU  70   9.573  -6.724  -1.785
  543    HG   LEU  70           HG       LEU  70   9.627  -4.677  -3.097
  544   1HD1  LEU  70          HD11      LEU  70  11.925  -4.021  -3.002
  545   2HD1  LEU  70          HD12      LEU  70  11.624  -4.396  -4.694
  546   3HD1  LEU  70          HD13      LEU  70  12.469  -5.556  -3.669
  547   1HD2  LEU  70          HD21      LEU  70   9.069  -6.952  -4.147
  548   2HD2  LEU  70          HD22      LEU  70  10.669  -6.888  -4.880
  549   3HD2  LEU  70          HD23      LEU  70   9.471  -5.651  -5.266
  550    H    VAL  71           HN       VAL  71   8.841  -5.079   0.046
  551    HA   VAL  71           HA       VAL  71   8.144  -2.591  -0.975
  552    HB   VAL  71           HB       VAL  71   7.640  -3.377   1.902
  553   1HG1  VAL  71          HG11      VAL  71   6.817  -1.171   1.360
  554   2HG1  VAL  71          HG12      VAL  71   5.432  -2.261   1.376
  555   3HG1  VAL  71          HG13      VAL  71   6.129  -1.745  -0.159
  556   1HG2  VAL  71          HG21      VAL  71   7.159  -5.316   0.602
  557   2HG2  VAL  71          HG22      VAL  71   6.417  -4.368  -0.672
  558   3HG2  VAL  71          HG23      VAL  71   5.608  -4.533   0.888
  559    H    CYS  72           HN       CYS  72   9.646  -3.015   2.257
  560    HA   CYS  72           HA       CYS  72  10.212  -0.340   2.811
  561   1HB   CYS  72          HB2       CYS  72  10.801  -2.165   4.376
  562   2HB   CYS  72          HB1       CYS  72  12.143  -2.625   3.320
  563    H    SER  73           HN       SER  73  11.662  -2.363   0.384
  564    HA   SER  73           HA       SER  73  13.851  -0.479  -0.159
  565   1HB   SER  73          HB2       SER  73  13.280  -3.174  -0.854
  566   2HB   SER  73          HB1       SER  73  13.324  -2.282  -2.372
  567    HG   SER  73           HG       SER  73  15.399  -2.218  -2.143
  568    H    MET  74           HN       MET  74  10.862  -1.523  -1.889
  569    HA   MET  74           HA       MET  74  10.952   0.413  -3.950
  570   1HB   MET  74          HB2       MET  74   8.602  -0.835  -2.491
  571   2HB   MET  74          HB1       MET  74   8.382   0.274  -3.843
  572   1HG   MET  74          HG2       MET  74  10.031  -1.327  -5.101
  573   2HG   MET  74          HG1       MET  74   9.595  -2.477  -3.841
  574   1HE   MET  74          HE1       MET  74   7.480  -3.485  -3.417
  575   2HE   MET  74          HE2       MET  74   5.948  -3.235  -4.258
  576   3HE   MET  74          HE3       MET  74   6.560  -1.996  -3.157
  577    H    LEU  75           HN       LEU  75   9.698   0.680  -0.633
  578    HA   LEU  75           HA       LEU  75   8.671   3.335  -0.889
  579   1HB   LEU  75          HB2       LEU  75   9.871   2.032   1.579
  580   2HB   LEU  75          HB1       LEU  75   8.808   3.437   1.564
  581    HG   LEU  75           HG       LEU  75   8.073   0.653   0.614
  582   1HD1  LEU  75          HD11      LEU  75   7.468   2.227   3.112
  583   2HD1  LEU  75          HD12      LEU  75   8.100   0.585   2.975
  584   3HD1  LEU  75          HD13      LEU  75   6.416   0.919   2.572
  585   1HD2  LEU  75          HD21      LEU  75   6.747   2.039  -0.720
  586   2HD2  LEU  75          HD22      LEU  75   6.658   3.308   0.504
  587   3HD2  LEU  75          HD23      LEU  75   5.715   1.828   0.693
  588    H    HIS  76           HN       HIS  76  11.887   2.140  -0.846
  589    HA   HIS  76           HA       HIS  76  13.908   3.279  -1.105
  590   1HB   HIS  76          HB2       HIS  76  12.034   4.925  -2.260
  591   2HB   HIS  76          HB1       HIS  76  12.694   6.003  -1.034
  592    HD1  HIS  76           HD1      HIS  76  15.282   6.545  -1.209
  593    HD2  HIS  76           HD2      HIS  76  13.745   4.343  -4.396
  594    HE1  HIS  76           HE1      HIS  76  17.025   6.635  -3.046
  595    H    LEU  77           HN       LEU  77  12.750   2.708   1.525
  596    HA   LEU  77           HA       LEU  77  13.599   5.003   3.188
  597   1HB   LEU  77          HB2       LEU  77  11.763   2.764   3.541
  598   2HB   LEU  77          HB1       LEU  77  12.953   2.729   4.833
  599    HG   LEU  77           HG       LEU  77  12.442   5.235   5.119
  600   1HD1  LEU  77          HD11      LEU  77  10.265   5.984   4.319
  601   2HD1  LEU  77          HD12      LEU  77   9.968   4.410   3.581
  602   3HD1  LEU  77          HD13      LEU  77  11.238   5.455   2.946
  603   1HD2  LEU  77          HD21      LEU  77  10.234   3.241   5.696
  604   2HD2  LEU  77          HD22      LEU  77  10.523   4.751   6.559
  605   3HD2  LEU  77          HD23      LEU  77  11.690   3.433   6.671
  606    H    CYS  78           HN       CYS  78  14.853   2.061   1.932
  607    HA   CYS  78           HA       CYS  78  17.401   2.525   3.339
  608   1HB   CYS  78          HB2       CYS  78  15.642   0.136   3.867
  609   2HB   CYS  78          HB1       CYS  78  17.393   0.049   4.072
  610    H    SER  79           HN       SER  79  17.773   2.820   0.808
  611    HA   SER  79           HA       SER  79  17.483   0.740  -1.048
  612   1HB   SER  79          HB2       SER  79  18.204   2.899  -1.808
  613   2HB   SER  79          HB1       SER  79  19.628   2.859  -0.773
  614    HG   SER  79           HG       SER  79  19.079   1.474  -3.154
  615    H    GLY  80           HN       GLY  80  19.938  -0.046  -2.011
  616   1HA   GLY  80          HA2       GLY  80  20.619  -2.219  -0.237
  617   2HA   GLY  80          HA1       GLY  80  21.499  -1.788  -1.707
  618    H    LEU  81           HN       LEU  81  22.129   0.862  -1.027
  619    HA   LEU  81           HA       LEU  81  23.924   0.591   1.336
  620   1HB   LEU  81          HB2       LEU  81  25.415   2.203  -0.093
  621   2HB   LEU  81          HB1       LEU  81  25.441   0.481  -0.459
  622    HG   LEU  81           HG       LEU  81  23.851   0.785  -2.262
  623   1HD1  LEU  81          HD11      LEU  81  23.772   3.633  -1.247
  624   2HD1  LEU  81          HD12      LEU  81  22.421   2.553  -1.590
  625   3HD1  LEU  81          HD13      LEU  81  23.345   3.252  -2.914
  626   1HD2  LEU  81          HD21      LEU  81  25.256   2.375  -3.696
  627   2HD2  LEU  81          HD22      LEU  81  26.116   1.029  -2.949
  628   3HD2  LEU  81          HD23      LEU  81  26.231   2.644  -2.251
  629    H    VAL  82           HN       VAL  82  24.804   3.136   1.522
  630    HA   VAL  82           HA       VAL  82  22.335   4.523   2.199
  631    HB   VAL  82           HB       VAL  82  23.990   6.415   2.841
  632   1HG1  VAL  82          HG11      VAL  82  22.840   4.946   4.446
  633   2HG1  VAL  82          HG12      VAL  82  24.493   5.283   4.967
  634   3HG1  VAL  82          HG13      VAL  82  24.099   3.726   4.237
  635   1HG2  VAL  82          HG21      VAL  82  25.902   4.065   2.608
  636   2HG2  VAL  82          HG22      VAL  82  26.292   5.685   3.183
  637   3HG2  VAL  82          HG23      VAL  82  25.870   5.430   1.491
  638    HA   PRO  83           HA       PRO  83  21.972   6.355  -1.839
  639   1HB   PRO  83          HB2       PRO  83  20.759   8.737  -0.570
  640   2HB   PRO  83          HB1       PRO  83  20.061   7.612  -1.747
  641   1HG   PRO  83          HG2       PRO  83  19.436   7.684   0.994
  642   2HG   PRO  83          HG1       PRO  83  19.088   6.351  -0.116
  643   1HD   PRO  83          HD2       PRO  83  21.072   6.436   2.049
  644   2HD   PRO  83          HD1       PRO  83  20.525   5.050   1.070
  645    H    ARG  84           HN       ARG  84  23.598   7.550  -2.908
  646    HA   ARG  84           HA       ARG  84  25.552   9.024  -1.352
  647   1HB   ARG  84          HB2       ARG  84  25.099   8.573  -4.303
  648   2HB   ARG  84          HB1       ARG  84  26.305   9.738  -3.756
  649   1HG   ARG  84          HG2       ARG  84  27.387   7.591  -4.091
  650   2HG   ARG  84          HG1       ARG  84  27.348   7.941  -2.370
  651   1HD   ARG  84          HD2       ARG  84  25.537   6.457  -2.000
  652   2HD   ARG  84          HD1       ARG  84  25.189   6.307  -3.717
  653    HE   ARG  84           HE       ARG  84  27.037   4.721  -2.157
  654   1HH1  ARG  84          HH21      ARG  84  26.742   6.251  -5.243
  655   2HH1  ARG  84          HH22      ARG  84  27.994   5.297  -5.966
  656   1HH2  ARG  84          HH11      ARG  84  28.649   3.483  -3.091
  657   2HH2  ARG  84          HH12      ARG  84  29.070   3.735  -4.752