*HEADER    STRUCTURAL PROTEIN                      19-JUL-01   1JMQ              
*TITLE     YAP65 (L30K MUTANT) WW DOMAIN IN COMPLEX WITH GTPPPPYTVG              
*TITLE    2 PEPTIDE                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 65 KDA YES-ASSOCIATED PROTEIN;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: YAP65;                                                      
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES;                                                       
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: WW DOMAIN BINDING PROTEIN-1;                               
*COMPND   9 CHAIN: P;                                                            
*COMPND  10 FRAGMENT: RESIDUES 147-156;                                          
*COMPND  11 SYNONYM: WBP-1;                                                      
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: YAP65;                                                         
*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: PGAT2;                                    
*SOURCE  10 MOL_ID: 2;                                                           
*SOURCE  11 SYNTHETIC: YES;                                                      
*SOURCE  12 OTHER_DETAILS: THIS PEPTIDE WAS CHEMICALLY SYNTHESIZED.              
*SOURCE  13 THE SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO               
*SOURCE  14 SAPIENS (HUMAN).                                                     
*KEYWDS    WW DOMAIN, POLYPROLINE LIGAND, YAP65 MUTANT                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.R.PIRES, F.TAHA-NEJAD, F.TOEPERT, T.AST, U.HOFFMULLER,              
*AUTHOR   2 J.SCHNEIDER-MERGENER, R.KUHNE, M.J.MACIAS, H.OSCHKINAT               
*REVDAT   1   21-DEC-01 1JMQ    0                                                

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 assign ( segid "   1" and  resid  15  and name  ha   )(segid "   1" and  resid  16  and name  hn   )  3   1.2 0.4  
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 assign ( segid "   1" and  resid  17  and name  hb1  )(segid "   1" and  resid  18  and name  hn   )  4   2.2 0.75
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 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  18  and name  hn   )  6.5 4.7 0.75
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 assign ( segid "   1" and  resid  18  and name  ha   )(segid "   1" and  resid  19  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  18  and name  hg#  )(segid "   1" and  resid  19  and name  hn   )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  18  and name  hb1  )(segid "   1" and  resid  19  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  18  and name  hb2  )(segid "   1" and  resid  19  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  18  and name  ha   )(segid "   1" and  resid  19  and name  he#  )  4 2.2 1.75 
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  20  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  19  and name  hb1  )(segid "   1" and  resid  20  and name  hn   )  3.5 1.7 0.5     
 assign ( segid "   1" and  resid  19  and name  hb2  )(segid "   1" and  resid  20  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  19  and name  hg2  )(segid "   1" and  resid  20  and name  hn   )  5 3.2 0.75
 assign ( segid "   1" and  resid  20  and name  ha   )(segid "   1" and  resid  21  and name  hn   )  3   1.2 0.4  
 assign ( segid "   1" and  resid  20  and name  hb#  )(segid "   1" and  resid  21  and name  hn   )  3 1.2 1.4 
 assign ( segid "   1" and  resid  21  and name  ha   )(segid "   1" and  resid  22  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  21  and name  hd#  )(segid "   1" and  resid  22  and name  hn   )  4   2.2 1.75
 assign ( segid "   1" and  resid  21  and name  hb1  )(segid "   1" and  resid  22  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  21  and name  hg#  )(segid "   1" and  resid  22  and name  hn   )  4   2.2 1.75
 assign ( segid "   1" and  resid  22  and name  ha   )(segid "   1" and  resid  23  and name  hn   )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  22  and name  hb   )(segid "   1" and  resid  23  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  23  and name  ha   )(segid "   1" and  resid  24  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  23  and name  hb#  )(segid "   1" and  resid  24  and name  hn   )  3 1.2 1.4 
 assign ( segid "   1" and  resid  23  and name  hn   )(segid "   1" and  resid  24  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  24  and name  ha   )(segid "   1" and  resid  25  and name  hn   )  5   3.2 0.75
 assign ( segid "   1" and  resid  24  and name  hb1  )(segid "   1" and  resid  25  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  24  and name  hb2  )(segid "   1" and  resid  25  and name  hn   )  3.7 1.9 0.75
 assign ( segid "   1" and  resid  24  and name  hn   )(segid "   1" and  resid  25  and name  hn   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  25  and name  ha1  )(segid "   1" and  resid  26  and name  hn   )  4.5 2.7 0.75
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 assign ( segid "   1" and  resid  25  and name  hn   )(segid "   1" and  resid  26  and name  hn   )  2.5 0.7 0.3  
 assign ( segid "   1" and  resid  26  and name  ha   )(segid "   1" and  resid  27  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  26  and name  hg1  )(segid "   1" and  resid  27  and name  hn   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  26  and name  hg2  )(segid "   1" and  resid  27  and name  hn   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  26  and name  hb1  )(segid "   1" and  resid  27  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  26  and name  hb2  )(segid "   1" and  resid  27  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  26  and name  hn   )(segid "   1" and  resid  27  and name  hn   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  27  and name  ha   )(segid "   1" and  resid  28  and name  hn   )  3   1.2 0.4 
 assign ( segid "   1" and  resid  27  and name  hd1  )(segid "   1" and  resid  28  and name  hn   )  5 3.2 0.75
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 assign ( segid "   1" and  resid  27  and name  hb1  )(segid "   1" and  resid  28  and name  hn   )  4.3 2.5 0.75
 assign ( segid "   1" and  resid  27  and name  hb2  )(segid "   1" and  resid  28  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  27  and name  hg1  )(segid "   1" and  resid  28  and name  hn   )  5.2 3.4 0.75
 assign ( segid "   1" and  resid  27  and name  hg2  )(segid "   1" and  resid  28  and name  hn   )  4.8 3 0.75
 assign ( segid "   1" and  resid  28  and name  ha   )(segid "   1" and  resid  29  and name  hn   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  28  and name  ha   )(segid "   1" and  resid  29  and name  hd#  )  3.5 1.7 1.5
 assign ( segid "   1" and  resid  28  and name  hb1  )(segid "   1" and  resid  29  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  28  and name  hb2  )(segid "   1" and  resid  29  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  29  and name  hn   )  4.5 2.7 1.75 
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  30  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  29  and name  hb1  )(segid "   1" and  resid  30  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  29  and name  hb2  )(segid "   1" and  resid  30  and name  hn   )  4.3 2.5 0.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  30  and name  hn   )  4 2.2 1.75
 assign ( segid "   1" and  resid  30  and name  ha   )(segid "   1" and  resid  31  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  30  and name  hg2  )(segid "   1" and  resid  31  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  30  and name  hg1  )(segid "   1" and  resid  31  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  30  and name  hb1  )(segid "   1" and  resid  31  and name  hn   )  5.5 3.7 0.75
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 assign ( segid "   1" and  resid  31  and name  ha   )(segid "   1" and  resid  32  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  32  and name  ha   )(segid "   1" and  resid  33  and name  hn   )  3.5 1.7 0.5
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 assign ( segid "   1" and  resid  33  and name  ha   )(segid "   1" and  resid  34  and name  hn   )  3.5 1.7 0.5
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 assign ( segid "   1" and  resid  34  and name  ha   )(segid "   1" and  resid  35  and name  hn   )  4   2.2 0.75
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 assign ( segid "   1" and  resid  34  and name  hb2  )(segid "   1" and  resid  35  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  34  and name  hn   )(segid "   1" and  resid  35  and name  hn   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  35  and name  ha   )(segid "   1" and  resid  36  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  35  and name  hb#  )(segid "   1" and  resid  36  and name  hn   )  4   2.2 1.75
 assign ( segid "   1" and  resid  35  and name  hg1  )(segid "   1" and  resid  36  and name  hn   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  36  and name  ha   )(segid "   1" and  resid  37  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  36  and name  hb   )(segid "   1" and  resid  37  and name  hn   )  3   1.2 0.4 
 assign ( segid "   1" and  resid  36  and name  hg2# )(segid "   1" and  resid  37  and name  hn   )  4   2.2 1.75
 assign ( segid "   1" and  resid  37  and name  ha   )(segid "   1" and  resid  38  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  37  and name  hb   )(segid "   1" and  resid  38  and name  hn   )  3   1.2 0.4 
 assign ( segid "   1" and  resid  37  and name  hg2# )(segid "   1" and  resid  38  and name  hn   )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  38  and name  ha   )(segid "   1" and  resid  39  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  38  and name  hb   )(segid "   1" and  resid  39  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  38  and name  hg2# )(segid "   1" and  resid  39  and name  hn   )  4.8 3 1.75
 assign ( segid "   1" and  resid  39  and name  ha   )(segid "   1" and  resid  40  and name  hn   )  4.8 3 0.75
 assign ( segid "   1" and  resid  39  and name  hb1  )(segid "   1" and  resid  40  and name  hn   )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  39  and name  hb2  )(segid "   1" and  resid  40  and name  hn   )  4.5 2.7 0.75 
 assign ( segid "   1" and  resid  40  and name  ha   )(segid "   1" and  resid  41  and name  hn   )  2.2 0.4 0.3 
 assign ( segid "   1" and  resid  40  and name  hb#  )(segid "   1" and  resid  41  and name  hn   )  4 2.2 1.75
 assign ( segid "   1" and  resid  40  and name  hn   )(segid "   1" and  resid  41  and name  hn   )  5.5 3.7 0.75 
 assign ( segid "   1" and  resid  40  and name  hg#  )(segid "   1" and  resid  41  and name  hn   )  5.2 3.4 1.75
 assign ( segid "   1" and  resid  41  and name  ha   )(segid "   1" and  resid  42  and name  hd1  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  41  and name  ha   )(segid "   1" and  resid  42  and name  hd2  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  43  and name  ha   )(segid "   1" and  resid  44  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  43  and name  hb#  )(segid "   1" and  resid  44  and name  hn   )  3.5 1.7 1.5
 assign ( segid "   1" and  resid  43  and name  hn   )(segid "   1" and  resid  44  and name  hn   )  3   1.2 0.4  
 assign ( segid "   1" and  resid  44  and name  ha   )(segid "   1" and  resid  45  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  44  and name  hn   )(segid "   1" and  resid  45  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  44  and name  hb#  )(segid "   1" and  resid  45  and name  hn   )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  44  and name  hg1  )(segid "   1" and  resid  45  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  44  and name  hg2  )(segid "   1" and  resid  45  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  45  and name  ha   )(segid "   1" and  resid  46  and name  hn   )  3 1.2 0.4
 assign ( segid "   1" and  resid  45  and name  hn   )(segid "   1" and  resid  46  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  45  and name  hb#  )(segid "   1" and  resid  46  and name  hn   )  3.5 1.7 1.5  
 assign ( segid "   1" and  resid  46  and name  ha   )(segid "   1" and  resid  47  and name  hn   )  3.3 1.5 0.5
 assign ( segid "   1" and  resid  46  and name  hn   )(segid "   1" and  resid  47  and name  hn   )  3.8 2 0.75
 assign ( segid "   1" and  resid  46  and name  hb1  )(segid "   1" and  resid  47  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  46  and name  hb2  )(segid "   1" and  resid  47  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  47  and name  ha   )(segid "   1" and  resid  48  and name  hn   )  3   1.2 0.4  
 assign ( segid "   1" and  resid  47  and name  hb#  )(segid "   1" and  resid  48  and name  hn   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  47  and name  hd1# )(segid "   1" and  resid  48  and name  hn   )  4.8 3 1.75
 assign ( segid "   1" and  resid  47  and name  hd2# )(segid "   1" and  resid  48  and name  hn   )  5   3.2 1.75
 assign ( segid "   1" and  resid  47  and name  hn   )(segid "   1" and  resid  48  and name  hn   )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  48  and name  ha   )(segid "   1" and  resid  49  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  48  and name  hn   )(segid "   1" and  resid  49  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  48  and name  hb#  )(segid "   1" and  resid  49  and name  hn   )  4   2.2 1.75
 assign ( segid "   1" and  resid  49  and name  ha   )(segid "   1" and  resid  50  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  49  and name  hb#  )(segid "   1" and  resid  50  and name  hn   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  49  and name  hg2  )(segid "   1" and  resid  50  and name  hn   )  5   3.2 0.75
 assign ( segid "   1" and  resid  15  and name  ha   )(segid "   1" and  resid  17  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  16  and name  hn   )(segid "   1" and  resid  32  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  31  and name  ha   )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  32  and name  hn   )  3.2 1.4 0.5 
 assign ( segid "   1" and  resid  18  and name  hn   )(segid "   1" and  resid  30  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  18  and name  hn   )(segid "   1" and  resid  30  and name  hb1  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  18  and name  hn   )(segid "   1" and  resid  30  and name  hg2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  30  and name  hn   )  3.5 1.7 0.5  
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  29  and name  ha   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  20  and name  hn   )(segid "   1" and  resid  28  and name  hn   )  3 1.2 0.4
 assign ( segid "   1" and  resid  21  and name  ha   )(segid "   1" and  resid  27  and name  ha   )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  21  and name  ha   )(segid "   1" and  resid  28  and name  hn   )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  22  and name  hn   )(segid "   1" and  resid  26  and name  hn   )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  27  and name  ha   )(segid "   1" and  resid  22  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  28  and name  ha   )(segid "   1" and  resid  39  and name  ha   )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  29  and name  hn   )(segid "   1" and  resid  38  and name  hn   )  3.7 1.9 0.75
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  20  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  30  and name  ha   )(segid "   1" and  resid  37  and name  ha   )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  30  and name  ha   )(segid "   1" and  resid  38  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  31  and name  ha   )(segid "   1" and  resid  18  and name  hn   )  5   3.2 0.75
 assign ( segid "   1" and  resid  31  and name  hn   )(segid "   1" and  resid  37  and name  ha   )  4   2.2 0.75
 assign ( segid "   1" and  resid  31  and name  hn   )(segid "   1" and  resid  36  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  32  and name  ha   )(segid "   1" and  resid  35  and name  ha   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  42  and name  ha   )(segid "   1" and  resid  45  and name  hb#  )  4.7 2.9 1.75
 assign ( segid "   1" and  resid  42  and name  ha   )(segid "   1" and  resid  45  and name  hn   )  4   2.2 0.75
 assign ( segid "   1" and  resid  45  and name  ha   )(segid "   1" and  resid  48  and name  hn   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  5   and name  hd#  )(segid "   1" and  resid  7  and name   ha   )  5   3.2 1.75
 assign ( segid "   1" and  resid  7   and name  hd1# )(segid "   1" and  resid  44  and name  hb#  )  4 2.2 2.75
 assign ( segid "   1" and  resid  7   and name  hd1# )(segid "   1" and  resid  44  and name  hg1  )  4 2.2 1.75
 assign ( segid "   1" and  resid  7   and name  hd1# )(segid "   1" and  resid  44  and name  hd#  )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  7   and name  hd1# )(segid "   1" and  resid  45  and name  ha   )  5 3.2 1.75
 assign ( segid "   1" and  resid  7   and name  hd1# )(segid "   1" and  resid  45  and name  hb#   )  5.2 3.4 1.75
 assign ( segid "   1" and  resid  7   and name  hg2# )(segid "   1" and  resid  45  and name  hb#   )  5.2 3.4 1.75
 assign ( segid "   1" and  resid  8   and name  hb#  )(segid "   1" and  resid  10  and name  hn   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  8   and name  hg#  )(segid "   1" and  resid  10  and name  hn   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  13  and name  ha   )(segid "   1" and  resid  43  and name  hb#  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  13  and name  ha   )(segid "   1" and  resid  43  and name  hg#  )  5 3.2 1.75
 assign ( segid "   1" and  resid  13  and name  ha   )(segid "   1" and  resid  43  and name  hd1  )  4 2.2 0.75  
 assign ( segid "   1" and  resid  13  and name  ha   )(segid "   1" and  resid  43  and name  hd2  )  4 2.2 0.75 
 assign ( segid "   1" and  resid  13  and name  hd1# )(segid "   1" and  resid  43  and name  hd1  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  13  and name  hd2# )(segid "   1" and  resid  43  and name  hd1  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  14  and name  hd2  )(segid "   1" and  resid  11  and name  hb   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  14  and name  hg1  )(segid "   1" and  resid  42  and name  hb1  )  4.5 2.7 0.75 
 assign ( segid "   1" and  resid  14  and name  hg1  )(segid "   1" and  resid  42  and name  hg1  )  6 4.2 0.75
 assign ( segid "   1" and  resid  14  and name  hg2  )(segid "   1" and  resid  42  and name  hb1  )  4.5 2.7 0.75 
 assign ( segid "   1" and  resid  14  and name  hg2  )(segid "   1" and  resid  42  and name  hg1  )  5 3.2 0.75
 assign ( segid "   1" and  resid  14  and name  hg2  )(segid "   1" and  resid  42  and name  hg2  )  4.8 3 0.75 
 assign ( segid "   1" and  resid  14  and name  hd1  )(segid "   1" and  resid  42  and name  ha   )  4.8 3 0.75 
 assign ( segid "   1" and  resid  14  and name  hd2  )(segid "   1" and  resid  42  and name  ha   )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  14  and name  hd2  )(segid "   1" and  resid  42  and name  hb1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  14  and name  hd2  )(segid "   1" and  resid  42  and name  hg1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  14  and name  hd2  )(segid "   1" and  resid  42  and name  hg2  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  15  and name  hb#  )(segid "   1" and  resid  17  and name  hn   )  4.8 3   1.75
 assign ( segid "   1" and  resid  16  and name  ha1  )(segid "   1" and  resid  32  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  16  and name  ha1  )(segid "   1" and  resid  33  and name  hd1# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  16  and name  ha1  )(segid "   1" and  resid  33  and name  hg11 )  4   2.2 0.75 
 assign ( segid "   1" and  resid  16  and name  ha1  )(segid "   1" and  resid  33  and name  hg12 )  4   2.2 0.75 
 assign ( segid "   1" and  resid  16  and name  ha2  )(segid "   1" and  resid  33  and name  hd1# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  16  and name  ha2  )(segid "   1" and  resid  33  and name  hg11 )  4.5 2.7 0.75  
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  32  and name  hd2  )  3.8 2 0.75
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  31  and name  hb2  )  4.8 3 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  ha   )  4   2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  hd1  )  4.3 2.5 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  hg1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  hg2  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  hb1  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  14  and name  hb2  )  4   2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  15  and name  hb#  )  4.5 2.7 1.75  
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  42  and name  ha   )  5 3.2 0.75  
 assign ( segid "   1" and  resid  17  and name  hb2  )(segid "   1" and  resid  42  and name  hg2  )  4.9 3.1 0.75 
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  42  and name  hb2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  42  and name  hg1  )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  42  and name  hg2  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  42  and name  hd2  )  5 3.2 0.75 
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  42  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  29  and name  ha   )  4   2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  29  and name  ha   )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  29  and name  hb1  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  29  and name  hb2  )  4   2.2 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  29  and name  hd#  )  5.5 3.7 1.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  29  and name  hb1  )  4 2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  29  and name  hb2  )  4   2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  29  and name  hn   )  6 4.2 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  29  and name  hb1  )  5   3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  29  and name  hb2  )  5.2 3.4 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  32  and name  hn   )  5   3.2 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  30  and name  hn   )  4   2.2 0.75 
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  30  and name  hn   )  6 4.2 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  30  and name  ha   )  5 3.2 0.75 
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  31  and name  ha   )  4.3 2.5 0.75 
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  31  and name  hd21 )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  31  and name  hd22 )  4.3 2.5 0.75 
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  31  and name  hb1  )  5 3.2 0.75 
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  31  and name  hb2  )  4.8 3 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  31  and name  hd22 )  5.1 3.3 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  31  and name  hb2  )  4.7 2.9 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  31  and name  hb2  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  31  and name  hb1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  31  and name  hb1  )  4.6 2.8 0.75
 assign ( segid "   1" and  resid  17  and name  he1  )(segid "   1" and  resid  31  and name  hd21 )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  he1  )(segid "   1" and  resid  31  and name  hd22 )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  38  and name  hg2# )  4 2.2 1.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  38  and name  hb   )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  38  and name  hb   )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  38  and name  hg2# )  3 1.2 1.4 
 assign ( segid "   1" and  resid  17  and name  hb1  )(segid "   1" and  resid  13  and name  hb2  )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hb1  )(segid "   1" and  resid  13  and name  hd1# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  17  and name  hb1  )(segid "   1" and  resid  13  and name  hd2# )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  17  and name  hb2  )(segid "   1" and  resid  13  and name  hb2  )  5 3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hb2  )(segid "   1" and  resid  13  and name  hd2# )  5 3.2 1.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  13  and name  hd1# )  4.8 3 1.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  33  and name  hg2# )  5 3.2 1.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  33  and name  hg12 )  5   3.2 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  33  and name  hb   )  5   3.2 0.75
 assign ( segid "   1" and  resid  17  and name  he3  )(segid "   1" and  resid  33  and name  hg12 )  4.8 3 0.75
 assign ( segid "   1" and  resid  17  and name  hz3  )(segid "   1" and  resid  37  and name  ha   )  5   3.2 0.75 
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  37  and name  ha   )  6 4.2 0.75
 assign ( segid "   1" and  resid  17  and name  hz2  )(segid "   1" and  resid  38  and name  hg2# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  17  and name  hh2  )(segid "   1" and  resid  38  and name  hg2# )  3.2 1.4 1.5
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  17  and name  he3  )  4 2.2 0.75
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  17  and name  hd1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  17  and name  hd1  )(segid "   1" and  resid  17  and name  hn   )  4 2.2 0.75
 assign ( segid "   1" and  resid  17  and name  hn   )(segid "   1" and  resid  17  and name  he3  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  18  and name  hb1  )(segid "   1" and  resid  20  and name  hb#  )  4 2.2 1.75
 assign ( segid "   1" and  resid  18  and name  hg2  )(segid "   1" and  resid  20  and name  hb#  )  4 2.2 1.75
 assign ( segid "   1" and  resid  18  and name  hb1  )(segid "   1" and  resid  30  and name  hb2  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  18  and name  hg2  )(segid "   1" and  resid  30  and name  hg2  )  5.5 3.7 0.75 
 assign ( segid "   1" and  resid  18  and name  hg2  )(segid "   1" and  resid  30  and name  hd1  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  18  and name  ha   )(segid "   1" and  resid  32  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  18  and name  hb2  )(segid "   1" and  resid  32  and name  hd2  )  4.3 2.5 0.75
 assign ( segid "   1" and  resid  18  and name  hg1  )(segid "   1" and  resid  32  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  18  and name  hg2  )(segid "   1" and  resid  32  and name  hd2  )  6 4.2 0.75
 assign ( segid "   1" and  resid  18  and name  hb1  )(segid "   1" and  resid  32  and name  hd2  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  20  and name  hb#  )  6   4.2 1.75
 assign ( segid "   1" and  resid  19  and name  hb1  )(segid "   1" and  resid  30  and name  hb2  )  5.1 3.3 0.75 
 assign ( segid "   1" and  resid  19  and name  hb1  )(segid "   1" and  resid  30  and name  hg1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  19  and name  hb1  )(segid "   1" and  resid  30  and name  hg2  )  5 3.2 0.75
 assign ( segid "   1" and  resid  19  and name  hb2  )(segid "   1" and  resid  30  and name  hb2  )  4.5 2.7 0.75  
 assign ( segid "   1" and  resid  19  and name  hb2  )(segid "   1" and  resid  30  and name  hg1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  19  and name  hb2  )(segid "   1" and  resid  30  and name  hg2  )  5   3.2 0.75 
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  19  and name  he#  )  5 3.2 1.75
 assign ( segid "   1" and  resid  20  and name  hb#  )(segid "   1" and  resid  28  and name  hd#  )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  20  and name  hb#  )(segid "   1" and  resid  28  and name  he#  )  3.5 1.7 2.5
 assign ( segid "   1" and  resid  21  and name  hd#  )(segid "   1" and  resid  25  and name  ha1  )  4 2.2 1.75 
 assign ( segid "   1" and  resid  21  and name  hd#  )(segid "   1" and  resid  25  and name  ha2  )  4 2.2 1.75
 assign ( segid "   1" and  resid  22  and name  ha   )(segid "   1" and  resid  28  and name  he#  )  3.3 1.5 1.5
 assign ( segid "   1" and  resid  22  and name  ha   )(segid "   1" and  resid  28  and name  hd#  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  22  and name  hb   )(segid "   1" and  resid  28  and name  hd#  )  5.5 3.7 1.75 
 assign ( segid "   1" and  resid  22  and name  hb   )(segid "   1" and  resid  28  and name  he#  )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  22  and name  hg2# )(segid "   1" and  resid  28  and name  hd#  )  3.5 1.7 2.5
 assign ( segid "   1" and  resid  22  and name  hg2# )(segid "   1" and  resid  28  and name  he#  )  3.5 1.7 2.5  
 assign ( segid "   1" and  resid  22  and name  hg2# )(segid "   1" and  resid  26  and name  hg2  )  5 3.2 1.75
 assign ( segid "   1" and  resid  22  and name  hg2# )(segid "   1" and  resid  26  and name  hb1  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  25  and name  ha1  )(segid "   1" and  resid  27  and name  hg#  )  4.5 2.7 1.75  
 assign ( segid "   1" and  resid  25  and name  ha2  )(segid "   1" and  resid  27  and name  hg#  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  26  and name  hb1  )(segid "   1" and  resid  28  and name  hd#  )  4 2.2 1.75
 assign ( segid "   1" and  resid  26  and name  hb1  )(segid "   1" and  resid  28  and name  he#  )  6 4.2 1.75
 assign ( segid "   1" and  resid  26  and name  hb2  )(segid "   1" and  resid  28  and name  hd#  )  4 2.2 1.75  
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  21  and name  ha   )  4   2.2 1.75  
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  21  and name  ha   )  3.5 1.7 1.5
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  37  and name  hb   )  2.5 0.7 1.3
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  37  and name  hb   )  2.5 0.7 1.3
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  ha   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hb1  )  5.5 3.7 1.75 
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hb2  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hg1  )  4 2.2 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hg2  )  3 1.2 1.4
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hd1  )  4.5 2.7 1.75 
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  hd2  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  he1  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  30  and name  he2  )  5 3.2 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  37  and name  hg2# )  4 2.2 2.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  37  and name  hg2# )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  37  and name  ha   )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  37  and name  ha   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  30  and name  ha   )  4.7 2.9 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  30  and name  hg1  )  4 2.2 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  30  and name  hg2  )  4.7 2.9 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  30  and name  hb2  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  30  and name  hd2  )  5 3.2 1.75
 assign ( segid "   1" and  resid  28  and name  ha   )(segid "   1" and  resid  28  and name  hd#  )  4 2.2 1.75
 assign ( segid "   1" and  resid  28  and name  ha   )(segid "   1" and  resid  28  and name  he#  )  6   4.2 1.75
 assign ( segid "   1" and  resid  28  and name  hn   )(segid "   1" and  resid  28  and name  he#  )  5.5 3.7 1.75 
 assign ( segid "   1" and  resid  28  and name  hn   )(segid "   1" and  resid  28  and name  hd#  )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  28  and name  hb1  )(segid "   1" and  resid  28  and name  hd#  )  3.5 1.7 1.5
 assign ( segid "   1" and  resid  28  and name  hb2  )(segid "   1" and  resid  28  and name  hd#  )  3 1.2 1.4
 assign ( segid "   1" and  resid  28  and name  hb1  )(segid "   1" and  resid  28  and name  he#  )  4.8 3 1.75 
 assign ( segid "   1" and  resid  28  and name  hb2  )(segid "   1" and  resid  28  and name  he#  )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  28  and name  hd#  )(segid "   1" and  resid  18  and name  hb1  )  6   4.2 1.75 
 assign ( segid "   1" and  resid  28  and name  he#  )(segid "   1" and  resid  18  and name  hb1  )  6   4.2 1.75 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  7   and name  hg2# )  3.5 1.7 2.5 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  7   and name  hd1# )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  20  and name  hb#  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  42  and name  hg2  )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  42  and name  hd2  )  4 2.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  13  and name  hd2# )  4 2.2 2.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  13  and name  hd1# )  4 2.2 2.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  14  and name  hd1  )  4.9 3.1 1.75 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  14  and name  hd2  )  4.8 3 1.75
 assign ( segid "   1" and  resid  29  and name  hb2  )(segid "   1" and  resid  19  and name  he#  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  ha   )  3.5 1.7 1.5 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  he#  )  4.2 2.4 2.75 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  hb1  )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  hb2  )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  hg1  )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  19  and name  hg2  )  5 3.2 1.75
  assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  27  and name  hb2  )  6 4.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  27  and name  hg1  )  4 2.2 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  27  and name  hd1  )  5 3.2 1.75 
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  27  and name  hd2  )  5 3.2 1.75  
 assign ( segid "   1" and  resid  29  and name  hb1  )(segid "   1" and  resid  38  and name  hg2# )  4.5 2.7 1.75   
 assign ( segid "   1" and  resid  29  and name  hb2  )(segid "   1" and  resid  38  and name  hg2# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  38  and name  hg2# )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  38  and name  hg2# )  4 2.2 2.75
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  41  and name  hb2  )  4.8 3 1.75  
 assign ( segid "   1" and  resid  29  and name  hd#  )(segid "   1" and  resid  42  and name  hd1  )  4.5 2.7 1.75 
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  29  and name  hd#  )  3   1.2 1.4
 assign ( segid "   1" and  resid  29  and name  hn   )(segid "   1" and  resid  29  and name  hd#  )  3   1.2 1.4
 assign ( segid "   1" and  resid  30  and name  ha   )(segid "   1" and  resid  37  and name  hg2# )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  30  and name  hb1  )(segid "   1" and  resid  37  and name  ha   )  4.5 2.7 0.75 
 assign ( segid "   1" and  resid  30  and name  hg1  )(segid "   1" and  resid  37  and name  ha   )  5 3.2 0.75
 assign ( segid "   1" and  resid  30  and name  hg2  )(segid "   1" and  resid  37  and name  ha   )  5 3.2 0.75
 assign ( segid "   1" and  resid  30  and name  hg1  )(segid "   1" and  resid  37  and name  hb   )  5 3.2 0.75
 assign ( segid "   1" and  resid  30  and name  hg2  )(segid "   1" and  resid  37  and name  hb   )  5 3.2 0.75
 assign ( segid "   1" and  resid  30  and name  ha   )(segid "   1" and  resid  37  and name  hb   )  5   3.2 0.75
 assign ( segid "   1" and  resid  30  and name  he1  )(segid "   1" and  resid  32  and name  he1  )  4.8 3 0.75
 assign ( segid "   1" and  resid  30  and name  hb2  )(segid "   1" and  resid  32  and name  hd2  )  5 3.2 0.75
 assign ( segid "   1" and  resid  30  and name  hb2  )(segid "   1" and  resid  32  and name  he1  )  6 4.2 0.75
 assign ( segid "   1" and  resid  30  and name  hg2  )(segid "   1" and  resid  32  and name  he1  )  5.3 3.5 0.75  
 assign ( segid "   1" and  resid  30  and name  hd2  )(segid "   1" and  resid  32  and name  he1  )  5   3.2 0.75
 assign ( segid "   1" and  resid  30  and name  hd1  )(segid "   1" and  resid  32  and name  he1  )  4 2.2 0.75
 assign ( segid "   1" and  resid  30  and name  hd1  )(segid "   1" and  resid  32  and name  hd2  )  5.3 3.5 0.75
 assign ( segid "   1" and  resid  30  and name  he2  )(segid "   1" and  resid  32  and name  he1  )  5 3.2 0.75 
 assign ( segid "   1" and  resid  31  and name  hb1  )(segid "   1" and  resid  31  and name  hd21 )  5 3.2 0.75
 assign ( segid "   1" and  resid  31  and name  hb1  )(segid "   1" and  resid  31  and name  hd22 )  5 3.2 0.75
 assign ( segid "   1" and  resid  31  and name  hb2  )(segid "   1" and  resid  31  and name  hd21 )  4.7 2.9 0.75
 assign ( segid "   1" and  resid  31  and name  hb2  )(segid "   1" and  resid  31  and name  hd22 )  4.7 2.9 0.75
 assign ( segid "   1" and  resid  32  and name  ha   )(segid "   1" and  resid  35  and name  hb#  )  5 3.2 1.75
 assign ( segid "   1" and  resid  32  and name  ha   )(segid "   1" and  resid  35  and name  hg#  )   5 3.2 1.75
 assign ( segid "   1" and  resid  32  and name  hd2  )(segid "   1" and  resid  32  and name  ha   )  4   2.2 0.75
 assign ( segid "   1" and  resid  33  and name  hd1# )(segid "   1" and  resid  34  and name  hb#  )  5 3.2 2.75
 assign ( segid "   1" and  resid  33  and name  hd1# )(segid "   1" and  resid  34  and name  ha   )  5   3.2 1.75   
 assign ( segid "   1" and  resid  39  and name  ha   )(segid "   1" and  resid  39  and name  hd1  )  4.8 3 0.75
 assign ( segid "   1" and  resid  39  and name  ha   )(segid "   1" and  resid  39  and name  he3  )  3.2 1.4 0.5
 assign ( segid "   1" and  resid  39  and name  hb1  )(segid "   1" and  resid  39  and name  he3  )  4.2 2.4 0.75
 assign ( segid "   1" and  resid  39  and name  hb1  )(segid "   1" and  resid  39  and name  hd1  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  39  and name  hb2  )(segid "   1" and  resid  39  and name  hd1  )  4 2.2 0.75
 assign ( segid "   1" and  resid  39  and name  hb2  )(segid "   1" and  resid  39  and name  he3  )  4 2.2 0.75
 assign ( segid "   1" and  resid  39  and name  hn   )(segid "   1" and  resid  39  and name  he3  )  5 3.2 0.75
 assign ( segid "   1" and  resid  39  and name  hn   )(segid "   1" and  resid  39  and name  hd1  )  4.5 2.7 0.75
 assign ( segid "   1" and  resid  39  and name  hn   )(segid "   1" and  resid  39  and name  ha   )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  39  and name  he1  )(segid "   1" and  resid  39  and name  hd1  )  3 1.2 0.4
 assign ( segid "   1" and  resid  39  and name  he1  )(segid "   1" and  resid  39  and name  hh2  )  5.5 3.7 0.75
 assign ( segid "   1" and  resid  39  and name  he1  )(segid "   1" and  resid  39  and name  hz2  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  44  and name  ha   )(segid "   1" and  resid  7   and name  hd1# )  5   3.2 1.75
 assign ( segid "   1" and  resid  44  and name  ha   )(segid "   1" and  resid  7   and name  hg2# )  5   3.2 1.75  
 assign ( segid "   1" and  resid  43  and name  hd1  )(segid "   1" and  resid  11  and name  hg## )  4.5 2.7 2.75 
 assign ( segid "   1" and  resid  43  and name  hd2  )(segid "   1" and  resid  11  and name  hg## )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  43  and name  hg1  )(segid "   1" and  resid  11  and name  hg## )  5   3.2 2.75 
 assign ( segid "   1" and  resid  43  and name  hg2  )(segid "   1" and  resid  11  and name  hg## )  5   3.2 2.75  
 assign ( segid "   1" and  resid  43  and name  hd1  )(segid "   1" and  resid  13  and name  hd1# )  4.8 3 1.75
 assign ( segid "   1" and  resid  43  and name  hd1  )(segid "   1" and  resid  13  and name  hd2# )  5 3.2 1.75
 assign ( segid "   1" and  resid  43  and name  hd2  )(segid "   1" and  resid  13  and name  hd2# )  5 3.2 1.75
 assign ( segid "   1" and  resid  43  and name  hd2  )(segid "   1" and  resid  13  and name  hd1# )  5 3.2 1.75
 assign ( segid "   1" and  resid  43  and name  hg#  )(segid "   1" and  resid  14  and name  hd1  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  17  and name  hb1  )  3    1.2 0.4
 assign ( segid "   1" and  resid  17  and name  ha   )(segid "   1" and  resid  17  and name  hb2  )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  39  and name  ha   )(segid "   1" and  resid  39  and name  hb1  )  3   1.2 0.4   
 assign ( segid "   1" and  resid  39  and name  ha   )(segid "   1" and  resid  39  and name  hb2  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  29  and name  hb1  )  2.8 1 0.4
 assign ( segid "   1" and  resid  29  and name  ha   )(segid "   1" and  resid  29  and name  hb2  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  31  and name  ha   )(segid "   1" and  resid  31  and name  hb1  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  31  and name  ha   )(segid "   1" and  resid  31  and name  hb2  )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  26  and name  ha   )(segid "   1" and  resid  26  and name  hb1  )  3   1.2 0.4   
 assign ( segid "   1" and  resid  26  and name  ha   )(segid "   1" and  resid  26  and name  hb2  )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  19  and name  hb1  )  3   1.2 0.4   
 assign ( segid "   1" and  resid  19  and name  ha   )(segid "   1" and  resid  19  and name  hb2  )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  9  and name   hn   )(segid "   1" and  resid  9   and name  hb1  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  9  and name   hn   )(segid "   1" and  resid  9   and name  hb2  )  2.8 1 0.4 
 assign ( segid "   1" and  resid  10  and name  hn   )(segid "   1" and  resid  10  and name  hb1  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  10  and name  hn   )(segid "   1" and  resid  10  and name  hb2  )  3 1.2 0.4
 assign ( segid "   1" and  resid  11  and name  hn   )(segid "   1" and  resid  11  and name  hb   )  3   1.2 0.4   
 assign ( segid "   1" and  resid  11  and name  hn   )(segid "   1" and  resid  11  and name  hg## )  3   1.2 2.4    
 assign ( segid "   1" and  resid  17  and name  hn   )(segid "   1" and  resid  17  and name  hb2  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  17  and name  he1  )(segid "   1" and  resid  17  and name  hd1  )  2.5 0.7 0.3
 assign ( segid "   1" and  resid  17  and name  he1  )(segid "   1" and  resid  17  and name  hh2  )  5  3.2 0.75 
 assign ( segid "   1" and  resid  17  and name  he1  )(segid "   1" and  resid  17  and name  hz2  )  2.8 1 0.4 
 assign ( segid "   1" and  resid  19  and name  hn   )(segid "   1" and  resid  19  and name  hb1  )  3.5 1.7 0.5 
 assign ( segid "   1" and  resid  19  and name  hn   )(segid "   1" and  resid  19  and name  hb2  )  4.3 2.5 0.75
 assign ( segid "   1" and  resid  26  and name  hn   )(segid "   1" and  resid  26  and name  hb1  )  3.5 1.7 0.5
 assign ( segid "   1" and  resid  26  and name  hn   )(segid "   1" and  resid  26  and name  hb2  )  3.2 1.4 0.5 
 assign ( segid "   1" and  resid  46  and name  hn   )(segid "   1" and  resid  46  and name  hb1  )  3.7 1.9 0.75 
 assign ( segid "   1" and  resid  46  and name  hn   )(segid "   1" and  resid  46  and name  hb2  )  3   1.2 0.4   
 assign ( segid "   1" and  resid  47  and name  hn   )(segid "   1" and  resid  47  and name  hb1  )  2.5 0.7 0.3 
 assign ( segid "   1" and  resid  47  and name  hn   )(segid "   1" and  resid  47  and name  hb1  )  3.5 1.7 0.5
assign ( segid "   1" and resid 5 and name he# or segid "   1" 
and  resid  5 and name    hz  )
(segid "   1" and  resid  7  and name  ha   )  5.5 3.7 1.75
assign ( segid "   1" and  resid  17  and 
name  hb1 or segid "   1" and  resid  14  and name hd1  )
(segid "   1" and  resid  42  and name  hb1 )  5 3.2 0.75
assign ( segid "   1" and  resid  17  and 
name  hb1 or segid "   1" and  resid  14  and name hd1  )
(segid "   1" and  resid  42  and name  hg1 )  4 2.2 0.75
assign ( segid "   1" and  resid  17  and 
name  hb1 or segid "   1" and  resid  14  and name hd1  )
(segid "   1" and  resid  42  and name  hg2 )  4.7 2.9 0.75
 assign ( segid "   1" and  resid  27  and name  hd1  )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name  hz )  4 2.2 1.75
 assign ( segid "   1" and  resid  27  and name  hd2  )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name  hz )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  13  and name  ha   )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  7  and name   hg2# )  3.5 1.7 2.5
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  7  and name   hd1# )  4.5 2.7 2.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  13  and name  hd1# )  3.8 2 2.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  13  and name  hd2# )  3.8 2 2.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  ha   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  hb1  )  4   2.2 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  hb2  )  4   2.2 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  he#  )  3.8 2 2.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  hg1  )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  19  and name  hg2  )  4   2.2 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  27  and name  hb1  )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  27  and name  hb2  )  4 2.2 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  27  and name  hg2  )  4.3 2.5 1.75 
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  28  and name  ha   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  38  and name  hg2# )  4.6 2.8 2.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  41  and name  hn   )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  41  and name  ha or segid "   1" and  resid  41  and name hb1  )  3.7 1.9 1.75
 assign ( segid "   1" and  resid  29  and name  hd#  )
 (segid "   1" and  resid  41  and name  ha or segid "   1" and  resid  41  and name hb1  )  3.7 1.9 1.75 
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  41  and name  hb2  )  3 1.2 1.4
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  42  and name  hd1  )  4.8 3 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  42  and name  hd2  )  4.5 2.7 1.75
 assign ( segid "   1" and  resid  29  and name  ha  )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz   )  4.3 2.5 1.75
 assign ( segid "   1" and  resid  29  and name  hn  )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz   )  4.8 3 1.75
 assign ( segid "   1" and  resid  29  and name  hb1 )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz   )  5 3.2 1.75
 assign ( segid "   1" and  resid  29  and name  hb2 )
 (segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz   )  4.6 2.8 1.75
 assign ( segid "   1" and  resid  29  and name  he# or segid "   1" and  resid  29  and name hz  )
 (segid "   1" and  resid  39  and name  ha   )  5.3 3.5 1.75
  assign ( segid "   2" and resid  1  and name  ha#  )(segid "   2" and resid  2  and name  hn   )  3 1.2 1.4
 assign ( segid "   2" and resid  2  and name  ha   )(segid "   2" and resid  3  and name  hd1  )  2.2 0.4 0.3
 assign ( segid "   2" and resid  2  and name  ha   )(segid "   2" and resid  3  and name  hd2  )  3 1.2 0.4  
 assign ( segid "   2" and resid  2  and name  hg2# )(segid "   2" and resid  3  and name  hd1  )  4 2.2 1.75
 assign ( segid "   2" and resid  2  and name  hg2# )(segid "   2" and resid  3  and name  hd2  )  4.5 2.7 1.75
 assign ( segid "   2" and resid  3  and name  ha   )(segid "   2" and resid  4  and name  hd1  )  2.5 0.7 0.3
 assign ( segid "   2" and resid  3  and name  ha   )(segid "   2" and resid  4  and name  hd2  )  3 1.2 0.4
 assign ( segid "   2" and resid  4  and name  ha   )(segid "   2" and resid  5  and name  hd1  )  2.5 0.7 0.3
 assign ( segid "   2" and resid  4  and name  ha   )(segid "   2" and resid  5  and name  hd2  )  3 1.2 0.4
 assign ( segid "   2" and resid  5  and name  ha   )(segid "   2" and resid  6  and name  hd1  )  2.5 0.7 0.3
 assign ( segid "   2" and resid  5  and name  ha   )(segid "   2" and resid  6  and name  hd2  )  3 1.2 0.4
 assign ( segid "   2" and resid  7  and name  ha   )(segid "   2" and resid  8  and name  hn   )  3   1.2 0.4   
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  8  and name  ha   )  5 3.2 1.75 
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  8  and name  ha   )  3.8 2 1.75
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  8  and name  hg2# )  4.5 2.7 2.75 
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  8  and name  hg2# )  4.8 3 2.75
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  9  and name  ha   )  5.3 3.5 1.75 
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  9  and name  ha   )  4.3 2.5 1.75
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  9  and name  hb   )  5 3.2 1.75
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  9  and name  hb   )  4.5 2.7 1.75 
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  9  and name  hg## )  4.3 2.5 3.75   
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  9  and name  hg## )  4.7 2.9 3.75
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  7  and name  ha   )  3.7 1.9 1.75
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  7  and name  hb1  )  3.2 1.4 1.5 
 assign ( segid "   2" and resid  7  and name  hd#  )(segid "   2" and resid  7  and name  hb2  )  3.2 1.4 1.5  
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  7  and name  hb1  )  4.8 3 1.75
 assign ( segid "   2" and resid  7  and name  he#  )(segid "   2" and resid  7  and name  hb2  )  4.8 3 1.75 
 assign ( segid "   2" and resid  8  and name  ha   )(segid "   2" and resid  9  and name  hn   )  3 1.2 0.4
 assign ( segid "   2" and resid  8  and name  hb   )(segid "   2" and resid  9  and name  hn   )  3 1.2 0.4
 assign ( segid "   2" and resid  8  and name  hg2# )(segid "   2" and resid  9  and name  hn   )  3.5 1.7 1.5  
 assign ( segid "   2" and resid  8  and name  hg2# )(segid "   2" and resid  9  and name  ha   )  4.5 2.7 1.75 
 assign ( segid "   2" and resid  9  and name  ha   )(segid "   2" and resid  10 and name  hn   )  3 1.2 0.4
 assign ( segid "   2" and resid  9  and name  hg## )(segid "   2" and resid  10 and name  hn   )  3.5 1.7 2.5
 assign ( segid "   1" and resid  22 and name  hg2# )(segid "   2" and resid  5  and name  hd2  )  4 2.2 1.75
 assign ( segid "   1" and resid  22 and name  hg2# )(segid "   2" and resid  5  and name  hd1  )  3 1.2 1.4
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hd1  )  4.5 2.7 1.75  
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hd2  )  4 2.2 1.75
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hg1  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hb2  )  3.5 1.7 0.4
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hb1  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  28 and name  he#  )(segid "   2" and resid  5  and name  hg2  )  3.0 1.3 0.5
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hd1  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hd2  )  3.7 1.9 1.75
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hg1  )  4.3 2.5 1.75
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hb2  )  5.5 3.7 0.75
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hb1  )  5.5 3.7 0.75
 assign ( segid "   1" and resid  28 and name  hd#  )(segid "   2" and resid  5  and name  hg2  )  5 3.2 1.75
 assign ( segid "   1" and resid  39 and name  hd1  )(segid "   2" and resid  4  and name  hd1  )  3.5 1.7 0.4
 assign ( segid "   1" and resid  39 and name  hd1  )(segid "   2" and resid  4  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and resid  39 and name  hz2  )(segid "   2" and resid  4  and name  hd1  )  5 3.2 1.75 
 assign ( segid "   1" and resid  39 and name  hz2  )(segid "   2" and resid  4  and name  hd2  )  5.5 3.7 0.75
 assign ( segid "   1" and resid  39 and name  hh2  )(segid "   2" and resid  4  and name  ha   )  3.1 1.3 0.5
 assign ( segid "   1" and resid  39 and name  hz2  )(segid "   2" and resid  4  and name  ha   )  2.5 0.7 0.3
 assign ( segid "   1" and resid  39 and name  he1  )(segid "   2" and resid  4  and name  ha   )  4 2.2 0.75
 assign ( segid "   1" and resid  39 and name  hd1  )(segid "   2" and resid  4  and name  hb#  )  4.3 2.5 1.75
 assign ( segid "   1" and resid  39 and name  hz2  )(segid "   2" and resid  4  and name  hb#  )  4 2.2 1.75
 assign ( segid "   1" and resid  39 and name  hd1  )(segid "   2" and resid  4  and name  hg#  )  5.1 3.3 1.75
 assign ( segid "   1" and resid  30 and name  ha   )(segid "   2" and resid  7  and name  hd#  )  4 2.2 1.75 
 assign ( segid "   1" and resid  30 and name  hg2  )(segid "   2" and resid  7  and name  hd#  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  30 and name  hd1  )(segid "   2" and resid  7  and name  hd#  )  5.2 3.4 1.75
 assign ( segid "   1" and resid  30 and name  hd2  )(segid "   2" and resid  7  and name  hd#  )  4 2.2 1.75
 assign ( segid "   1" and resid  30 and name  hg2  )(segid "   2" and resid  7  and name  he#  )  4.3 2.5 1.75
 assign ( segid "   1" and resid  30 and name  hd1  )(segid "   2" and resid  7  and name  he#  )  4.2 2.4 1.75 
 assign ( segid "   1" and resid  30 and name  hd2  )(segid "   2" and resid  7  and name  he#  )  3.5 1.7 1.5
 assign ( segid "   1" and resid  30 and name  hb2  )(segid "   2" and resid  7  and name  he#  )  4.5 2.7 1.75 
 assign ( segid "   1" and resid  35 and name  hb#  )(segid "   2" and resid  7  and name  hd#  )  4.5 2.7 2.75
 assign ( segid "   1" and resid  35 and name  hg1  )(segid "   2" and resid  7  and name  hd#  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  35 and name  hb#  )(segid "   2" and resid  7  and name  he#  )  4.5 2.7 2.75
 assign ( segid "   1" and resid  35 and name  hg1  )(segid "   2" and resid  7  and name  he#  )  4 2.2 2.7
 assign ( segid "   1" and resid  35 and name  hg2  )(segid "   2" and resid  7  and name  he#  )  4 2.2 1.75
 assign ( segid "   1" and resid  36 and name  ha   )(segid "   2" and resid  7  and name  hb1  )  3.5 1.7 0.5
 assign ( segid "   1" and resid  36 and name  ha   )(segid "   2" and resid  7  and name  hb2  )  3.5 1.7 0.5
 assign ( segid "   1" and resid  36 and name  ha   )(segid "   2" and resid  7  and name  hd#  )  4.5 2.7 1.75
 assign ( segid "   1" and resid  37 and name  ha   )(segid "   2" and resid  7  and name  hd#  )  5 3.2 1.75
 assign ( segid "   1" and resid  37 and name  hg2# )(segid "   2" and resid  7  and name  ha   )  3 1.2 1.4
 assign ( segid "   1" and resid  37 and name  hg2# )(segid "   2" and resid  7  and name  hb1  )  3.3 1.5 1.5
 assign ( segid "   1" and resid  37 and name  hg2# )(segid "   2" and resid  7  and name  hb2  )  3.3 1.5 1.5
 assign ( segid "   1" and resid  37 and name  hg2# )(segid "   2" and resid  7  and name  he#  )  4.5 2.7 2.75
 assign ( segid "   1" and resid  37 and name  hg2# )(segid "   2" and resid  7  and name  hd#  )  3.2 1.4 2.5
 assign ( segid "   1" and resid  32 and name  ha   )(segid "   2" and resid  7  and name  he#  )  2.2 0.4 1.3
 assign ( segid "   1" and resid  32 and name  he#  )(segid "   2" and resid  9  and name  ha   )  2.2 0.4 1.3
 assign ( segid "   1" and resid  32 and name  he#  )(segid "   2" and resid  9  and name  hg## )  4 2.2 3.75
 assign ( segid "   1" and resid  32 and name  he#  )(segid "   2" and resid  9  and name  hb   )  5.2 3.4 1.75 

  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    PHE   5           H        PHE   5  -5.693  10.404   4.990
    2    HA   PHE   5           HA       PHE   5  -4.545   9.250   3.275
    3   1HB   PHE   5          1HB       PHE   5  -6.298  10.962   2.204
    4   2HB   PHE   5          2HB       PHE   5  -4.822  11.693   1.572
    5    HD1  PHE   5           HD1      PHE   5  -6.519   8.369   1.917
    6    HD2  PHE   5           HD2      PHE   5  -3.835  10.826  -0.367
    7    HE1  PHE   5           HE1      PHE   5  -6.391   6.609   0.175
    8    HE2  PHE   5           HE2      PHE   5  -3.707   9.065  -2.109
    9    HZ   PHE   5           HZ       PHE   5  -4.985   6.957  -1.838
   10    H    GLU   6           H        GLU   6  -2.433   9.290   4.270
   11    HA   GLU   6           HA       GLU   6  -0.643  11.563   3.549
   12   1HB   GLU   6          1HB       GLU   6   0.813  10.527   5.263
   13   2HB   GLU   6          2HB       GLU   6  -0.813  10.791   5.896
   14   1HG   GLU   6          1HG       GLU   6  -0.635   8.211   4.586
   15   2HG   GLU   6          2HG       GLU   6   0.596   8.358   5.842
   16    H    ILE   7           H        ILE   7  -1.576   9.338   1.667
   17    HA   ILE   7           HA       ILE   7   1.078   8.087   1.057
   18    HB   ILE   7           HB       ILE   7  -1.692   7.377   0.034
   19   1HG1  ILE   7          1HG1      ILE   7  -1.616   7.191   2.498
   20   2HG1  ILE   7          2HG1      ILE   7  -1.680   5.595   1.752
   21   1HG2  ILE   7          1HG2      ILE   7  -0.709   5.352  -0.714
   22   2HG2  ILE   7          2HG2      ILE   7   0.740   5.598   0.261
   23   3HG2  ILE   7          3HG2      ILE   7   0.457   6.596  -1.166
   24   1HD1  ILE   7          1HD1      ILE   7   0.665   6.982   3.040
   25   2HD1  ILE   7          2HD1      ILE   7   0.921   5.689   1.868
   26   3HD1  ILE   7          3HD1      ILE   7   0.030   5.368   3.355
   27    HA   PRO   8           HA       PRO   8   0.354  11.348  -2.169
   28   1HB   PRO   8          1HB       PRO   8   2.939  12.251  -2.221
   29   2HB   PRO   8          2HB       PRO   8   1.716  12.877  -1.099
   30   1HG   PRO   8          1HG       PRO   8   3.882  10.879  -0.634
   31   2HG   PRO   8          2HG       PRO   8   3.300  12.176   0.422
   32   1HD   PRO   8          1HD       PRO   8   2.607   9.567   0.750
   33   2HD   PRO   8          2HD       PRO   8   1.564  10.923   1.231
   34    H    ASP   9           H        ASP   9   2.151  11.684  -4.140
   35    HA   ASP   9           HA       ASP   9   2.514   8.934  -5.213
   36   1HB   ASP   9          1HB       ASP   9   2.039  11.674  -6.222
   37   2HB   ASP   9          2HB       ASP   9   3.109  10.692  -7.223
   38    H    ASP  10           H        ASP  10   4.385  10.540  -3.255
   39    HA   ASP  10           HA       ASP  10   6.810  11.236  -4.512
   40   1HB   ASP  10          1HB       ASP  10   5.789  10.863  -1.935
   41   2HB   ASP  10          2HB       ASP  10   7.147   9.741  -2.025
   42    H    VAL  11           H        VAL  11   5.401   8.082  -3.937
   43    HA   VAL  11           HA       VAL  11   7.571   6.830  -5.528
   44    HB   VAL  11           HB       VAL  11   6.771   6.054  -2.704
   45   1HG1  VAL  11          1HG1      VAL  11   7.189   4.125  -4.306
   46   2HG1  VAL  11          2HG1      VAL  11   8.265   4.182  -2.910
   47   3HG1  VAL  11          3HG1      VAL  11   8.834   4.734  -4.485
   48   1HG2  VAL  11          1HG2      VAL  11   9.314   7.145  -3.937
   49   2HG2  VAL  11          2HG2      VAL  11   9.244   6.449  -2.317
   50   3HG2  VAL  11          3HG2      VAL  11   8.317   7.902  -2.694
   51    HA   PRO  12           HA       PRO  12   3.998   4.702  -7.013
   52   1HB   PRO  12          1HB       PRO  12   5.225   2.630  -8.311
   53   2HB   PRO  12          2HB       PRO  12   5.173   4.283  -8.950
   54   1HG   PRO  12          1HG       PRO  12   7.374   2.863  -7.528
   55   2HG   PRO  12          2HG       PRO  12   7.455   3.982  -8.895
   56   1HD   PRO  12          1HD       PRO  12   8.023   4.692  -6.318
   57   2HD   PRO  12          2HD       PRO  12   7.424   5.831  -7.541
   58    H    LEU  13           H        LEU  13   5.958   1.816  -6.703
   59    HA   LEU  13           HA       LEU  13   4.673   1.071  -4.129
   60   1HB   LEU  13          1HB       LEU  13   4.145  -0.054  -6.864
   61   2HB   LEU  13          2HB       LEU  13   4.089  -1.146  -5.481
   62    HG   LEU  13           HG       LEU  13   2.543   1.456  -5.648
   63   1HD1  LEU  13          1HD1      LEU  13   0.960  -0.972  -5.651
   64   2HD1  LEU  13          2HD1      LEU  13   2.051  -0.936  -7.036
   65   3HD1  LEU  13          3HD1      LEU  13   0.913   0.386  -6.775
   66   1HD2  LEU  13          1HD2      LEU  13   1.840   1.008  -3.536
   67   2HD2  LEU  13          2HD2      LEU  13   3.251  -0.046  -3.452
   68   3HD2  LEU  13          3HD2      LEU  13   1.676  -0.715  -3.868
   69    HA   PRO  14           HA       PRO  14   8.636  -0.887  -3.861
   70   1HB   PRO  14          1HB       PRO  14   8.227  -2.409  -1.627
   71   2HB   PRO  14          2HB       PRO  14   8.491  -0.657  -1.581
   72   1HG   PRO  14          1HG       PRO  14   6.000  -2.205  -1.254
   73   2HG   PRO  14          2HG       PRO  14   6.458  -0.647  -0.565
   74   1HD   PRO  14          1HD       PRO  14   4.743  -1.048  -2.733
   75   2HD   PRO  14          2HD       PRO  14   5.486   0.489  -2.268
   76    H    ALA  15           H        ALA  15   9.516  -3.258  -3.558
   77    HA   ALA  15           HA       ALA  15   8.578  -4.891  -5.667
   78   1HB   ALA  15          1HB       ALA  15  10.001  -6.627  -4.425
   79   2HB   ALA  15          2HB       ALA  15  10.225  -5.397  -3.182
   80   3HB   ALA  15          3HB       ALA  15  10.800  -5.106  -4.823
   81    H    GLY  16           H        GLY  16   7.075  -6.545  -5.783
   82   1HA   GLY  16          1HA       GLY  16   5.203  -7.795  -5.191
   83   2HA   GLY  16          2HA       GLY  16   6.114  -8.186  -3.742
   84    H    TRP  17           H        TRP  17   4.819  -5.061  -4.835
   85    HA   TRP  17           HA       TRP  17   2.903  -5.123  -2.566
   86   1HB   TRP  17          1HB       TRP  17   5.329  -3.427  -2.918
   87   2HB   TRP  17          2HB       TRP  17   3.899  -2.676  -2.209
   88    HD1  TRP  17           HD1      TRP  17   6.860  -4.424  -1.146
   89    HE1  TRP  17           HE1      TRP  17   6.541  -5.509   1.175
   90    HE3  TRP  17           HE3      TRP  17   1.790  -4.215  -0.781
   91    HZ2  TRP  17           HZ2      TRP  17   4.395  -6.199   2.951
   92    HZ3  TRP  17           HZ3      TRP  17   0.621  -5.085   1.219
   93    HH2  TRP  17           HH2      TRP  17   1.916  -6.080   3.086
   94    H    GLU  18           H        GLU  18   1.557  -5.311  -4.614
   95    HA   GLU  18           HA       GLU  18   1.281  -2.873  -6.260
   96   1HB   GLU  18          1HB       GLU  18   0.916  -5.549  -6.662
   97   2HB   GLU  18          2HB       GLU  18  -0.738  -5.039  -6.314
   98   1HG   GLU  18          1HG       GLU  18  -0.922  -3.924  -8.280
   99   2HG   GLU  18          2HG       GLU  18   0.689  -3.220  -8.129
  100    H    MET  19           H        MET  19  -1.423  -2.763  -6.551
  101    HA   MET  19           HA       MET  19  -2.828  -2.665  -4.013
  102   1HB   MET  19          1HB       MET  19  -2.923  -0.241  -3.821
  103   2HB   MET  19          2HB       MET  19  -1.246  -0.777  -3.819
  104   1HG   MET  19          1HG       MET  19  -0.895  -0.059  -6.053
  105   2HG   MET  19          2HG       MET  19  -2.625   0.063  -6.371
  106   1HE   MET  19          1HE       MET  19   0.140   2.155  -6.462
  107   2HE   MET  19          2HE       MET  19   0.514   1.511  -4.866
  108   3HE   MET  19          3HE       MET  19   0.188   3.231  -5.059
  109    H    ALA  20           H        ALA  20  -5.012  -2.397  -4.311
  110    HA   ALA  20           HA       ALA  20  -5.991  -1.590  -7.002
  111   1HB   ALA  20          1HB       ALA  20  -6.182  -4.258  -5.615
  112   2HB   ALA  20          2HB       ALA  20  -5.683  -3.915  -7.271
  113   3HB   ALA  20          3HB       ALA  20  -7.383  -3.784  -6.817
  114    H    LYS  21           H        LYS  21  -8.439  -1.425  -6.951
  115    HA   LYS  21           HA       LYS  21  -9.296  -0.334  -4.318
  116   1HB   LYS  21          1HB       LYS  21 -11.076   0.697  -5.732
  117   2HB   LYS  21          2HB       LYS  21  -9.460   1.067  -6.334
  118   1HG   LYS  21          1HG       LYS  21  -9.666  -0.386  -8.153
  119   2HG   LYS  21          2HG       LYS  21 -10.908  -1.357  -7.363
  120   1HD   LYS  21          1HD       LYS  21 -12.246  -0.165  -8.819
  121   2HD   LYS  21          2HD       LYS  21 -12.242   0.959  -7.460
  122   1HE   LYS  21          1HE       LYS  21  -9.943   1.685  -8.808
  123   2HE   LYS  21          2HE       LYS  21 -11.045   1.264 -10.133
  124   1HZ   LYS  21          1HZ       LYS  21 -11.339   3.576  -9.365
  125   2HZ   LYS  21          2HZ       LYS  21 -11.741   3.001  -7.817
  126   3HZ   LYS  21          3HZ       LYS  21 -12.741   2.647  -9.145
  127    H    THR  22           H        THR  22 -11.290  -1.013  -3.365
  128    HA   THR  22           HA       THR  22 -12.061  -3.798  -4.041
  129    HB   THR  22           HB       THR  22 -13.100  -3.714  -1.830
  130    HG1  THR  22           HG1      THR  22 -13.721  -1.882  -1.049
  131   1HG2  THR  22          1HG2      THR  22 -10.601  -3.964  -2.041
  132   2HG2  THR  22          2HG2      THR  22 -11.137  -3.313  -0.493
  133   3HG2  THR  22          3HG2      THR  22 -10.463  -2.236  -1.715
  134    H    SER  23           H        SER  23 -14.702  -3.556  -2.915
  135    HA   SER  23           HA       SER  23 -16.355  -3.205  -5.118
  136   1HB   SER  23          1HB       SER  23 -17.015  -4.164  -2.959
  137   2HB   SER  23          2HB       SER  23 -16.897  -2.577  -2.200
  138    HG   SER  23           HG       SER  23 -18.607  -1.873  -3.392
  139    H    SER  24           H        SER  24 -14.958  -0.662  -3.111
  140    HA   SER  24           HA       SER  24 -16.451   1.357  -4.759
  141   1HB   SER  24          1HB       SER  24 -15.765   1.128  -1.852
  142   2HB   SER  24          2HB       SER  24 -15.860   2.740  -2.561
  143    HG   SER  24           HG       SER  24 -17.954   2.268  -3.245
  144    H    GLY  25           H        GLY  25 -13.764   1.834  -2.497
  145   1HA   GLY  25          1HA       GLY  25 -11.781   2.113  -4.622
  146   2HA   GLY  25          2HA       GLY  25 -12.281   3.657  -3.940
  147    H    GLN  26           H        GLN  26 -12.228   0.775  -1.959
  148    HA   GLN  26           HA       GLN  26 -10.513   1.980   0.013
  149   1HB   GLN  26          1HB       GLN  26 -11.243  -0.922  -0.511
  150   2HB   GLN  26          2HB       GLN  26 -10.639  -0.271   1.011
  151   1HG   GLN  26          1HG       GLN  26 -12.636   1.301   1.002
  152   2HG   GLN  26          2HG       GLN  26 -13.269   0.360  -0.348
  153   1HE2  GLN  26          1HE2      GLN  26 -15.080  -0.153   1.266
  154   2HE2  GLN  26          2HE2      GLN  26 -14.836  -1.432   2.355
  155    H    ARG  27           H        ARG  27  -8.735   2.616  -1.527
  156    HA   ARG  27           HA       ARG  27  -7.137   0.939  -3.068
  157   1HB   ARG  27          1HB       ARG  27  -7.069   3.534  -2.011
  158   2HB   ARG  27          2HB       ARG  27  -5.557   2.795  -1.490
  159   1HG   ARG  27          1HG       ARG  27  -5.484   1.930  -3.982
  160   2HG   ARG  27          2HG       ARG  27  -6.564   3.299  -4.269
  161   1HD   ARG  27          1HD       ARG  27  -4.337   4.081  -2.566
  162   2HD   ARG  27          2HD       ARG  27  -3.760   3.401  -4.099
  163    HE   ARG  27           HE       ARG  27  -6.012   5.176  -4.518
  164   1HH1  ARG  27          1HH1      ARG  27  -2.587   5.090  -3.900
  165   2HH1  ARG  27          2HH1      ARG  27  -2.302   6.621  -4.653
  166   1HH2  ARG  27          1HH2      ARG  27  -5.616   7.161  -5.489
  167   2HH2  ARG  27          2HH2      ARG  27  -4.002   7.786  -5.546
  168    H    TYR  28           H        TYR  28  -6.760  -1.141  -2.193
  169    HA   TYR  28           HA       TYR  28  -5.207  -1.213   0.362
  170   1HB   TYR  28          1HB       TYR  28  -5.948  -3.526   0.511
  171   2HB   TYR  28          2HB       TYR  28  -7.340  -2.492   0.222
  172    HD1  TYR  28           HD1      TYR  28  -8.550  -2.558  -1.871
  173    HD2  TYR  28           HD2      TYR  28  -5.064  -4.991  -1.281
  174    HE1  TYR  28           HE1      TYR  28  -9.188  -3.941  -3.818
  175    HE2  TYR  28           HE2      TYR  28  -5.711  -6.375  -3.227
  176    HH   TYR  28           HH       TYR  28  -8.771  -6.225  -4.671
  177    H    PHE  29           H        PHE  29  -3.090  -1.735   0.226
  178    HA   PHE  29           HA       PHE  29  -1.910  -2.170  -2.401
  179   1HB   PHE  29          1HB       PHE  29  -0.843  -1.971   0.429
  180   2HB   PHE  29          2HB       PHE  29   0.192  -2.078  -0.998
  181    HD1  PHE  29           HD1      PHE  29   0.421  -0.213  -2.516
  182    HD2  PHE  29           HD2      PHE  29  -2.370  -0.020   0.733
  183    HE1  PHE  29           HE1      PHE  29   0.094   2.196  -2.946
  184    HE2  PHE  29           HE2      PHE  29  -2.701   2.387   0.308
  185    HZ   PHE  29           HZ       PHE  29  -1.470   3.502  -1.533
  186    H    LYS  30           H        LYS  30  -1.838  -4.101  -3.293
  187    HA   LYS  30           HA       LYS  30  -2.172  -6.597  -1.864
  188   1HB   LYS  30          1HB       LYS  30  -1.454  -5.757  -4.671
  189   2HB   LYS  30          2HB       LYS  30  -1.722  -7.441  -4.226
  190   1HG   LYS  30          1HG       LYS  30  -3.874  -5.939  -3.177
  191   2HG   LYS  30          2HG       LYS  30  -3.628  -5.370  -4.820
  192   1HD   LYS  30          1HD       LYS  30  -3.353  -8.149  -5.008
  193   2HD   LYS  30          2HD       LYS  30  -4.715  -7.915  -3.913
  194   1HE   LYS  30          1HE       LYS  30  -5.893  -7.718  -5.885
  195   2HE   LYS  30          2HE       LYS  30  -5.287  -6.052  -5.833
  196   1HZ   LYS  30          1HZ       LYS  30  -4.669  -7.030  -7.927
  197   2HZ   LYS  30          2HZ       LYS  30  -3.996  -8.385  -7.155
  198   3HZ   LYS  30          3HZ       LYS  30  -3.267  -6.859  -6.988
  199    H    ASN  31           H        ASN  31  -0.576  -8.099  -1.384
  200    HA   ASN  31           HA       ASN  31   2.262  -7.191  -1.737
  201   1HB   ASN  31          1HB       ASN  31   1.058  -7.412   0.565
  202   2HB   ASN  31          2HB       ASN  31   1.232  -9.149   0.315
  203   1HD2  ASN  31          1HD2      ASN  31   2.724  -8.970   2.285
  204   2HD2  ASN  31          2HD2      ASN  31   4.340  -8.523   2.021
  205    H    HIS  32           H        HIS  32   3.255  -8.408  -3.344
  206    HA   HIS  32           HA       HIS  32   2.284 -11.181  -3.821
  207   1HB   HIS  32          1HB       HIS  32   4.290  -9.446  -5.298
  208   2HB   HIS  32          2HB       HIS  32   3.611 -10.962  -5.880
  209    HD1  HIS  32           HD1      HIS  32   1.010 -10.972  -6.414
  210    HD2  HIS  32           HD2      HIS  32   2.604  -7.200  -5.631
  211    HE1  HIS  32           HE1      HIS  32  -0.726  -9.287  -7.166
  212    H    ILE  33           H        ILE  33   5.046  -9.390  -2.594
  213    HA   ILE  33           HA       ILE  33   6.965 -11.536  -2.554
  214    HB   ILE  33           HB       ILE  33   7.931 -10.111  -0.641
  215   1HG1  ILE  33          1HG1      ILE  33   5.856  -8.072  -1.429
  216   2HG1  ILE  33          2HG1      ILE  33   5.532  -9.214  -0.126
  217   1HG2  ILE  33          1HG2      ILE  33   7.705  -9.598  -3.441
  218   2HG2  ILE  33          2HG2      ILE  33   9.025  -9.173  -2.351
  219   3HG2  ILE  33          3HG2      ILE  33   7.682  -8.054  -2.589
  220   1HD1  ILE  33          1HD1      ILE  33   6.562  -7.629   1.156
  221   2HD1  ILE  33          2HD1      ILE  33   7.420  -6.933  -0.220
  222   3HD1  ILE  33          3HD1      ILE  33   8.033  -8.395   0.555
  223    H    ASP  34           H        ASP  34   4.220 -10.687  -0.569
  224    HA   ASP  34           HA       ASP  34   4.761 -13.071   1.171
  225   1HB   ASP  34          1HB       ASP  34   4.757 -10.423   1.905
  226   2HB   ASP  34          2HB       ASP  34   3.088 -10.885   2.238
  227    H    GLN  35           H        GLN  35   2.725 -11.771  -1.180
  228    HA   GLN  35           HA       GLN  35   0.580 -12.370  -1.943
  229   1HB   GLN  35          1HB       GLN  35   1.895 -14.623  -0.815
  230   2HB   GLN  35          2HB       GLN  35   0.206 -14.714  -0.314
  231   1HG   GLN  35          1HG       GLN  35  -0.526 -15.103  -2.432
  232   2HG   GLN  35          2HG       GLN  35   0.598 -13.939  -3.134
  233   1HE2  GLN  35          1HE2      GLN  35   2.623 -14.732  -3.923
  234   2HE2  GLN  35          2HE2      GLN  35   3.038 -16.378  -3.915
  235    H    THR  36           H        THR  36  -0.329 -10.494  -0.727
  236    HA   THR  36           HA       THR  36  -2.553 -11.224   0.932
  237    HB   THR  36           HB       THR  36  -1.228  -9.789   2.904
  238    HG1  THR  36           HG1      THR  36   0.815 -10.203   2.797
  239   1HG2  THR  36          1HG2      THR  36  -0.789 -12.578   3.341
  240   2HG2  THR  36          2HG2      THR  36  -2.323 -12.386   2.492
  241   3HG2  THR  36          3HG2      THR  36  -2.050 -11.549   4.020
  242    H    THR  37           H        THR  37  -3.975  -9.492   1.034
  243    HA   THR  37           HA       THR  37  -3.075  -6.920  -0.169
  244    HB   THR  37           HB       THR  37  -5.573  -6.571  -0.304
  245    HG1  THR  37           HG1      THR  37  -5.820  -9.253   0.501
  246   1HG2  THR  37          1HG2      THR  37  -4.075  -7.890  -1.992
  247   2HG2  THR  37          2HG2      THR  37  -5.829  -7.983  -2.144
  248   3HG2  THR  37          3HG2      THR  37  -4.940  -9.297  -1.381
  249    H    THR  38           H        THR  38  -2.856  -5.088   1.111
  250    HA   THR  38           HA       THR  38  -4.003  -5.203   3.882
  251    HB   THR  38           HB       THR  38  -1.529  -5.661   3.685
  252    HG1  THR  38           HG1      THR  38  -1.313  -4.675   5.525
  253   1HG2  THR  38          1HG2      THR  38  -1.504  -2.788   2.707
  254   2HG2  THR  38          2HG2      THR  38  -1.016  -4.209   1.787
  255   3HG2  THR  38          3HG2      THR  38  -0.070  -3.698   3.183
  256    H    TRP  39           H        TRP  39  -4.625  -3.156   4.771
  257    HA   TRP  39           HA       TRP  39  -5.546  -1.186   2.845
  258   1HB   TRP  39          1HB       TRP  39  -5.430  -1.240   5.880
  259   2HB   TRP  39          2HB       TRP  39  -6.363  -0.087   4.929
  260    HD1  TRP  39           HD1      TRP  39  -6.942  -3.045   6.814
  261    HE1  TRP  39           HE1      TRP  39  -8.987  -4.367   5.976
  262    HE3  TRP  39           HE3      TRP  39  -7.538  -0.925   2.205
  263    HZ2  TRP  39           HZ2      TRP  39 -10.653  -4.510   3.659
  264    HZ3  TRP  39           HZ3      TRP  39  -9.358  -1.681   0.704
  265    HH2  TRP  39           HH2      TRP  39 -10.916  -3.468   1.427
  266    H    GLN  40           H        GLN  40  -3.066  -1.293   5.400
  267    HA   GLN  40           HA       GLN  40  -2.117   1.378   5.195
  268   1HB   GLN  40          1HB       GLN  40  -0.776  -1.252   5.889
  269   2HB   GLN  40          2HB       GLN  40  -0.037   0.324   6.171
  270   1HG   GLN  40          1HG       GLN  40  -1.762   0.958   7.707
  271   2HG   GLN  40          2HG       GLN  40  -2.769  -0.414   7.244
  272   1HE2  GLN  40          1HE2      GLN  40  -0.995  -2.553   7.337
  273   2HE2  GLN  40          2HE2      GLN  40  -0.364  -2.728   8.903
  274    H    ASP  41           H        ASP  41   0.272   1.750   4.391
  275    HA   ASP  41           HA       ASP  41   0.419   0.746   1.572
  276   1HB   ASP  41          1HB       ASP  41   1.513   3.272   2.851
  277   2HB   ASP  41          2HB       ASP  41   1.515   2.897   1.128
  278    HA   PRO  42           HA       PRO  42   4.257  -1.062   2.879
  279   1HB   PRO  42          1HB       PRO  42   5.123  -1.927   0.450
  280   2HB   PRO  42          2HB       PRO  42   3.826  -2.725   1.351
  281   1HG   PRO  42          1HG       PRO  42   3.676  -0.952  -1.011
  282   2HG   PRO  42          2HG       PRO  42   2.615  -2.278  -0.524
  283   1HD   PRO  42          1HD       PRO  42   2.107   0.457  -0.202
  284   2HD   PRO  42          2HD       PRO  42   1.228  -0.872   0.579
  285    H    ARG  43           H        ARG  43   3.980   1.851   1.367
  286    HA   ARG  43           HA       ARG  43   6.950   2.206   1.280
  287   1HB   ARG  43          1HB       ARG  43   6.629   3.501  -0.808
  288   2HB   ARG  43          2HB       ARG  43   6.049   1.846  -0.993
  289   1HG   ARG  43          1HG       ARG  43   3.741   2.701  -0.372
  290   2HG   ARG  43          2HG       ARG  43   4.393   4.334  -0.501
  291   1HD   ARG  43          1HD       ARG  43   5.165   3.682  -2.863
  292   2HD   ARG  43          2HD       ARG  43   4.119   2.260  -2.690
  293    HE   ARG  43           HE       ARG  43   2.261   3.704  -2.905
  294   1HH1  ARG  43          1HH1      ARG  43   5.084   5.484  -1.914
  295   2HH1  ARG  43          2HH1      ARG  43   4.281   7.014  -1.990
  296   1HH2  ARG  43          1HH2      ARG  43   1.241   5.702  -2.997
  297   2HH2  ARG  43          2HH2      ARG  43   2.122   7.139  -2.598
  298    H    LYS  44           H        LYS  44   4.514   3.018   3.073
  299    HA   LYS  44           HA       LYS  44   5.494   5.723   3.633
  300   1HB   LYS  44          1HB       LYS  44   3.995   6.017   1.675
  301   2HB   LYS  44          2HB       LYS  44   2.684   5.263   2.582
  302   1HG   LYS  44          1HG       LYS  44   2.455   7.683   2.735
  303   2HG   LYS  44          2HG       LYS  44   2.921   7.055   4.316
  304   1HD   LYS  44          1HD       LYS  44   4.241   9.063   3.718
  305   2HD   LYS  44          2HD       LYS  44   5.271   7.640   3.865
  306   1HE   LYS  44          1HE       LYS  44   5.908   7.801   1.691
  307   2HE   LYS  44          2HE       LYS  44   4.223   7.932   1.151
  308   1HZ   LYS  44          1HZ       LYS  44   5.728  10.138   2.461
  309   2HZ   LYS  44          2HZ       LYS  44   4.191  10.232   1.743
  310   3HZ   LYS  44          3HZ       LYS  44   5.568   9.984   0.779
  311    H    ALA  45           H        ALA  45   2.937   3.299   4.172
  312    HA   ALA  45           HA       ALA  45   2.764   4.208   7.023
  313   1HB   ALA  45          1HB       ALA  45   0.538   4.075   6.666
  314   2HB   ALA  45          2HB       ALA  45   0.694   2.383   6.195
  315   3HB   ALA  45          3HB       ALA  45   0.862   3.654   4.984
  316    H    MET  46           H        MET  46   4.965   2.651   6.550
  317    HA   MET  46           HA       MET  46   4.190  -0.162   7.192
  318   1HB   MET  46          1HB       MET  46   6.552  -0.607   6.562
  319   2HB   MET  46          2HB       MET  46   5.699   0.263   5.288
  320   1HG   MET  46          1HG       MET  46   7.018   2.093   5.507
  321   2HG   MET  46          2HG       MET  46   6.939   2.040   7.268
  322   1HE   MET  46          1HE       MET  46   9.639   1.424   4.295
  323   2HE   MET  46          2HE       MET  46  10.529   2.177   5.617
  324   3HE   MET  46          3HE       MET  46   8.937   2.789   5.175
  325    H    LEU  47           H        LEU  47   6.611  -0.864   8.492
  326    HA   LEU  47           HA       LEU  47   6.058  -0.061  11.206
  327   1HB   LEU  47          1HB       LEU  47   7.254  -2.148  10.023
  328   2HB   LEU  47          2HB       LEU  47   8.696  -1.198  10.382
  329    HG   LEU  47           HG       LEU  47   7.189  -1.039  12.723
  330   1HD1  LEU  47          1HD1      LEU  47   6.459  -3.242  13.262
  331   2HD1  LEU  47          2HD1      LEU  47   7.248  -3.931  11.844
  332   3HD1  LEU  47          3HD1      LEU  47   5.814  -2.923  11.652
  333   1HD2  LEU  47          1HD2      LEU  47   9.513  -2.782  11.878
  334   2HD2  LEU  47          2HD2      LEU  47   8.948  -2.701  13.547
  335   3HD2  LEU  47          3HD2      LEU  47   9.570  -1.253  12.754
  336    H    SER  48           H        SER  48   6.228   2.384  10.521
  337    HA   SER  48           HA       SER  48   8.758   3.410  11.565
  338   1HB   SER  48          1HB       SER  48   8.082   3.368   8.643
  339   2HB   SER  48          2HB       SER  48   8.967   4.754   9.282
  340    HG   SER  48           HG       SER  48  10.089   2.655   8.528
  341    H    GLN  49           H        GLN  49   7.863   4.934  12.915
  342    HA   GLN  49           HA       GLN  49   5.967   6.913  11.714
  343   1HB   GLN  49          1HB       GLN  49   5.290   4.839  13.451
  344   2HB   GLN  49          2HB       GLN  49   5.431   6.242  14.511
  345   1HG   GLN  49          1HG       GLN  49   4.079   7.239  12.296
  346   2HG   GLN  49          2HG       GLN  49   3.393   5.627  12.503
  347   1HE2  GLN  49          1HE2      GLN  49   1.956   8.115  13.071
  348   2HE2  GLN  49          2HE2      GLN  49   1.610   8.123  14.733
  349    H    MET  50           H        MET  50   8.464   7.755  11.842
  350    HA   MET  50           HA       MET  50   8.913   9.024  14.513
  351   1HB   MET  50          1HB       MET  50  10.611   7.554  13.188
  352   2HB   MET  50          2HB       MET  50  10.813   8.981  12.170
  353   1HG   MET  50          1HG       MET  50  12.436   9.420  13.757
  354   2HG   MET  50          2HG       MET  50  11.054  10.181  14.544
  355   1HE   MET  50          1HE       MET  50  10.799   8.631  17.780
  356   2HE   MET  50          2HE       MET  50   9.699   9.178  16.517
  357   3HE   MET  50          3HE       MET  50  11.166  10.093  16.854
  358   1H    GLY  51          1H        GLY  51 -13.845   0.677   9.985
  359   2H    GLY  51          2H        GLY  51 -15.167  -0.360   9.736
  360   3H    GLY  51          3H        GLY  51 -14.084  -0.040   8.467
  361   1HA   GLY  51          1HA       GLY  51 -12.294  -1.113   9.749
  362   2HA   GLY  51          2HA       GLY  51 -13.504  -1.546  10.958
  363    H    THR  52           H        THR  52 -11.833  -2.964   8.640
  364    HA   THR  52           HA       THR  52 -13.702  -5.138   8.272
  365    HB   THR  52           HB       THR  52 -14.764  -3.463   6.828
  366    HG1  THR  52           HG1      THR  52 -14.437  -4.633   4.786
  367   1HG2  THR  52          1HG2      THR  52 -13.616  -2.323   5.092
  368   2HG2  THR  52          2HG2      THR  52 -12.220  -3.395   5.205
  369   3HG2  THR  52          3HG2      THR  52 -12.539  -2.225   6.485
  370    HA   PRO  53           HA       PRO  53  -9.835  -7.014   7.281
  371   1HB   PRO  53          1HB       PRO  53 -10.698  -9.280   6.011
  372   2HB   PRO  53          2HB       PRO  53 -10.812  -9.052   7.766
  373   1HG   PRO  53          1HG       PRO  53 -12.909  -8.751   5.669
  374   2HG   PRO  53          2HG       PRO  53 -13.034  -9.433   7.296
  375   1HD   PRO  53          1HD       PRO  53 -13.877  -6.920   6.641
  376   2HD   PRO  53          2HD       PRO  53 -13.333  -7.378   8.268
  377    HA   PRO  54           HA       PRO  54  -8.840  -5.855   3.150
  378   1HB   PRO  54          1HB       PRO  54  -6.804  -7.598   2.569
  379   2HB   PRO  54          2HB       PRO  54  -6.613  -6.198   3.642
  380   1HG   PRO  54          1HG       PRO  54  -7.090  -9.069   4.333
  381   2HG   PRO  54          2HG       PRO  54  -5.968  -7.910   5.065
  382   1HD   PRO  54          1HD       PRO  54  -8.328  -8.527   6.209
  383   2HD   PRO  54          2HD       PRO  54  -7.633  -6.893   6.314
  384    HA   PRO  55           HA       PRO  55 -10.801  -8.516   0.263
  385   1HB   PRO  55          1HB       PRO  55  -9.236  -8.346  -1.991
  386   2HB   PRO  55          2HB       PRO  55 -10.290  -7.032  -1.434
  387   1HG   PRO  55          1HG       PRO  55  -7.357  -7.375  -1.107
  388   2HG   PRO  55          2HG       PRO  55  -8.289  -5.915  -1.458
  389   1HD   PRO  55          1HD       PRO  55  -7.312  -6.510   1.013
  390   2HD   PRO  55          2HD       PRO  55  -8.785  -5.550   0.754
  391    HA   PRO  56           HA       PRO  56  -8.948 -12.506   0.162
  392   1HB   PRO  56          1HB       PRO  56  -9.766 -13.592  -2.206
  393   2HB   PRO  56          2HB       PRO  56 -10.860 -13.314  -0.838
  394   1HG   PRO  56          1HG       PRO  56 -10.521 -11.752  -3.335
  395   2HG   PRO  56          2HG       PRO  56 -11.981 -12.071  -2.389
  396   1HD   PRO  56          1HD       PRO  56 -10.557  -9.711  -2.338
  397   2HD   PRO  56          2HD       PRO  56 -11.659 -10.260  -1.060
  398    H    TYR  57           H        TYR  57  -7.670 -10.169  -1.794
  399    HA   TYR  57           HA       TYR  57  -5.673 -10.012  -3.030
  400   1HB   TYR  57          1HB       TYR  57  -4.902 -11.168  -0.935
  401   2HB   TYR  57          2HB       TYR  57  -5.165 -12.713  -1.738
  402    HD1  TYR  57           HD1      TYR  57  -3.056  -9.715  -1.574
  403    HD2  TYR  57           HD2      TYR  57  -3.789 -13.399  -3.656
  404    HE1  TYR  57           HE1      TYR  57  -0.840  -9.538  -2.667
  405    HE2  TYR  57           HE2      TYR  57  -1.572 -13.223  -4.747
  406    HH   TYR  57           HH       TYR  57   0.492 -12.164  -4.551
  407    H    THR  58           H        THR  58  -4.501 -11.019  -4.876
  408    HA   THR  58           HA       THR  58  -5.634 -13.422  -6.123
  409    HB   THR  58           HB       THR  58  -6.190 -11.809  -8.175
  410    HG1  THR  58           HG1      THR  58  -6.849  -9.820  -7.497
  411   1HG2  THR  58          1HG2      THR  58  -8.311 -12.417  -7.713
  412   2HG2  THR  58          2HG2      THR  58  -8.307 -11.555  -6.174
  413   3HG2  THR  58          3HG2      THR  58  -7.646 -13.187  -6.273
  414    H    VAL  59           H        VAL  59  -4.754 -13.224  -8.649
  415    HA   VAL  59           HA       VAL  59  -2.244 -11.854  -9.016
  416    HB   VAL  59           HB       VAL  59  -1.581 -13.420  -7.240
  417   1HG1  VAL  59          1HG1      VAL  59  -1.972 -15.723  -7.325
  418   2HG1  VAL  59          2HG1      VAL  59  -2.161 -15.726  -9.078
  419   3HG1  VAL  59          3HG1      VAL  59  -3.445 -15.084  -8.054
  420   1HG2  VAL  59          1HG2      VAL  59   0.375 -14.179  -8.264
  421   2HG2  VAL  59          2HG2      VAL  59  -0.146 -12.927  -9.391
  422   3HG2  VAL  59          3HG2      VAL  59  -0.459 -14.625  -9.753
  423    H    GLY  60           H        GLY  60  -3.987 -11.762 -10.897
  424   1HA   GLY  60          1HA       GLY  60  -4.541 -12.343 -13.102
  425   2HA   GLY  60          2HA       GLY  60  -2.942 -13.084 -13.167
  Start of MODEL    2
    1    H    PHE   5           H        PHE   5  -9.896  11.357   2.727
    2    HA   PHE   5           HA       PHE   5  -7.709  10.324   1.289
    3   1HB   PHE   5          1HB       PHE   5  -8.314  12.680   2.302
    4   2HB   PHE   5          2HB       PHE   5  -7.348  12.126   3.671
    5    HD1  PHE   5           HD1      PHE   5  -7.290  13.365   0.263
    6    HD2  PHE   5           HD2      PHE   5  -4.964  11.387   3.285
    7    HE1  PHE   5           HE1      PHE   5  -5.213  13.906  -0.981
    8    HE2  PHE   5           HE2      PHE   5  -2.887  11.929   2.040
    9    HZ   PHE   5           HZ       PHE   5  -3.012  13.187  -0.092
   10    H    GLU   6           H        GLU   6  -5.633   9.485   2.077
   11    HA   GLU   6           HA       GLU   6  -5.291   8.597   4.821
   12   1HB   GLU   6          1HB       GLU   6  -7.100   7.126   3.512
   13   2HB   GLU   6          2HB       GLU   6  -5.650   6.319   2.915
   14   1HG   GLU   6          1HG       GLU   6  -5.828   5.107   4.837
   15   2HG   GLU   6          2HG       GLU   6  -5.064   6.517   5.571
   16    H    ILE   7           H        ILE   7  -4.474   7.436   1.520
   17    HA   ILE   7           HA       ILE   7  -1.587   7.494   2.324
   18    HB   ILE   7           HB       ILE   7  -2.956   6.019   0.049
   19   1HG1  ILE   7          1HG1      ILE   7  -3.856   5.263   2.212
   20   2HG1  ILE   7          2HG1      ILE   7  -2.806   4.025   1.523
   21   1HG2  ILE   7          1HG2      ILE   7  -0.249   5.692   1.378
   22   2HG2  ILE   7          2HG2      ILE   7  -0.538   6.337  -0.238
   23   3HG2  ILE   7          3HG2      ILE   7  -0.890   4.645   0.112
   24   1HD1  ILE   7          1HD1      ILE   7  -1.709   4.058   3.501
   25   2HD1  ILE   7          2HD1      ILE   7  -2.501   5.553   4.000
   26   3HD1  ILE   7          3HD1      ILE   7  -1.057   5.614   2.988
   27    HA   PRO   8           HA       PRO   8  -1.097  10.812  -0.562
   28   1HB   PRO   8          1HB       PRO   8   1.604  10.627  -0.976
   29   2HB   PRO   8          2HB       PRO   8   0.894  11.303   0.502
   30   1HG   PRO   8          1HG       PRO   8   2.033   8.592   0.004
   31   2HG   PRO   8          2HG       PRO   8   2.171   9.627   1.434
   32   1HD   PRO   8          1HD       PRO   8   0.469   7.509   1.283
   33   2HD   PRO   8          2HD       PRO   8   0.165   8.939   2.292
   34    H    ASP   9           H        ASP   9  -0.782  11.100  -2.847
   35    HA   ASP   9           HA       ASP   9  -0.706   8.550  -4.388
   36   1HB   ASP   9          1HB       ASP   9  -2.479  10.526  -4.433
   37   2HB   ASP   9          2HB       ASP   9  -1.311  11.256  -5.534
   38    H    ASP  10           H        ASP  10   1.755   9.890  -3.295
   39    HA   ASP  10           HA       ASP  10   3.172  10.249  -5.911
   40   1HB   ASP  10          1HB       ASP  10   2.533  12.266  -4.142
   41   2HB   ASP  10          2HB       ASP  10   4.163  11.828  -3.627
   42    H    VAL  11           H        VAL  11   3.171   7.803  -4.614
   43    HA   VAL  11           HA       VAL  11   5.856   7.726  -3.267
   44    HB   VAL  11           HB       VAL  11   3.620   5.704  -2.952
   45   1HG1  VAL  11          1HG1      VAL  11   6.101   6.455  -1.398
   46   2HG1  VAL  11          2HG1      VAL  11   5.715   4.901  -2.135
   47   3HG1  VAL  11          3HG1      VAL  11   4.828   5.449  -0.714
   48   1HG2  VAL  11          1HG2      VAL  11   3.534   7.157  -0.639
   49   2HG2  VAL  11          2HG2      VAL  11   2.427   7.399  -1.989
   50   3HG2  VAL  11          3HG2      VAL  11   3.846   8.431  -1.818
   51    HA   PRO  12           HA       PRO  12   7.041   5.273  -6.739
   52   1HB   PRO  12          1HB       PRO  12   9.223   4.012  -5.672
   53   2HB   PRO  12          2HB       PRO  12   9.230   5.711  -6.179
   54   1HG   PRO  12          1HG       PRO  12   8.944   4.544  -3.450
   55   2HG   PRO  12          2HG       PRO  12   9.854   5.968  -3.975
   56   1HD   PRO  12          1HD       PRO  12   7.428   6.113  -2.757
   57   2HD   PRO  12          2HD       PRO  12   8.001   7.326  -3.919
   58    H    LEU  13           H        LEU  13   5.917   3.928  -3.798
   59    HA   LEU  13           HA       LEU  13   4.938   1.815  -3.317
   60   1HB   LEU  13          1HB       LEU  13   4.770   2.284  -6.180
   61   2HB   LEU  13          2HB       LEU  13   4.972   0.565  -5.856
   62    HG   LEU  13           HG       LEU  13   2.853   2.383  -4.673
   63   1HD1  LEU  13          1HD1      LEU  13   1.932   0.024  -6.062
   64   2HD1  LEU  13          2HD1      LEU  13   2.995   0.959  -7.113
   65   3HD1  LEU  13          3HD1      LEU  13   1.572   1.717  -6.402
   66   1HD2  LEU  13          1HD2      LEU  13   3.300   0.820  -2.967
   67   2HD2  LEU  13          2HD2      LEU  13   3.663  -0.468  -4.116
   68   3HD2  LEU  13          3HD2      LEU  13   1.997   0.056  -3.874
   69    HA   PRO  14           HA       PRO  14   8.678  -0.602  -3.230
   70   1HB   PRO  14          1HB       PRO  14   7.871  -2.461  -1.401
   71   2HB   PRO  14          2HB       PRO  14   8.363  -0.817  -0.963
   72   1HG   PRO  14          1HG       PRO  14   5.687  -2.022  -1.037
   73   2HG   PRO  14          2HG       PRO  14   6.282  -0.645  -0.116
   74   1HD   PRO  14          1HD       PRO  14   4.720  -0.605  -2.483
   75   2HD   PRO  14          2HD       PRO  14   5.405   0.787  -1.634
   76    H    ALA  15           H        ALA  15   9.298  -2.932  -3.664
   77    HA   ALA  15           HA       ALA  15   7.843  -4.005  -5.914
   78   1HB   ALA  15          1HB       ALA  15   9.700  -5.376  -6.073
   79   2HB   ALA  15          2HB       ALA  15   9.776  -5.645  -4.331
   80   3HB   ALA  15          3HB       ALA  15  10.366  -4.130  -5.016
   81    H    GLY  16           H        GLY  16   6.673  -6.029  -6.009
   82   1HA   GLY  16          1HA       GLY  16   5.111  -7.572  -5.224
   83   2HA   GLY  16          2HA       GLY  16   6.182  -7.772  -3.846
   84    H    TRP  17           H        TRP  17   4.594  -4.779  -4.811
   85    HA   TRP  17           HA       TRP  17   2.715  -5.027  -2.521
   86   1HB   TRP  17          1HB       TRP  17   5.072  -3.231  -2.833
   87   2HB   TRP  17          2HB       TRP  17   3.623  -2.525  -2.117
   88    HD1  TRP  17           HD1      TRP  17   6.631  -4.189  -1.069
   89    HE1  TRP  17           HE1      TRP  17   6.355  -5.312   1.237
   90    HE3  TRP  17           HE3      TRP  17   1.559  -4.187  -0.706
   91    HZ2  TRP  17           HZ2      TRP  17   4.240  -6.108   3.002
   92    HZ3  TRP  17           HZ3      TRP  17   0.425  -5.127   1.285
   93    HH2  TRP  17           HH2      TRP  17   1.761  -6.094   3.140
   94    H    GLU  18           H        GLU  18   1.486  -5.235  -4.714
   95    HA   GLU  18           HA       GLU  18   1.010  -2.758  -6.230
   96   1HB   GLU  18          1HB       GLU  18   0.784  -5.428  -6.723
   97   2HB   GLU  18          2HB       GLU  18  -0.889  -5.038  -6.309
   98   1HG   GLU  18          1HG       GLU  18  -1.207  -3.900  -8.235
   99   2HG   GLU  18          2HG       GLU  18   0.333  -3.053  -8.085
  100    H    MET  19           H        MET  19  -1.706  -2.801  -6.498
  101    HA   MET  19           HA       MET  19  -3.077  -2.886  -3.955
  102   1HB   MET  19          1HB       MET  19  -3.307  -0.507  -3.596
  103   2HB   MET  19          2HB       MET  19  -1.598  -0.905  -3.720
  104   1HG   MET  19          1HG       MET  19  -2.894  -0.224  -6.290
  105   2HG   MET  19          2HG       MET  19  -2.819   1.097  -5.132
  106   1HE   MET  19          1HE       MET  19  -1.211   2.250  -4.411
  107   2HE   MET  19          2HE       MET  19  -0.756   2.767  -6.033
  108   3HE   MET  19          3HE       MET  19   0.492   2.289  -4.886
  109    H    ALA  20           H        ALA  20  -5.309  -2.414  -4.138
  110    HA   ALA  20           HA       ALA  20  -6.387  -1.683  -6.789
  111   1HB   ALA  20          1HB       ALA  20  -6.911  -3.819  -7.393
  112   2HB   ALA  20          2HB       ALA  20  -7.415  -4.245  -5.757
  113   3HB   ALA  20          3HB       ALA  20  -5.707  -4.288  -6.193
  114    H    LYS  21           H        LYS  21  -8.947  -1.979  -6.580
  115    HA   LYS  21           HA       LYS  21  -9.693  -0.800  -3.941
  116   1HB   LYS  21          1HB       LYS  21 -10.482  -0.517  -6.772
  117   2HB   LYS  21          2HB       LYS  21 -11.826  -0.474  -5.632
  118   1HG   LYS  21          1HG       LYS  21 -11.069   1.788  -5.854
  119   2HG   LYS  21          2HG       LYS  21 -10.467   1.222  -4.296
  120   1HD   LYS  21          1HD       LYS  21  -8.489   2.060  -5.102
  121   2HD   LYS  21          2HD       LYS  21  -8.401   0.473  -5.865
  122   1HE   LYS  21          1HE       LYS  21  -8.141   1.722  -7.783
  123   2HE   LYS  21          2HE       LYS  21  -9.909   1.843  -7.698
  124   1HZ   LYS  21          1HZ       LYS  21  -7.947   3.718  -6.477
  125   2HZ   LYS  21          2HZ       LYS  21  -9.630   3.809  -6.270
  126   3HZ   LYS  21          3HZ       LYS  21  -8.947   4.047  -7.806
  127    H    THR  22           H        THR  22 -11.003  -1.956  -2.566
  128    HA   THR  22           HA       THR  22 -12.045  -4.575  -3.489
  129    HB   THR  22           HB       THR  22 -12.113  -3.382  -0.710
  130    HG1  THR  22           HG1      THR  22 -10.063  -3.902  -0.454
  131   1HG2  THR  22          1HG2      THR  22 -12.642  -5.992  -1.937
  132   2HG2  THR  22          2HG2      THR  22 -13.150  -5.362  -0.370
  133   3HG2  THR  22          3HG2      THR  22 -11.549  -6.078  -0.555
  134    H    SER  23           H        SER  23 -13.254  -1.941  -4.209
  135    HA   SER  23           HA       SER  23 -16.023  -2.578  -4.046
  136   1HB   SER  23          1HB       SER  23 -15.938  -2.237  -1.692
  137   2HB   SER  23          2HB       SER  23 -14.878  -0.837  -1.854
  138    HG   SER  23           HG       SER  23 -16.568   0.362  -2.050
  139    H    SER  24           H        SER  24 -13.997   0.361  -3.642
  140    HA   SER  24           HA       SER  24 -14.570   1.299  -6.333
  141   1HB   SER  24          1HB       SER  24 -16.737   1.552  -4.999
  142   2HB   SER  24          2HB       SER  24 -15.898   2.780  -4.050
  143    HG   SER  24           HG       SER  24 -16.679   2.809  -6.734
  144    H    GLY  25           H        GLY  25 -13.659   2.248  -3.003
  145   1HA   GLY  25          1HA       GLY  25 -11.460   3.868  -4.217
  146   2HA   GLY  25          2HA       GLY  25 -12.420   4.515  -2.891
  147    H    GLN  26           H        GLN  26 -12.190   1.290  -2.201
  148    HA   GLN  26           HA       GLN  26 -10.239   1.737  -0.094
  149   1HB   GLN  26          1HB       GLN  26 -11.606  -0.738  -1.196
  150   2HB   GLN  26          2HB       GLN  26 -10.671  -0.703   0.296
  151   1HG   GLN  26          1HG       GLN  26 -12.269   0.509   1.431
  152   2HG   GLN  26          2HG       GLN  26 -12.818   1.345  -0.020
  153   1HE2  GLN  26          1HE2      GLN  26 -15.077   0.749   0.516
  154   2HE2  GLN  26          2HE2      GLN  26 -15.633  -0.834   0.255
  155    H    ARG  27           H        ARG  27  -8.458   2.419  -1.673
  156    HA   ARG  27           HA       ARG  27  -7.263   0.544  -3.496
  157   1HB   ARG  27          1HB       ARG  27  -5.350   2.148  -3.323
  158   2HB   ARG  27          2HB       ARG  27  -6.892   2.960  -3.574
  159   1HG   ARG  27          1HG       ARG  27  -6.811   3.970  -1.547
  160   2HG   ARG  27          2HG       ARG  27  -6.274   2.491  -0.746
  161   1HD   ARG  27          1HD       ARG  27  -4.186   3.329  -0.655
  162   2HD   ARG  27          2HD       ARG  27  -4.142   3.391  -2.424
  163    HE   ARG  27           HE       ARG  27  -4.740   5.637  -0.630
  164   1HH1  ARG  27          1HH1      ARG  27  -5.138   4.285  -3.815
  165   2HH1  ARG  27          2HH1      ARG  27  -5.426   5.823  -4.549
  166   1HH2  ARG  27          1HH2      ARG  27  -5.117   7.619  -1.609
  167   2HH2  ARG  27          2HH2      ARG  27  -5.415   7.696  -3.313
  168    H    TYR  28           H        TYR  28  -7.410  -1.352  -1.867
  169    HA   TYR  28           HA       TYR  28  -5.530  -1.402   0.352
  170   1HB   TYR  28          1HB       TYR  28  -6.284  -3.675   0.590
  171   2HB   TYR  28          2HB       TYR  28  -7.681  -2.727   0.096
  172    HD1  TYR  28           HD1      TYR  28  -5.361  -5.391  -0.827
  173    HD2  TYR  28           HD2      TYR  28  -8.511  -2.852  -2.264
  174    HE1  TYR  28           HE1      TYR  28  -5.740  -6.927  -2.733
  175    HE2  TYR  28           HE2      TYR  28  -8.876  -4.378  -4.176
  176    HH   TYR  28           HH       TYR  28  -7.923  -6.096  -5.361
  177    H    PHE  29           H        PHE  29  -3.374  -1.929   0.253
  178    HA   PHE  29           HA       PHE  29  -2.172  -2.330  -2.372
  179   1HB   PHE  29          1HB       PHE  29  -1.101  -2.139   0.451
  180   2HB   PHE  29          2HB       PHE  29  -0.067  -2.265  -0.976
  181    HD1  PHE  29           HD1      PHE  29  -2.650  -0.195   0.692
  182    HD2  PHE  29           HD2      PHE  29   0.276  -0.392  -2.445
  183    HE1  PHE  29           HE1      PHE  29  -2.939   2.220   0.279
  184    HE2  PHE  29           HE2      PHE  29  -0.012   2.033  -2.856
  185    HZ   PHE  29           HZ       PHE  29  -1.621   3.341  -1.498
  186    H    LYS  30           H        LYS  30  -1.942  -4.250  -3.285
  187    HA   LYS  30           HA       LYS  30  -2.227  -6.766  -1.845
  188   1HB   LYS  30          1HB       LYS  30  -1.610  -5.907  -4.676
  189   2HB   LYS  30          2HB       LYS  30  -1.797  -7.599  -4.213
  190   1HG   LYS  30          1HG       LYS  30  -3.984  -6.203  -3.109
  191   2HG   LYS  30          2HG       LYS  30  -3.808  -5.611  -4.751
  192   1HD   LYS  30          1HD       LYS  30  -3.415  -8.382  -4.946
  193   2HD   LYS  30          2HD       LYS  30  -4.773  -8.197  -3.837
  194   1HE   LYS  30          1HE       LYS  30  -6.077  -7.879  -5.672
  195   2HE   LYS  30          2HE       LYS  30  -5.245  -6.328  -5.897
  196   1HZ   LYS  30          1HZ       LYS  30  -4.060  -8.900  -6.775
  197   2HZ   LYS  30          2HZ       LYS  30  -3.618  -7.327  -7.240
  198   3HZ   LYS  30          3HZ       LYS  30  -5.076  -8.000  -7.792
  199    H    ASN  31           H        ASN  31  -0.566  -8.127  -1.291
  200    HA   ASN  31           HA       ASN  31   2.223  -7.132  -1.740
  201   1HB   ASN  31          1HB       ASN  31   1.064  -7.441   0.578
  202   2HB   ASN  31          2HB       ASN  31   1.328  -9.162   0.302
  203   1HD2  ASN  31          1HD2      ASN  31   2.851  -8.937   2.241
  204   2HD2  ASN  31          2HD2      ASN  31   4.433  -8.395   1.952
  205    H    HIS  32           H        HIS  32   3.244  -8.285  -3.378
  206    HA   HIS  32           HA       HIS  32   2.400 -11.100  -3.856
  207   1HB   HIS  32          1HB       HIS  32   4.301  -9.279  -5.370
  208   2HB   HIS  32          2HB       HIS  32   3.653 -10.811  -5.947
  209    HD1  HIS  32           HD1      HIS  32   1.109 -10.884  -6.568
  210    HD2  HIS  32           HD2      HIS  32   2.480  -7.092  -5.504
  211    HE1  HIS  32           HE1      HIS  32  -0.711  -9.248  -7.232
  212    H    ILE  33           H        ILE  33   5.073  -9.188  -2.640
  213    HA   ILE  33           HA       ILE  33   7.109 -11.226  -2.675
  214    HB   ILE  33           HB       ILE  33   8.023  -9.792  -0.743
  215   1HG1  ILE  33          1HG1      ILE  33   5.828  -7.849  -1.470
  216   2HG1  ILE  33          2HG1      ILE  33   5.595  -9.025  -0.176
  217   1HG2  ILE  33          1HG2      ILE  33   9.049  -8.878  -2.513
  218   2HG2  ILE  33          2HG2      ILE  33   7.748  -7.689  -2.575
  219   3HG2  ILE  33          3HG2      ILE  33   7.644  -9.161  -3.541
  220   1HD1  ILE  33          1HD1      ILE  33   6.588  -7.452   1.132
  221   2HD1  ILE  33          2HD1      ILE  33   7.299  -6.620  -0.251
  222   3HD1  ILE  33          3HD1      ILE  33   8.087  -8.049   0.418
  223    H    ASP  34           H        ASP  34   4.354 -10.571  -0.631
  224    HA   ASP  34           HA       ASP  34   5.040 -12.975   1.028
  225   1HB   ASP  34          1HB       ASP  34   5.047 -10.386   1.877
  226   2HB   ASP  34          2HB       ASP  34   3.368 -10.821   2.194
  227    H    GLN  35           H        GLN  35   2.912 -11.726  -1.236
  228    HA   GLN  35           HA       GLN  35   0.747 -12.352  -1.924
  229   1HB   GLN  35          1HB       GLN  35   2.144 -14.559  -1.319
  230   2HB   GLN  35          2HB       GLN  35   0.887 -14.708  -0.090
  231   1HG   GLN  35          1HG       GLN  35  -0.250 -15.739  -1.788
  232   2HG   GLN  35          2HG       GLN  35  -0.637 -14.080  -2.242
  233   1HE2  GLN  35          1HE2      GLN  35   1.739 -13.183  -3.386
  234   2HE2  GLN  35          2HE2      GLN  35   2.131 -14.130  -4.739
  235    H    THR  36           H        THR  36  -0.023 -10.460  -0.535
  236    HA   THR  36           HA       THR  36  -2.148 -11.353   1.260
  237    HB   THR  36           HB       THR  36  -0.955  -9.742   3.074
  238    HG1  THR  36           HG1      THR  36   0.948  -9.348   2.205
  239   1HG2  THR  36          1HG2      THR  36  -0.956 -11.649   4.271
  240   2HG2  THR  36          2HG2      THR  36   0.241 -12.395   3.214
  241   3HG2  THR  36          3HG2      THR  36  -1.471 -12.463   2.794
  242    H    THR  37           H        THR  37  -3.770  -9.822   1.226
  243    HA   THR  37           HA       THR  37  -3.202  -7.224  -0.121
  244    HB   THR  37           HB       THR  37  -5.710  -7.209  -0.297
  245    HG1  THR  37           HG1      THR  37  -6.841  -8.894   0.523
  246   1HG2  THR  37          1HG2      THR  37  -4.786  -9.923  -1.170
  247   2HG2  THR  37          2HG2      THR  37  -4.032  -8.489  -1.865
  248   3HG2  THR  37          3HG2      THR  37  -5.767  -8.746  -2.042
  249    H    THR  38           H        THR  38  -3.230  -5.317   1.063
  250    HA   THR  38           HA       THR  38  -4.479  -5.384   3.791
  251    HB   THR  38           HB       THR  38  -2.004  -5.725   3.838
  252    HG1  THR  38           HG1      THR  38  -2.848  -4.687   5.586
  253   1HG2  THR  38          1HG2      THR  38  -1.339  -4.534   1.848
  254   2HG2  THR  38          2HG2      THR  38  -0.597  -3.719   3.223
  255   3HG2  THR  38          3HG2      THR  38  -2.026  -3.028   2.457
  256    H    TRP  39           H        TRP  39  -5.007  -3.194   4.606
  257    HA   TRP  39           HA       TRP  39  -5.999  -1.443   2.479
  258   1HB   TRP  39          1HB       TRP  39  -6.060  -1.195   5.503
  259   2HB   TRP  39          2HB       TRP  39  -7.071  -0.302   4.368
  260    HD1  TRP  39           HD1      TRP  39  -6.529  -3.828   5.767
  261    HE1  TRP  39           HE1      TRP  39  -8.658  -5.214   5.344
  262    HE3  TRP  39           HE3      TRP  39  -9.172  -0.533   2.894
  263    HZ2  TRP  39           HZ2      TRP  39 -11.150  -4.962   3.970
  264    HZ3  TRP  39           HZ3      TRP  39 -11.421  -1.137   2.041
  265    HH2  TRP  39           HH2      TRP  39 -12.409  -3.348   2.576
  266    H    GLN  40           H        GLN  40  -3.885  -1.019   5.341
  267    HA   GLN  40           HA       GLN  40  -3.016   1.606   4.919
  268   1HB   GLN  40          1HB       GLN  40  -0.980   0.821   6.154
  269   2HB   GLN  40          2HB       GLN  40  -2.482   0.247   6.879
  270   1HG   GLN  40          1HG       GLN  40  -1.765  -1.664   4.917
  271   2HG   GLN  40          2HG       GLN  40  -0.290  -1.294   5.811
  272   1HE2  GLN  40          1HE2      GLN  40  -0.209  -1.874   8.075
  273   2HE2  GLN  40          2HE2      GLN  40  -1.410  -2.822   8.810
  274    H    ASP  41           H        ASP  41  -0.806   2.294   4.060
  275    HA   ASP  41           HA       ASP  41  -0.334   0.958   1.439
  276   1HB   ASP  41          1HB       ASP  41   0.590   3.125   0.801
  277   2HB   ASP  41          2HB       ASP  41  -0.972   3.371   1.578
  278    HA   PRO  42           HA       PRO  42   3.519  -0.513   3.064
  279   1HB   PRO  42          1HB       PRO  42   4.667  -1.289   0.719
  280   2HB   PRO  42          2HB       PRO  42   3.386  -2.216   1.514
  281   1HG   PRO  42          1HG       PRO  42   3.225  -0.357  -0.805
  282   2HG   PRO  42          2HG       PRO  42   2.370  -1.879  -0.519
  283   1HD   PRO  42          1HD       PRO  42   1.261   0.601  -0.151
  284   2HD   PRO  42          2HD       PRO  42   0.724  -0.862   0.698
  285    H    ARG  43           H        ARG  43   3.689   2.089   3.297
  286    HA   ARG  43           HA       ARG  43   6.343   2.819   2.465
  287   1HB   ARG  43          1HB       ARG  43   5.604   4.631   0.854
  288   2HB   ARG  43          2HB       ARG  43   5.365   2.989   0.267
  289   1HG   ARG  43          1HG       ARG  43   2.974   3.373   1.477
  290   2HG   ARG  43          2HG       ARG  43   3.351   5.036   1.041
  291   1HD   ARG  43          1HD       ARG  43   4.013   3.719  -1.272
  292   2HD   ARG  43          2HD       ARG  43   2.640   2.755  -0.694
  293    HE   ARG  43           HE       ARG  43   2.113   5.581  -0.391
  294   1HH1  ARG  43          1HH1      ARG  43   2.258   3.013  -2.737
  295   2HH1  ARG  43          2HH1      ARG  43   1.118   3.768  -3.795
  296   1HH2  ARG  43          1HH2      ARG  43   0.633   6.538  -1.782
  297   2HH2  ARG  43          2HH2      ARG  43   0.202   5.746  -3.261
  298    H    LYS  44           H        LYS  44   3.122   4.220   3.207
  299    HA   LYS  44           HA       LYS  44   4.477   6.270   4.901
  300   1HB   LYS  44          1HB       LYS  44   2.758   6.758   3.041
  301   2HB   LYS  44          2HB       LYS  44   1.555   6.098   4.150
  302   1HG   LYS  44          1HG       LYS  44   1.438   8.223   4.952
  303   2HG   LYS  44          2HG       LYS  44   2.936   7.816   5.788
  304   1HD   LYS  44          1HD       LYS  44   4.262   8.943   4.235
  305   2HD   LYS  44          2HD       LYS  44   3.060   8.799   2.954
  306   1HE   LYS  44          1HE       LYS  44   3.101  11.121   3.720
  307   2HE   LYS  44          2HE       LYS  44   1.587  10.385   4.281
  308   1HZ   LYS  44          1HZ       LYS  44   2.744   9.803   6.364
  309   2HZ   LYS  44          2HZ       LYS  44   2.668  11.483   6.122
  310   3HZ   LYS  44          3HZ       LYS  44   4.117  10.644   5.830
  311    H    ALA  45           H        ALA  45   2.249   3.541   5.029
  312    HA   ALA  45           HA       ALA  45   1.665   4.023   7.899
  313   1HB   ALA  45          1HB       ALA  45   0.042   2.248   7.559
  314   2HB   ALA  45          2HB       ALA  45   0.793   1.800   6.028
  315   3HB   ALA  45          3HB       ALA  45  -0.051   3.341   6.179
  316    H    MET  46           H        MET  46   4.140   3.642   8.247
  317    HA   MET  46           HA       MET  46   4.612   0.700   8.617
  318   1HB   MET  46          1HB       MET  46   5.956   2.546   6.988
  319   2HB   MET  46          2HB       MET  46   7.004   2.348   8.393
  320   1HG   MET  46          1HG       MET  46   5.802  -0.063   7.048
  321   2HG   MET  46          2HG       MET  46   7.257   0.687   6.390
  322   1HE   MET  46          1HE       MET  46   9.278   0.948   7.274
  323   2HE   MET  46          2HE       MET  46  10.027   0.103   8.626
  324   3HE   MET  46          3HE       MET  46   9.110   1.579   8.918
  325    H    LEU  47           H        LEU  47   5.254   3.988   9.823
  326    HA   LEU  47           HA       LEU  47   6.055   2.816  12.457
  327   1HB   LEU  47          1HB       LEU  47   6.684   5.334  10.941
  328   2HB   LEU  47          2HB       LEU  47   6.915   5.276  12.688
  329    HG   LEU  47           HG       LEU  47   8.134   3.343  10.693
  330   1HD1  LEU  47          1HD1      LEU  47   8.924   5.962  11.510
  331   2HD1  LEU  47          2HD1      LEU  47   9.808   4.832  10.486
  332   3HD1  LEU  47          3HD1      LEU  47  10.046   4.811  12.234
  333   1HD2  LEU  47          1HD2      LEU  47   9.523   2.984  12.966
  334   2HD2  LEU  47          2HD2      LEU  47   8.065   2.061  12.603
  335   3HD2  LEU  47          3HD2      LEU  47   7.977   3.464  13.666
  336    H    SER  48           H        SER  48   4.597   5.860  11.363
  337    HA   SER  48           HA       SER  48   2.781   7.100  12.238
  338   1HB   SER  48          1HB       SER  48   1.854   4.302  12.965
  339   2HB   SER  48          2HB       SER  48   0.830   5.714  12.705
  340    HG   SER  48           HG       SER  48   0.807   4.669  10.800
  341    H    GLN  49           H        GLN  49   3.689   8.196  14.011
  342    HA   GLN  49           HA       GLN  49   4.129   6.807  16.572
  343   1HB   GLN  49          1HB       GLN  49   5.600   8.600  15.575
  344   2HB   GLN  49          2HB       GLN  49   4.289   9.748  15.845
  345   1HG   GLN  49          1HG       GLN  49   4.329   9.067  18.285
  346   2HG   GLN  49          2HG       GLN  49   5.802   8.163  17.936
  347   1HE2  GLN  49          1HE2      GLN  49   5.481  10.614  19.656
  348   2HE2  GLN  49          2HE2      GLN  49   6.531  11.771  18.993
  349    H    MET  50           H        MET  50   2.288   6.378  17.754
  350    HA   MET  50           HA       MET  50   0.086   8.401  17.762
  351   1HB   MET  50          1HB       MET  50   0.226   5.494  18.630
  352   2HB   MET  50          2HB       MET  50  -1.236   6.481  18.622
  353   1HG   MET  50          1HG       MET  50   0.373   6.278  16.101
  354   2HG   MET  50          2HG       MET  50  -0.655   4.921  16.559
  355   1HE   MET  50          1HE       MET  50  -0.250   7.496  14.483
  356   2HE   MET  50          2HE       MET  50  -0.678   8.840  15.537
  357   3HE   MET  50          3HE       MET  50  -1.749   8.394  14.212
  358   1H    GLY  51          1H        GLY  51 -12.990  -2.313   9.142
  359   2H    GLY  51          2H        GLY  51 -12.344  -3.295  10.369
  360   3H    GLY  51          3H        GLY  51 -13.120  -1.836  10.764
  361   1HA   GLY  51          1HA       GLY  51 -14.561  -3.706  11.242
  362   2HA   GLY  51          2HA       GLY  51 -15.225  -2.706   9.950
  363    H    THR  52           H        THR  52 -14.903  -3.453   7.719
  364    HA   THR  52           HA       THR  52 -15.245  -6.336   7.473
  365    HB   THR  52           HB       THR  52 -14.950  -4.072   5.472
  366    HG1  THR  52           HG1      THR  52 -16.774  -4.187   7.023
  367   1HG2  THR  52          1HG2      THR  52 -15.786  -5.582   3.804
  368   2HG2  THR  52          2HG2      THR  52 -16.091  -6.835   5.007
  369   3HG2  THR  52          3HG2      THR  52 -14.434  -6.394   4.594
  370    HA   PRO  53           HA       PRO  53 -10.978  -7.301   6.827
  371   1HB   PRO  53          1HB       PRO  53 -11.265  -9.692   5.525
  372   2HB   PRO  53          2HB       PRO  53 -11.525  -9.503   7.270
  373   1HG   PRO  53          1HG       PRO  53 -13.514  -9.648   5.054
  374   2HG   PRO  53          2HG       PRO  53 -13.586 -10.343   6.680
  375   1HD   PRO  53          1HD       PRO  53 -14.901  -8.064   5.944
  376   2HD   PRO  53          2HD       PRO  53 -14.378  -8.404   7.607
  377    HA   PRO  54           HA       PRO  54  -9.979  -6.060   2.721
  378   1HB   PRO  54          1HB       PRO  54  -7.694  -7.480   2.198
  379   2HB   PRO  54          2HB       PRO  54  -7.742  -6.091   3.302
  380   1HG   PRO  54          1HG       PRO  54  -7.794  -9.012   3.919
  381   2HG   PRO  54          2HG       PRO  54  -6.916  -7.708   4.731
  382   1HD   PRO  54          1HD       PRO  54  -9.216  -8.758   5.708
  383   2HD   PRO  54          2HD       PRO  54  -8.754  -7.059   5.956
  384    HA   PRO  55           HA       PRO  55 -11.404  -8.979  -0.241
  385   1HB   PRO  55          1HB       PRO  55  -9.826  -8.539  -2.439
  386   2HB   PRO  55          2HB       PRO  55 -11.082  -7.403  -1.905
  387   1HG   PRO  55          1HG       PRO  55  -8.138  -7.300  -1.499
  388   2HG   PRO  55          2HG       PRO  55  -9.276  -5.996  -1.857
  389   1HD   PRO  55          1HD       PRO  55  -8.275  -6.485   0.632
  390   2HD   PRO  55          2HD       PRO  55  -9.859  -5.732   0.344
  391    HA   PRO  56           HA       PRO  56  -8.902 -12.606  -0.129
  392   1HB   PRO  56          1HB       PRO  56  -9.758 -13.963  -2.348
  393   2HB   PRO  56          2HB       PRO  56 -10.736 -13.810  -0.875
  394   1HG   PRO  56          1HG       PRO  56 -10.914 -12.290  -3.430
  395   2HG   PRO  56          2HG       PRO  56 -12.208 -12.895  -2.384
  396   1HD   PRO  56          1HD       PRO  56 -11.401 -10.297  -2.407
  397   2HD   PRO  56          2HD       PRO  56 -12.099 -11.090  -0.979
  398    H    TYR  57           H        TYR  57  -6.733 -12.300  -0.570
  399    HA   TYR  57           HA       TYR  57  -5.572 -10.952  -2.725
  400   1HB   TYR  57          1HB       TYR  57  -4.485 -11.762  -0.617
  401   2HB   TYR  57          2HB       TYR  57  -4.479 -13.392  -1.292
  402    HD1  TYR  57           HD1      TYR  57  -3.250 -13.822  -3.462
  403    HD2  TYR  57           HD2      TYR  57  -2.854 -10.154  -1.266
  404    HE1  TYR  57           HE1      TYR  57  -1.180 -13.292  -4.719
  405    HE2  TYR  57           HE2      TYR  57  -0.784  -9.623  -2.521
  406    HH   TYR  57           HH       TYR  57   0.770 -11.952  -4.557
  407    H    THR  58           H        THR  58  -4.557 -11.705  -4.686
  408    HA   THR  58           HA       THR  58  -5.052 -14.441  -5.643
  409    HB   THR  58           HB       THR  58  -7.228 -13.354  -5.958
  410    HG1  THR  58           HG1      THR  58  -7.346 -13.598  -8.222
  411   1HG2  THR  58          1HG2      THR  58  -7.440 -11.191  -6.554
  412   2HG2  THR  58          2HG2      THR  58  -6.374 -11.397  -7.943
  413   3HG2  THR  58          3HG2      THR  58  -5.694 -11.063  -6.351
  414    H    VAL  59           H        VAL  59  -4.911 -13.498  -8.461
  415    HA   VAL  59           HA       VAL  59  -2.397 -11.977  -8.669
  416    HB   VAL  59           HB       VAL  59  -1.666 -14.236  -8.014
  417   1HG1  VAL  59          1HG1      VAL  59  -3.879 -15.094  -9.390
  418   2HG1  VAL  59          2HG1      VAL  59  -2.560 -16.144  -8.874
  419   3HG1  VAL  59          3HG1      VAL  59  -2.585 -15.501 -10.517
  420   1HG2  VAL  59          1HG2      VAL  59  -0.455 -14.790 -10.285
  421   2HG2  VAL  59          2HG2      VAL  59  -0.074 -13.292  -9.437
  422   3HG2  VAL  59          3HG2      VAL  59  -1.173 -13.270 -10.816
  423    H    GLY  60           H        GLY  60  -3.069 -10.641 -10.325
  424   1HA   GLY  60          1HA       GLY  60  -3.181 -11.256 -12.980
  425   2HA   GLY  60          2HA       GLY  60  -4.818 -11.647 -12.456
  Start of MODEL    3
    1    H    PHE   5           H        PHE   5  -5.779  14.507  -0.556
    2    HA   PHE   5           HA       PHE   5  -3.148  13.300  -0.137
    3   1HB   PHE   5          1HB       PHE   5  -5.421  13.467   1.293
    4   2HB   PHE   5          2HB       PHE   5  -5.699  11.902   0.528
    5    HD1  PHE   5           HD1      PHE   5  -4.304  13.455   3.332
    6    HD2  PHE   5           HD2      PHE   5  -3.488  10.345   0.483
    7    HE1  PHE   5           HE1      PHE   5  -2.745  12.390   4.942
    8    HE2  PHE   5           HE2      PHE   5  -1.929   9.281   2.091
    9    HZ   PHE   5           HZ       PHE   5  -1.558  10.303   4.321
   10    H    GLU   6           H        GLU   6  -2.702  12.848  -2.484
   11    HA   GLU   6           HA       GLU   6  -4.265  10.538  -3.568
   12   1HB   GLU   6          1HB       GLU   6  -3.302  12.982  -4.623
   13   2HB   GLU   6          2HB       GLU   6  -2.331  11.711  -5.368
   14   1HG   GLU   6          1HG       GLU   6  -5.236  11.153  -5.194
   15   2HG   GLU   6          2HG       GLU   6  -4.776  12.457  -6.291
   16    H    ILE   7           H        ILE   7  -3.124   8.937  -2.254
   17    HA   ILE   7           HA       ILE   7  -0.276   8.710  -2.144
   18    HB   ILE   7           HB       ILE   7  -2.558   6.751  -1.798
   19   1HG1  ILE   7          1HG1      ILE   7  -0.764   8.203   0.167
   20   2HG1  ILE   7          2HG1      ILE   7  -2.426   8.650  -0.213
   21   1HG2  ILE   7          1HG2      ILE   7  -0.482   5.703  -0.369
   22   2HG2  ILE   7          2HG2      ILE   7   0.369   6.333  -1.780
   23   3HG2  ILE   7          3HG2      ILE   7  -0.931   5.161  -1.986
   24   1HD1  ILE   7          1HD1      ILE   7  -2.934   6.144   0.423
   25   2HD1  ILE   7          2HD1      ILE   7  -2.730   7.346   1.697
   26   3HD1  ILE   7          3HD1      ILE   7  -1.403   6.260   1.289
   27    HA   PRO   8           HA       PRO   8  -0.632   5.714  -5.829
   28   1HB   PRO   8          1HB       PRO   8  -2.901   5.737  -7.348
   29   2HB   PRO   8          2HB       PRO   8  -2.694   4.678  -5.943
   30   1HG   PRO   8          1HG       PRO   8  -4.237   7.195  -6.214
   31   2HG   PRO   8          2HG       PRO   8  -4.574   5.763  -5.234
   32   1HD   PRO   8          1HD       PRO   8  -3.523   8.136  -4.284
   33   2HD   PRO   8          2HD       PRO   8  -3.420   6.568  -3.463
   34    H    ASP   9           H        ASP   9  -1.161   6.148  -8.453
   35    HA   ASP   9           HA       ASP   9  -0.567   7.571 -10.247
   36   1HB   ASP   9          1HB       ASP   9  -2.749   8.525  -8.891
   37   2HB   ASP   9          2HB       ASP   9  -1.675   9.923  -8.837
   38    H    ASP  10           H        ASP  10   1.214   7.416  -7.735
   39    HA   ASP  10           HA       ASP  10   3.119   9.468  -8.578
   40   1HB   ASP  10          1HB       ASP  10   1.132  10.211  -6.792
   41   2HB   ASP  10          2HB       ASP  10   2.485   9.816  -5.730
   42    H    VAL  11           H        VAL  11   2.304   7.591  -5.623
   43    HA   VAL  11           HA       VAL  11   4.989   6.972  -4.913
   44    HB   VAL  11           HB       VAL  11   3.859   5.297  -3.485
   45   1HG1  VAL  11          1HG1      VAL  11   3.664   7.347  -2.441
   46   2HG1  VAL  11          2HG1      VAL  11   1.955   6.995  -2.699
   47   3HG1  VAL  11          3HG1      VAL  11   2.809   8.072  -3.803
   48   1HG2  VAL  11          1HG2      VAL  11   2.203   4.250  -4.710
   49   2HG2  VAL  11          2HG2      VAL  11   1.699   5.745  -5.497
   50   3HG2  VAL  11          3HG2      VAL  11   1.220   5.421  -3.831
   51    HA   PRO  12           HA       PRO  12   5.678   3.985  -8.186
   52   1HB   PRO  12          1HB       PRO  12   8.191   3.226  -7.419
   53   2HB   PRO  12          2HB       PRO  12   7.857   4.735  -8.288
   54   1HG   PRO  12          1HG       PRO  12   8.350   4.281  -5.385
   55   2HG   PRO  12          2HG       PRO  12   8.889   5.607  -6.425
   56   1HD   PRO  12          1HD       PRO  12   6.786   5.795  -4.689
   57   2HD   PRO  12          2HD       PRO  12   6.933   6.767  -6.169
   58    H    LEU  13           H        LEU  13   5.270   3.414  -4.872
   59    HA   LEU  13           HA       LEU  13   4.763   1.485  -3.629
   60   1HB   LEU  13          1HB       LEU  13   4.354   0.594  -6.490
   61   2HB   LEU  13          2HB       LEU  13   4.029  -0.474  -5.131
   62    HG   LEU  13           HG       LEU  13   2.803   2.267  -5.543
   63   1HD1  LEU  13          1HD1      LEU  13   1.046  -0.070  -5.436
   64   2HD1  LEU  13          2HD1      LEU  13   2.172  -0.135  -6.792
   65   3HD1  LEU  13          3HD1      LEU  13   1.089   1.245  -6.611
   66   1HD2  LEU  13          1HD2      LEU  13   1.391   0.682  -3.668
   67   2HD2  LEU  13          2HD2      LEU  13   2.305   2.154  -3.350
   68   3HD2  LEU  13          3HD2      LEU  13   3.092   0.580  -3.225
   69    HA   PRO  14           HA       PRO  14   8.613  -0.677  -3.561
   70   1HB   PRO  14          1HB       PRO  14   8.082  -2.396  -1.502
   71   2HB   PRO  14          2HB       PRO  14   8.420  -0.673  -1.270
   72   1HG   PRO  14          1HG       PRO  14   5.879  -2.132  -1.080
   73   2HG   PRO  14          2HG       PRO  14   6.368  -0.614  -0.330
   74   1HD   PRO  14          1HD       PRO  14   4.709  -0.958  -2.601
   75   2HD   PRO  14          2HD       PRO  14   5.322   0.568  -1.946
   76    H    ALA  15           H        ALA  15   9.399  -3.074  -3.570
   77    HA   ALA  15           HA       ALA  15   8.225  -4.456  -5.783
   78   1HB   ALA  15          1HB       ALA  15  10.580  -4.471  -4.420
   79   2HB   ALA  15          2HB       ALA  15  10.110  -5.736  -5.556
   80   3HB   ALA  15          3HB       ALA  15   9.862  -5.968  -3.826
   81    H    GLY  16           H        GLY  16   6.904  -6.319  -5.845
   82   1HA   GLY  16          1HA       GLY  16   5.183  -7.718  -5.135
   83   2HA   GLY  16          2HA       GLY  16   6.170  -7.982  -3.708
   84    H    TRP  17           H        TRP  17   4.743  -4.931  -4.787
   85    HA   TRP  17           HA       TRP  17   2.814  -5.066  -2.528
   86   1HB   TRP  17          1HB       TRP  17   5.201  -3.309  -2.866
   87   2HB   TRP  17          2HB       TRP  17   3.755  -2.586  -2.161
   88    HD1  TRP  17           HD1      TRP  17   6.746  -4.335  -1.118
   89    HE1  TRP  17           HE1      TRP  17   6.449  -5.409   1.211
   90    HE3  TRP  17           HE3      TRP  17   1.686  -4.101  -0.694
   91    HZ2  TRP  17           HZ2      TRP  17   4.320  -6.081   3.014
   92    HZ3  TRP  17           HZ3      TRP  17   0.533  -4.956   1.321
   93    HH2  TRP  17           HH2      TRP  17   1.846  -5.952   3.180
   94    H    GLU  18           H        GLU  18   1.569  -5.310  -4.688
   95    HA   GLU  18           HA       GLU  18   1.181  -2.875  -6.298
   96   1HB   GLU  18          1HB       GLU  18   0.879  -5.567  -6.688
   97   2HB   GLU  18          2HB       GLU  18  -0.780  -5.110  -6.314
   98   1HG   GLU  18          1HG       GLU  18  -0.246  -5.053  -8.762
   99   2HG   GLU  18          2HG       GLU  18  -0.831  -3.519  -8.128
  100    H    MET  19           H        MET  19  -1.508  -2.751  -6.562
  101    HA   MET  19           HA       MET  19  -2.921  -2.751  -4.044
  102   1HB   MET  19          1HB       MET  19  -2.993  -0.344  -3.722
  103   2HB   MET  19          2HB       MET  19  -1.321  -0.893  -3.735
  104   1HG   MET  19          1HG       MET  19  -0.866   0.090  -5.782
  105   2HG   MET  19          2HG       MET  19  -2.534  -0.035  -6.333
  106   1HE   MET  19          1HE       MET  19  -0.262   2.584  -6.187
  107   2HE   MET  19          2HE       MET  19   0.165   1.784  -4.678
  108   3HE   MET  19          3HE       MET  19  -0.408   3.447  -4.650
  109    H    ALA  20           H        ALA  20  -5.094  -2.262  -4.298
  110    HA   ALA  20           HA       ALA  20  -6.063  -1.338  -6.932
  111   1HB   ALA  20          1HB       ALA  20  -7.044  -3.969  -5.877
  112   2HB   ALA  20          2HB       ALA  20  -5.470  -3.918  -6.673
  113   3HB   ALA  20          3HB       ALA  20  -6.917  -3.417  -7.548
  114    H    LYS  21           H        LYS  21  -8.453  -0.957  -6.818
  115    HA   LYS  21           HA       LYS  21  -9.234  -0.201  -4.054
  116   1HB   LYS  21          1HB       LYS  21 -10.480   0.408  -6.753
  117   2HB   LYS  21          2HB       LYS  21 -10.864   1.204  -5.228
  118   1HG   LYS  21          1HG       LYS  21  -8.058   1.363  -5.492
  119   2HG   LYS  21          2HG       LYS  21  -8.713   1.768  -7.078
  120   1HD   LYS  21          1HD       LYS  21  -9.856   2.982  -4.565
  121   2HD   LYS  21          2HD       LYS  21  -8.450   3.689  -5.359
  122   1HE   LYS  21          1HE       LYS  21  -9.754   3.858  -7.477
  123   2HE   LYS  21          2HE       LYS  21 -11.173   3.213  -6.630
  124   1HZ   LYS  21          1HZ       LYS  21 -11.122   5.022  -5.105
  125   2HZ   LYS  21          2HZ       LYS  21 -11.016   5.701  -6.658
  126   3HZ   LYS  21          3HZ       LYS  21  -9.627   5.570  -5.688
  127    H    THR  22           H        THR  22 -10.150  -2.001  -3.049
  128    HA   THR  22           HA       THR  22 -11.916  -3.836  -4.490
  129    HB   THR  22           HB       THR  22 -10.424  -4.507  -2.620
  130    HG1  THR  22           HG1      THR  22 -12.359  -5.659  -3.033
  131   1HG2  THR  22          1HG2      THR  22 -11.175  -3.879  -0.293
  132   2HG2  THR  22          2HG2      THR  22 -12.239  -2.684  -1.032
  133   3HG2  THR  22          3HG2      THR  22 -10.492  -2.546  -1.223
  134    H    SER  23           H        SER  23 -14.217  -4.097  -3.893
  135    HA   SER  23           HA       SER  23 -16.384  -3.248  -3.499
  136   1HB   SER  23          1HB       SER  23 -14.601  -2.391  -1.346
  137   2HB   SER  23          2HB       SER  23 -15.962  -1.291  -1.556
  138    HG   SER  23           HG       SER  23 -17.327  -3.154  -1.495
  139    H    SER  24           H        SER  24 -14.794  -0.187  -2.652
  140    HA   SER  24           HA       SER  24 -15.904   0.984  -5.184
  141   1HB   SER  24          1HB       SER  24 -16.183   1.655  -2.311
  142   2HB   SER  24          2HB       SER  24 -15.952   3.029  -3.392
  143    HG   SER  24           HG       SER  24 -17.828   0.980  -3.901
  144    H    GLY  25           H        GLY  25 -13.997   2.524  -2.612
  145   1HA   GLY  25          1HA       GLY  25 -11.804   2.927  -4.613
  146   2HA   GLY  25          2HA       GLY  25 -12.327   4.209  -3.525
  147    H    GLN  26           H        GLN  26 -12.248   0.979  -2.273
  148    HA   GLN  26           HA       GLN  26 -10.342   1.702  -0.218
  149   1HB   GLN  26          1HB       GLN  26 -11.670  -0.834  -1.185
  150   2HB   GLN  26          2HB       GLN  26 -10.531  -0.851   0.161
  151   1HG   GLN  26          1HG       GLN  26 -11.907   0.585   1.473
  152   2HG   GLN  26          2HG       GLN  26 -12.897   1.030   0.083
  153   1HE2  GLN  26          1HE2      GLN  26 -14.935   0.139   0.553
  154   2HE2  GLN  26          2HE2      GLN  26 -15.197  -1.481   0.984
  155    H    ARG  27           H        ARG  27  -8.541   2.415  -1.681
  156    HA   ARG  27           HA       ARG  27  -7.204   0.655  -3.508
  157   1HB   ARG  27          1HB       ARG  27  -5.361   2.319  -3.203
  158   2HB   ARG  27          2HB       ARG  27  -6.924   3.087  -3.469
  159   1HG   ARG  27          1HG       ARG  27  -6.953   4.000  -1.393
  160   2HG   ARG  27          2HG       ARG  27  -6.363   2.512  -0.645
  161   1HD   ARG  27          1HD       ARG  27  -4.276   3.363  -0.528
  162   2HD   ARG  27          2HD       ARG  27  -4.281   3.677  -2.272
  163    HE   ARG  27           HE       ARG  27  -4.876   5.623  -0.178
  164   1HH1  ARG  27          1HH1      ARG  27  -5.527   4.672  -3.461
  165   2HH1  ARG  27          2HH1      ARG  27  -5.993   6.264  -3.946
  166   1HH2  ARG  27          1HH2      ARG  27  -5.481   7.682  -0.833
  167   2HH2  ARG  27          2HH2      ARG  27  -5.966   7.958  -2.472
  168    H    TYR  28           H        TYR  28  -7.303  -1.316  -2.004
  169    HA   TYR  28           HA       TYR  28  -5.473  -1.367   0.272
  170   1HB   TYR  28          1HB       TYR  28  -6.156  -3.689   0.416
  171   2HB   TYR  28          2HB       TYR  28  -7.575  -2.719   0.042
  172    HD1  TYR  28           HD1      TYR  28  -5.229  -5.253  -1.200
  173    HD2  TYR  28           HD2      TYR  28  -8.567  -2.757  -2.220
  174    HE1  TYR  28           HE1      TYR  28  -5.704  -6.676  -3.168
  175    HE2  TYR  28           HE2      TYR  28  -9.023  -4.168  -4.197
  176    HH   TYR  28           HH       TYR  28  -8.444  -6.800  -4.746
  177    H    PHE  29           H        PHE  29  -3.330  -1.886   0.201
  178    HA   PHE  29           HA       PHE  29  -2.077  -2.243  -2.414
  179   1HB   PHE  29          1HB       PHE  29  -1.055  -2.073   0.431
  180   2HB   PHE  29          2HB       PHE  29  -0.009  -2.134  -0.991
  181    HD1  PHE  29           HD1      PHE  29  -2.645  -0.148   0.718
  182    HD2  PHE  29           HD2      PHE  29   0.272  -0.254  -2.425
  183    HE1  PHE  29           HE1      PHE  29  -2.952   2.279   0.351
  184    HE2  PHE  29           HE2      PHE  29  -0.030   2.176  -2.789
  185    HZ   PHE  29           HZ       PHE  29  -1.647   3.444  -1.407
  186    H    LYS  30           H        LYS  30  -1.893  -4.168  -3.327
  187    HA   LYS  30           HA       LYS  30  -2.212  -6.683  -1.908
  188   1HB   LYS  30          1HB       LYS  30  -1.477  -5.829  -4.704
  189   2HB   LYS  30          2HB       LYS  30  -1.720  -7.514  -4.258
  190   1HG   LYS  30          1HG       LYS  30  -3.916  -6.057  -3.248
  191   2HG   LYS  30          2HG       LYS  30  -3.655  -5.480  -4.884
  192   1HD   LYS  30          1HD       LYS  30  -3.315  -8.239  -5.099
  193   2HD   LYS  30          2HD       LYS  30  -4.672  -8.073  -3.986
  194   1HE   LYS  30          1HE       LYS  30  -5.346  -6.212  -5.869
  195   2HE   LYS  30          2HE       LYS  30  -4.509  -7.413  -6.870
  196   1HZ   LYS  30          1HZ       LYS  30  -6.556  -8.104  -4.830
  197   2HZ   LYS  30          2HZ       LYS  30  -5.867  -9.139  -5.988
  198   3HZ   LYS  30          3HZ       LYS  30  -6.919  -7.896  -6.474
  199    H    ASN  31           H        ASN  31  -0.590  -8.102  -1.354
  200    HA   ASN  31           HA       ASN  31   2.229  -7.152  -1.716
  201   1HB   ASN  31          1HB       ASN  31   0.990  -7.411   0.575
  202   2HB   ASN  31          2HB       ASN  31   1.258  -9.137   0.332
  203   1HD2  ASN  31          1HD2      ASN  31   2.708  -8.829   2.336
  204   2HD2  ASN  31          2HD2      ASN  31   4.305  -8.319   2.077
  205    H    HIS  32           H        HIS  32   3.229  -8.348  -3.348
  206    HA   HIS  32           HA       HIS  32   2.326 -11.147  -3.804
  207   1HB   HIS  32          1HB       HIS  32   4.322  -9.394  -5.273
  208   2HB   HIS  32          2HB       HIS  32   3.670 -10.924  -5.850
  209    HD1  HIS  32           HD1      HIS  32   1.078 -10.973  -6.415
  210    HD2  HIS  32           HD2      HIS  32   2.616  -7.175  -5.646
  211    HE1  HIS  32           HE1      HIS  32  -0.670  -9.318  -7.203
  212    H    ILE  33           H        ILE  33   5.035  -9.306  -2.546
  213    HA   ILE  33           HA       ILE  33   7.004 -11.402  -2.494
  214    HB   ILE  33           HB       ILE  33   7.901  -9.975  -0.549
  215   1HG1  ILE  33          1HG1      ILE  33   5.784  -7.978  -1.357
  216   2HG1  ILE  33          2HG1      ILE  33   5.479  -9.136  -0.062
  217   1HG2  ILE  33          1HG2      ILE  33   7.601  -9.343  -3.363
  218   2HG2  ILE  33          2HG2      ILE  33   9.000  -9.130  -2.310
  219   3HG2  ILE  33          3HG2      ILE  33   7.759  -7.879  -2.391
  220   1HD1  ILE  33          1HD1      ILE  33   6.449  -7.520   1.231
  221   2HD1  ILE  33          2HD1      ILE  33   7.314  -6.809  -0.131
  222   3HD1  ILE  33          3HD1      ILE  33   7.945  -8.256   0.656
  223    H    ASP  34           H        ASP  34   4.203 -10.661  -0.548
  224    HA   ASP  34           HA       ASP  34   4.772 -13.068   1.149
  225   1HB   ASP  34          1HB       ASP  34   4.965 -10.599   2.083
  226   2HB   ASP  34          2HB       ASP  34   3.205 -10.704   2.136
  227    H    GLN  35           H        GLN  35   2.769 -11.807  -1.201
  228    HA   GLN  35           HA       GLN  35   0.596 -12.344  -1.935
  229   1HB   GLN  35          1HB       GLN  35   1.200 -14.690  -0.104
  230   2HB   GLN  35          2HB       GLN  35  -0.058 -14.665  -1.341
  231   1HG   GLN  35          1HG       GLN  35   2.661 -13.894  -2.247
  232   2HG   GLN  35          2HG       GLN  35   2.453 -15.586  -1.797
  233   1HE2  GLN  35          1HE2      GLN  35   0.423 -16.662  -2.835
  234   2HE2  GLN  35          2HE2      GLN  35   0.050 -16.212  -4.430
  235    H    THR  36           H        THR  36  -0.198 -10.453  -0.597
  236    HA   THR  36           HA       THR  36  -2.392 -11.274   1.125
  237    HB   THR  36           HB       THR  36  -1.162  -9.726   2.998
  238    HG1  THR  36           HG1      THR  36   1.018 -10.563   3.054
  239   1HG2  THR  36          1HG2      THR  36  -1.420 -11.610   4.201
  240   2HG2  THR  36          2HG2      THR  36  -0.243 -12.479   3.217
  241   3HG2  THR  36          3HG2      THR  36  -1.927 -12.390   2.703
  242    H    THR  37           H        THR  37  -3.942  -9.688   1.014
  243    HA   THR  37           HA       THR  37  -3.215  -7.081  -0.224
  244    HB   THR  37           HB       THR  37  -5.728  -6.937  -0.426
  245    HG1  THR  37           HG1      THR  37  -5.980  -8.334   1.490
  246   1HG2  THR  37          1HG2      THR  37  -4.071  -8.225  -2.018
  247   2HG2  THR  37          2HG2      THR  37  -5.813  -8.388  -2.239
  248   3HG2  THR  37          3HG2      THR  37  -4.908  -9.649  -1.403
  249    H    THR  38           H        THR  38  -3.142  -5.216   1.026
  250    HA   THR  38           HA       THR  38  -4.401  -5.329   3.749
  251    HB   THR  38           HB       THR  38  -1.931  -5.712   3.749
  252    HG1  THR  38           HG1      THR  38  -2.148  -4.748   5.581
  253   1HG2  THR  38          1HG2      THR  38  -1.275  -4.443   1.803
  254   2HG2  THR  38          2HG2      THR  38  -0.497  -3.711   3.204
  255   3HG2  THR  38          3HG2      THR  38  -1.923  -2.956   2.492
  256    H    TRP  39           H        TRP  39  -4.839  -3.161   4.660
  257    HA   TRP  39           HA       TRP  39  -5.884  -1.322   2.641
  258   1HB   TRP  39          1HB       TRP  39  -5.820  -1.170   5.669
  259   2HB   TRP  39          2HB       TRP  39  -6.873  -0.242   4.603
  260    HD1  TRP  39           HD1      TRP  39  -6.319  -3.781   5.942
  261    HE1  TRP  39           HE1      TRP  39  -8.462  -5.156   5.550
  262    HE3  TRP  39           HE3      TRP  39  -8.997  -0.462   3.131
  263    HZ2  TRP  39           HZ2      TRP  39 -10.976  -4.885   4.223
  264    HZ3  TRP  39           HZ3      TRP  39 -11.263  -1.050   2.317
  265    HH2  TRP  39           HH2      TRP  39 -12.252  -3.259   2.859
  266    H    GLN  40           H        GLN  40  -3.602  -1.091   5.387
  267    HA   GLN  40           HA       GLN  40  -2.740   1.549   5.140
  268   1HB   GLN  40          1HB       GLN  40  -0.633   0.669   6.147
  269   2HB   GLN  40          2HB       GLN  40  -2.071  -0.018   6.902
  270   1HG   GLN  40          1HG       GLN  40  -1.855  -1.984   5.337
  271   2HG   GLN  40          2HG       GLN  40  -0.309  -1.320   4.806
  272   1HE2  GLN  40          1HE2      GLN  40  -1.930  -3.036   7.396
  273   2HE2  GLN  40          2HE2      GLN  40  -0.562  -3.248   8.377
  274    H    ASP  41           H        ASP  41  -0.605   2.324   4.213
  275    HA   ASP  41           HA       ASP  41  -0.270   1.260   1.440
  276   1HB   ASP  41          1HB       ASP  41   0.508   3.918   2.683
  277   2HB   ASP  41          2HB       ASP  41   0.544   3.524   0.965
  278    HA   PRO  42           HA       PRO  42   3.756  -0.054   2.866
  279   1HB   PRO  42          1HB       PRO  42   4.671  -1.029   0.492
  280   2HB   PRO  42          2HB       PRO  42   3.499  -1.893   1.499
  281   1HG   PRO  42          1HG       PRO  42   3.085  -0.337  -0.988
  282   2HG   PRO  42          2HG       PRO  42   2.227  -1.763  -0.390
  283   1HD   PRO  42          1HD       PRO  42   1.314   0.864  -0.247
  284   2HD   PRO  42          2HD       PRO  42   0.697  -0.500   0.706
  285    H    ARG  43           H        ARG  43   3.676   2.681   2.577
  286    HA   ARG  43           HA       ARG  43   6.322   3.382   1.731
  287   1HB   ARG  43          1HB       ARG  43   4.455   3.032  -0.354
  288   2HB   ARG  43          2HB       ARG  43   4.622   4.777  -0.167
  289   1HG   ARG  43          1HG       ARG  43   6.922   4.734  -0.626
  290   2HG   ARG  43          2HG       ARG  43   7.069   3.026  -0.213
  291   1HD   ARG  43          1HD       ARG  43   5.714   2.452  -2.235
  292   2HD   ARG  43          2HD       ARG  43   5.691   4.171  -2.671
  293    HE   ARG  43           HE       ARG  43   7.980   2.381  -2.913
  294   1HH1  ARG  43          1HH1      ARG  43   6.969   5.663  -2.333
  295   2HH1  ARG  43          2HH1      ARG  43   8.464   6.336  -2.885
  296   1HH2  ARG  43          1HH2      ARG  43   9.910   3.280  -3.625
  297   2HH2  ARG  43          2HH2      ARG  43  10.116   5.000  -3.611
  298    H    LYS  44           H        LYS  44   3.261   5.139   1.181
  299    HA   LYS  44           HA       LYS  44   4.174   7.469   2.644
  300   1HB   LYS  44          1HB       LYS  44   2.556   7.332   0.690
  301   2HB   LYS  44          2HB       LYS  44   1.363   6.692   1.820
  302   1HG   LYS  44          1HG       LYS  44   0.952   8.739   2.689
  303   2HG   LYS  44          2HG       LYS  44   2.672   9.102   2.833
  304   1HD   LYS  44          1HD       LYS  44   1.488   9.078   0.091
  305   2HD   LYS  44          2HD       LYS  44   1.097  10.443   1.137
  306   1HE   LYS  44          1HE       LYS  44   3.909   9.904   1.376
  307   2HE   LYS  44          2HE       LYS  44   3.496  10.034  -0.344
  308   1HZ   LYS  44          1HZ       LYS  44   3.913  12.207   0.844
  309   2HZ   LYS  44          2HZ       LYS  44   2.480  11.921   1.712
  310   3HZ   LYS  44          3HZ       LYS  44   2.433  12.099   0.023
  311    H    ALA  45           H        ALA  45   2.596   4.517   3.560
  312    HA   ALA  45           HA       ALA  45   1.756   5.720   6.172
  313   1HB   ALA  45          1HB       ALA  45   0.181   4.471   4.522
  314   2HB   ALA  45          2HB       ALA  45   0.113   4.015   6.224
  315   3HB   ALA  45          3HB       ALA  45   0.999   3.011   5.077
  316    H    MET  46           H        MET  46   4.129   5.580   6.795
  317    HA   MET  46           HA       MET  46   4.638   3.029   8.175
  318   1HB   MET  46          1HB       MET  46   5.424   3.000   5.673
  319   2HB   MET  46          2HB       MET  46   6.736   4.025   6.258
  320   1HG   MET  46          1HG       MET  46   7.625   1.860   6.488
  321   2HG   MET  46          2HG       MET  46   7.013   2.205   8.106
  322   1HE   MET  46          1HE       MET  46   4.710   0.572   9.175
  323   2HE   MET  46          2HE       MET  46   6.470   0.656   9.214
  324   3HE   MET  46          3HE       MET  46   5.676  -0.875   8.854
  325    H    LEU  47           H        LEU  47   5.982   6.188   7.183
  326    HA   LEU  47           HA       LEU  47   6.758   6.695  10.005
  327   1HB   LEU  47          1HB       LEU  47   8.647   5.538   8.861
  328   2HB   LEU  47          2HB       LEU  47   8.670   6.820   7.650
  329    HG   LEU  47           HG       LEU  47   8.719   8.187  10.082
  330   1HD1  LEU  47          1HD1      LEU  47  10.982   6.877  10.846
  331   2HD1  LEU  47          2HD1      LEU  47   9.990   5.522  10.309
  332   3HD1  LEU  47          3HD1      LEU  47   9.400   6.600  11.574
  333   1HD2  LEU  47          1HD2      LEU  47  11.089   8.651   9.430
  334   2HD2  LEU  47          2HD2      LEU  47   9.967   8.811   8.078
  335   3HD2  LEU  47          3HD2      LEU  47  10.973   7.370   8.223
  336    H    SER  48           H        SER  48   4.717   7.885   8.332
  337    HA   SER  48           HA       SER  48   5.870  10.615   7.855
  338   1HB   SER  48          1HB       SER  48   3.989  10.828   6.239
  339   2HB   SER  48          2HB       SER  48   5.021   9.450   5.857
  340    HG   SER  48           HG       SER  48   3.211   8.394   5.926
  341    H    GLN  49           H        GLN  49   4.934   9.609  10.459
  342    HA   GLN  49           HA       GLN  49   3.516  10.288  12.226
  343   1HB   GLN  49          1HB       GLN  49   4.564  12.433  11.058
  344   2HB   GLN  49          2HB       GLN  49   2.887  12.727  10.599
  345   1HG   GLN  49          1HG       GLN  49   2.179  12.706  12.909
  346   2HG   GLN  49          2HG       GLN  49   3.771  12.167  13.443
  347   1HE2  GLN  49          1HE2      GLN  49   1.858  14.934  13.022
  348   2HE2  GLN  49          2HE2      GLN  49   3.095  16.098  13.039
  349    H    MET  50           H        MET  50   2.072   8.481  11.131
  350    HA   MET  50           HA       MET  50  -0.588   9.727  10.549
  351   1HB   MET  50          1HB       MET  50   0.459   9.052   8.444
  352   2HB   MET  50          2HB       MET  50   0.799   7.450   9.097
  353   1HG   MET  50          1HG       MET  50  -1.496   6.859   9.144
  354   2HG   MET  50          2HG       MET  50  -2.016   8.536   8.975
  355   1HE   MET  50          1HE       MET  50  -3.633   7.112   6.610
  356   2HE   MET  50          2HE       MET  50  -2.850   5.991   7.722
  357   3HE   MET  50          3HE       MET  50  -2.606   5.813   5.986
  358   1H    GLY  51          1H        GLY  51 -14.585  -4.811  11.935
  359   2H    GLY  51          2H        GLY  51 -14.652  -3.173  12.381
  360   3H    GLY  51          3H        GLY  51 -13.166  -3.881  11.959
  361   1HA   GLY  51          1HA       GLY  51 -15.397  -3.057  10.230
  362   2HA   GLY  51          2HA       GLY  51 -13.667  -2.765  10.034
  363    H    THR  52           H        THR  52 -14.990  -3.758   7.865
  364    HA   THR  52           HA       THR  52 -14.998  -6.665   7.758
  365    HB   THR  52           HB       THR  52 -16.403  -5.180   6.358
  366    HG1  THR  52           HG1      THR  52 -16.154  -7.032   5.323
  367   1HG2  THR  52          1HG2      THR  52 -14.243  -4.457   4.512
  368   2HG2  THR  52          2HG2      THR  52 -14.089  -3.696   6.096
  369   3HG2  THR  52          3HG2      THR  52 -15.557  -3.467   5.147
  370    HA   PRO  53           HA       PRO  53 -10.693  -7.249   6.980
  371   1HB   PRO  53          1HB       PRO  53 -10.781  -9.627   5.628
  372   2HB   PRO  53          2HB       PRO  53 -11.036  -9.500   7.378
  373   1HG   PRO  53          1HG       PRO  53 -13.031  -9.774   5.181
  374   2HG   PRO  53          2HG       PRO  53 -13.019 -10.510   6.790
  375   1HD   PRO  53          1HD       PRO  53 -14.542  -8.342   6.124
  376   2HD   PRO  53          2HD       PRO  53 -13.969  -8.669   7.772
  377    HA   PRO  54           HA       PRO  54  -9.762  -5.923   2.887
  378   1HB   PRO  54          1HB       PRO  54  -7.555  -7.394   2.187
  379   2HB   PRO  54          2HB       PRO  54  -7.504  -6.061   3.357
  380   1HG   PRO  54          1HG       PRO  54  -7.648  -9.007   3.837
  381   2HG   PRO  54          2HG       PRO  54  -6.671  -7.781   4.660
  382   1HD   PRO  54          1HD       PRO  54  -8.955  -8.772   5.720
  383   2HD   PRO  54          2HD       PRO  54  -8.425  -7.096   5.994
  384    HA   PRO  55           HA       PRO  55 -11.435  -8.602  -0.168
  385   1HB   PRO  55          1HB       PRO  55  -9.899  -8.150  -2.393
  386   2HB   PRO  55          2HB       PRO  55 -11.069  -6.970  -1.769
  387   1HG   PRO  55          1HG       PRO  55  -8.112  -7.064  -1.425
  388   2HG   PRO  55          2HG       PRO  55  -9.169  -5.678  -1.725
  389   1HD   PRO  55          1HD       PRO  55  -8.179  -6.280   0.728
  390   2HD   PRO  55          2HD       PRO  55  -9.747  -5.477   0.491
  391    HA   PRO  56           HA       PRO  56  -9.166 -12.372  -0.349
  392   1HB   PRO  56          1HB       PRO  56 -10.064 -13.509  -2.673
  393   2HB   PRO  56          2HB       PRO  56 -11.056 -13.401  -1.206
  394   1HG   PRO  56          1HG       PRO  56 -11.097 -11.696  -3.646
  395   2HG   PRO  56          2HG       PRO  56 -12.444 -12.288  -2.660
  396   1HD   PRO  56          1HD       PRO  56 -11.469  -9.751  -2.492
  397   2HD   PRO  56          2HD       PRO  56 -12.247 -10.594  -1.135
  398    H    TYR  57           H        TYR  57  -6.977 -12.011  -0.702
  399    HA   TYR  57           HA       TYR  57  -5.737 -10.680  -2.832
  400   1HB   TYR  57          1HB       TYR  57  -4.697 -11.449  -0.705
  401   2HB   TYR  57          2HB       TYR  57  -4.750 -13.108  -1.301
  402    HD1  TYR  57           HD1      TYR  57  -2.982  -9.951  -1.388
  403    HD2  TYR  57           HD2      TYR  57  -3.489 -13.698  -3.425
  404    HE1  TYR  57           HE1      TYR  57  -0.854  -9.577  -2.600
  405    HE2  TYR  57           HE2      TYR  57  -1.359 -13.324  -4.636
  406    HH   TYR  57           HH       TYR  57   0.587 -12.080  -4.586
  407    H    THR  58           H        THR  58  -5.154 -11.247  -4.913
  408    HA   THR  58           HA       THR  58  -5.964 -13.971  -5.852
  409    HB   THR  58           HB       THR  58  -5.829 -11.269  -7.218
  410    HG1  THR  58           HG1      THR  58  -7.902 -13.022  -6.434
  411   1HG2  THR  58          1HG2      THR  58  -5.874 -14.008  -8.299
  412   2HG2  THR  58          2HG2      THR  58  -5.438 -12.493  -9.089
  413   3HG2  THR  58          3HG2      THR  58  -7.134 -12.956  -8.944
  414    H    VAL  59           H        VAL  59  -4.012 -11.743  -7.728
  415    HA   VAL  59           HA       VAL  59  -1.417 -12.737  -6.993
  416    HB   VAL  59           HB       VAL  59  -2.411 -14.817  -7.884
  417   1HG1  VAL  59          1HG1      VAL  59  -3.696 -14.848  -9.744
  418   2HG1  VAL  59          2HG1      VAL  59  -2.496 -13.950 -10.672
  419   3HG1  VAL  59          3HG1      VAL  59  -3.664 -13.086  -9.673
  420   1HG2  VAL  59          1HG2      VAL  59  -0.655 -14.254 -10.146
  421   2HG2  VAL  59          2HG2      VAL  59  -0.421 -15.369  -8.799
  422   3HG2  VAL  59          3HG2      VAL  59   0.021 -13.670  -8.626
  423    H    GLY  60           H        GLY  60  -2.777 -10.238  -7.815
  424   1HA   GLY  60          1HA       GLY  60  -1.589  -8.374  -8.867
  425   2HA   GLY  60          2HA       GLY  60  -0.935  -9.511 -10.045
  Start of MODEL    4
    1    H    PHE   5           H        PHE   5  -5.391  13.397   2.583
    2    HA   PHE   5           HA       PHE   5  -3.170  12.684   2.970
    3   1HB   PHE   5          1HB       PHE   5  -3.818  14.158   4.964
    4   2HB   PHE   5          2HB       PHE   5  -4.078  12.660   5.857
    5    HD1  PHE   5           HD1      PHE   5  -2.287  11.774   7.053
    6    HD2  PHE   5           HD2      PHE   5  -1.505  14.241   3.624
    7    HE1  PHE   5           HE1      PHE   5   0.149  11.608   7.489
    8    HE2  PHE   5           HE2      PHE   5   0.931  14.075   4.061
    9    HZ   PHE   5           HZ       PHE   5   1.758  12.759   5.994
   10    H    GLU   6           H        GLU   6  -5.404  10.623   2.731
   11    HA   GLU   6           HA       GLU   6  -4.438   8.412   4.449
   12   1HB   GLU   6          1HB       GLU   6  -6.690   8.886   2.497
   13   2HB   GLU   6          2HB       GLU   6  -6.333   7.259   3.078
   14   1HG   GLU   6          1HG       GLU   6  -6.370   9.171   5.268
   15   2HG   GLU   6          2HG       GLU   6  -7.896   9.180   4.384
   16    H    ILE   7           H        ILE   7  -2.251   8.391   3.376
   17    HA   ILE   7           HA       ILE   7  -0.721   7.484   1.820
   18    HB   ILE   7           HB       ILE   7  -3.164   5.761   1.284
   19   1HG1  ILE   7          1HG1      ILE   7  -2.545   5.866   3.678
   20   2HG1  ILE   7          2HG1      ILE   7  -2.194   4.276   3.001
   21   1HG2  ILE   7          1HG2      ILE   7  -0.216   5.140   0.934
   22   2HG2  ILE   7          2HG2      ILE   7  -1.304   5.571  -0.386
   23   3HG2  ILE   7          3HG2      ILE   7  -1.571   4.087   0.528
   24   1HD1  ILE   7          1HD1      ILE   7   0.175   5.086   2.596
   25   2HD1  ILE   7          2HD1      ILE   7  -0.270   4.928   4.295
   26   3HD1  ILE   7          3HD1      ILE   7  -0.231   6.520   3.538
   27    HA   PRO   8           HA       PRO   8  -2.396   9.895  -1.677
   28   1HB   PRO   8          1HB       PRO   8   0.014  10.966  -2.412
   29   2HB   PRO   8          2HB       PRO   8  -1.003  11.657  -1.133
   30   1HG   PRO   8          1HG       PRO   8   1.414   9.927  -0.917
   31   2HG   PRO   8          2HG       PRO   8   0.918  11.300   0.083
   32   1HD   PRO   8          1HD       PRO   8   0.605   8.695   0.833
   33   2HD   PRO   8          2HD       PRO   8  -0.430  10.018   1.409
   34    H    ASP   9           H        ASP   9  -1.786   9.768  -4.047
   35    HA   ASP   9           HA       ASP   9  -0.792   7.046  -4.686
   36   1HB   ASP   9          1HB       ASP   9  -2.967   8.133  -5.515
   37   2HB   ASP   9          2HB       ASP   9  -1.945   9.146  -6.535
   38    H    ASP  10           H        ASP  10   1.045   9.316  -3.897
   39    HA   ASP  10           HA       ASP  10   2.541   9.727  -6.451
   40   1HB   ASP  10          1HB       ASP  10   1.794  11.582  -4.800
   41   2HB   ASP  10          2HB       ASP  10   3.085  10.984  -3.759
   42    H    VAL  11           H        VAL  11   2.508   7.178  -4.812
   43    HA   VAL  11           HA       VAL  11   5.429   7.082  -4.127
   44    HB   VAL  11           HB       VAL  11   3.162   5.368  -3.054
   45   1HG1  VAL  11          1HG1      VAL  11   5.015   4.151  -2.486
   46   2HG1  VAL  11          2HG1      VAL  11   5.106   5.329  -1.178
   47   3HG1  VAL  11          3HG1      VAL  11   6.095   5.538  -2.621
   48   1HG2  VAL  11          1HG2      VAL  11   4.445   7.875  -1.927
   49   2HG2  VAL  11          2HG2      VAL  11   3.435   6.782  -0.982
   50   3HG2  VAL  11          3HG2      VAL  11   2.748   7.652  -2.354
   51    HA   PRO  12           HA       PRO  12   5.483   4.182  -7.523
   52   1HB   PRO  12          1HB       PRO  12   8.042   3.268  -7.179
   53   2HB   PRO  12          2HB       PRO  12   7.661   4.833  -7.922
   54   1HG   PRO  12          1HG       PRO  12   8.536   4.213  -5.139
   55   2HG   PRO  12          2HG       PRO  12   9.012   5.550  -6.197
   56   1HD   PRO  12          1HD       PRO  12   7.200   5.808  -4.182
   57   2HD   PRO  12          2HD       PRO  12   7.164   6.800  -5.654
   58    H    LEU  13           H        LEU  13   5.558   3.454  -4.213
   59    HA   LEU  13           HA       LEU  13   5.104   1.492  -3.014
   60   1HB   LEU  13          1HB       LEU  13   4.025   1.148  -5.733
   61   2HB   LEU  13          2HB       LEU  13   4.351  -0.374  -4.910
   62    HG   LEU  13           HG       LEU  13   2.042   0.479  -4.490
   63   1HD1  LEU  13          1HD1      LEU  13   3.790   0.527  -2.016
   64   2HD1  LEU  13          2HD1      LEU  13   3.262  -0.941  -2.834
   65   3HD1  LEU  13          3HD1      LEU  13   2.079   0.126  -2.089
   66   1HD2  LEU  13          1HD2      LEU  13   3.350   2.936  -4.228
   67   2HD2  LEU  13          2HD2      LEU  13   2.847   2.530  -2.587
   68   3HD2  LEU  13          3HD2      LEU  13   1.651   2.615  -3.880
   69    HA   PRO  14           HA       PRO  14   8.819  -0.824  -3.531
   70   1HB   PRO  14          1HB       PRO  14   8.456  -2.619  -1.496
   71   2HB   PRO  14          2HB       PRO  14   8.900  -0.923  -1.243
   72   1HG   PRO  14          1HG       PRO  14   6.360  -2.278  -0.741
   73   2HG   PRO  14          2HG       PRO  14   6.968  -0.758  -0.094
   74   1HD   PRO  14          1HD       PRO  14   5.071  -1.160  -2.197
   75   2HD   PRO  14          2HD       PRO  14   5.665   0.376  -1.545
   76    H    ALA  15           H        ALA  15   9.481  -3.318  -3.561
   77    HA   ALA  15           HA       ALA  15   8.149  -4.532  -5.793
   78   1HB   ALA  15          1HB       ALA  15  10.398  -5.015  -3.971
   79   2HB   ALA  15          2HB       ALA  15  10.282  -5.302  -5.707
   80   3HB   ALA  15          3HB       ALA  15   9.661  -6.500  -4.571
   81    H    GLY  16           H        GLY  16   6.897  -6.493  -5.857
   82   1HA   GLY  16          1HA       GLY  16   5.124  -7.830  -5.159
   83   2HA   GLY  16          2HA       GLY  16   6.115  -8.133  -3.740
   84    H    TRP  17           H        TRP  17   4.747  -5.066  -4.800
   85    HA   TRP  17           HA       TRP  17   2.843  -5.126  -2.528
   86   1HB   TRP  17          1HB       TRP  17   5.275  -3.489  -2.902
   87   2HB   TRP  17          2HB       TRP  17   3.875  -2.676  -2.216
   88    HD1  TRP  17           HD1      TRP  17   6.792  -4.456  -1.098
   89    HE1  TRP  17           HE1      TRP  17   6.446  -5.470   1.253
   90    HE3  TRP  17           HE3      TRP  17   1.734  -4.172  -0.775
   91    HZ2  TRP  17           HZ2      TRP  17   4.277  -6.074   3.036
   92    HZ3  TRP  17           HZ3      TRP  17   0.534  -4.960   1.243
   93    HH2  TRP  17           HH2      TRP  17   1.798  -5.915   3.147
   94    H    GLU  18           H        GLU  18   1.645  -5.369  -4.738
   95    HA   GLU  18           HA       GLU  18   1.323  -2.941  -6.356
   96   1HB   GLU  18          1HB       GLU  18   0.950  -5.630  -6.711
   97   2HB   GLU  18          2HB       GLU  18  -0.702  -5.107  -6.396
   98   1HG   GLU  18          1HG       GLU  18  -0.123  -5.085  -8.821
   99   2HG   GLU  18          2HG       GLU  18  -0.604  -3.504  -8.216
  100    H    MET  19           H        MET  19  -1.363  -2.753  -6.660
  101    HA   MET  19           HA       MET  19  -2.795  -2.650  -4.152
  102   1HB   MET  19          1HB       MET  19  -2.730  -0.275  -3.804
  103   2HB   MET  19          2HB       MET  19  -1.073  -0.839  -3.970
  104   1HG   MET  19          1HG       MET  19  -2.580   0.187  -6.371
  105   2HG   MET  19          2HG       MET  19  -1.779   1.300  -5.270
  106   1HE   MET  19          1HE       MET  19   0.314   1.861  -5.105
  107   2HE   MET  19          2HE       MET  19   0.226   2.275  -6.816
  108   3HE   MET  19          3HE       MET  19   1.650   1.449  -6.188
  109    H    ALA  20           H        ALA  20  -4.962  -2.004  -4.428
  110    HA   ALA  20           HA       ALA  20  -5.893  -1.096  -7.060
  111   1HB   ALA  20          1HB       ALA  20  -5.851  -3.243  -7.823
  112   2HB   ALA  20          2HB       ALA  20  -7.280  -3.468  -6.814
  113   3HB   ALA  20          3HB       ALA  20  -5.687  -3.903  -6.197
  114    H    LYS  21           H        LYS  21  -8.404  -1.117  -7.016
  115    HA   LYS  21           HA       LYS  21  -9.254  -0.214  -4.316
  116   1HB   LYS  21          1HB       LYS  21 -11.131   0.769  -5.635
  117   2HB   LYS  21          2HB       LYS  21  -9.556   1.261  -6.257
  118   1HG   LYS  21          1HG       LYS  21  -9.800   0.058  -8.193
  119   2HG   LYS  21          2HG       LYS  21 -10.698  -1.235  -7.398
  120   1HD   LYS  21          1HD       LYS  21 -12.722  -0.204  -7.714
  121   2HD   LYS  21          2HD       LYS  21 -12.043   1.413  -7.523
  122   1HE   LYS  21          1HE       LYS  21 -12.288   1.547  -9.797
  123   2HE   LYS  21          2HE       LYS  21 -10.832   0.536  -9.854
  124   1HZ   LYS  21          1HZ       LYS  21 -12.639  -0.516 -11.070
  125   2HZ   LYS  21          2HZ       LYS  21 -13.641  -0.439  -9.701
  126   3HZ   LYS  21          3HZ       LYS  21 -12.260  -1.428  -9.692
  127    H    THR  22           H        THR  22 -11.235  -0.989  -3.385
  128    HA   THR  22           HA       THR  22 -11.875  -3.798  -4.115
  129    HB   THR  22           HB       THR  22 -12.865  -3.828  -1.881
  130    HG1  THR  22           HG1      THR  22 -13.778  -1.979  -1.438
  131   1HG2  THR  22          1HG2      THR  22 -10.195  -3.441  -2.422
  132   2HG2  THR  22          2HG2      THR  22 -10.852  -3.888  -0.847
  133   3HG2  THR  22          3HG2      THR  22 -10.514  -2.197  -1.214
  134    H    SER  23           H        SER  23 -14.502  -3.661  -2.898
  135    HA   SER  23           HA       SER  23 -16.223  -3.334  -5.056
  136   1HB   SER  23          1HB       SER  23 -16.343  -3.630  -2.200
  137   2HB   SER  23          2HB       SER  23 -17.588  -2.487  -2.707
  138    HG   SER  23           HG       SER  23 -18.450  -3.995  -4.037
  139    H    SER  24           H        SER  24 -14.899  -0.782  -2.992
  140    HA   SER  24           HA       SER  24 -16.460   1.216  -4.601
  141   1HB   SER  24          1HB       SER  24 -15.748   0.964  -1.699
  142   2HB   SER  24          2HB       SER  24 -15.933   2.579  -2.383
  143    HG   SER  24           HG       SER  24 -17.836   1.035  -1.559
  144    H    GLY  25           H        GLY  25 -13.791   1.756  -2.331
  145   1HA   GLY  25          1HA       GLY  25 -11.818   2.127  -4.449
  146   2HA   GLY  25          2HA       GLY  25 -12.377   3.647  -3.762
  147    H    GLN  26           H        GLN  26 -12.226   0.792  -1.747
  148    HA   GLN  26           HA       GLN  26 -10.504   2.080   0.173
  149   1HB   GLN  26          1HB       GLN  26 -11.454  -0.751  -0.328
  150   2HB   GLN  26          2HB       GLN  26 -10.437  -0.340   1.051
  151   1HG   GLN  26          1HG       GLN  26 -12.091   1.001   2.032
  152   2HG   GLN  26          2HG       GLN  26 -12.936   1.244   0.503
  153   1HE2  GLN  26          1HE2      GLN  26 -14.967   0.440   1.456
  154   2HE2  GLN  26          2HE2      GLN  26 -15.188  -1.214   1.761
  155    H    ARG  27           H        ARG  27  -8.751   2.717  -1.374
  156    HA   ARG  27           HA       ARG  27  -7.166   1.093  -2.962
  157   1HB   ARG  27          1HB       ARG  27  -7.059   3.644  -1.774
  158   2HB   ARG  27          2HB       ARG  27  -5.535   2.866  -1.353
  159   1HG   ARG  27          1HG       ARG  27  -5.482   2.148  -3.854
  160   2HG   ARG  27          2HG       ARG  27  -6.672   3.435  -4.083
  161   1HD   ARG  27          1HD       ARG  27  -4.441   4.332  -2.427
  162   2HD   ARG  27          2HD       ARG  27  -3.891   3.761  -4.014
  163    HE   ARG  27           HE       ARG  27  -6.209   5.280  -4.496
  164   1HH1  ARG  27          1HH1      ARG  27  -3.049   5.778  -3.123
  165   2HH1  ARG  27          2HH1      ARG  27  -2.992   7.446  -3.582
  166   1HH2  ARG  27          1HH2      ARG  27  -6.111   7.446  -5.081
  167   2HH2  ARG  27          2HH2      ARG  27  -4.711   8.384  -4.681
  168    H    TYR  28           H        TYR  28  -6.668  -0.986  -2.267
  169    HA   TYR  28           HA       TYR  28  -5.150  -1.198   0.304
  170   1HB   TYR  28          1HB       TYR  28  -5.978  -3.459   0.426
  171   2HB   TYR  28          2HB       TYR  28  -7.347  -2.420   0.050
  172    HD1  TYR  28           HD1      TYR  28  -8.281  -2.361  -2.258
  173    HD2  TYR  28           HD2      TYR  28  -5.153  -5.085  -1.156
  174    HE1  TYR  28           HE1      TYR  28  -8.792  -3.747  -4.241
  175    HE2  TYR  28           HE2      TYR  28  -5.672  -6.475  -3.136
  176    HH   TYR  28           HH       TYR  28  -7.321  -5.459  -5.712
  177    H    PHE  29           H        PHE  29  -3.043  -1.824   0.151
  178    HA   PHE  29           HA       PHE  29  -1.911  -2.191  -2.528
  179   1HB   PHE  29          1HB       PHE  29  -0.753  -2.062   0.270
  180   2HB   PHE  29          2HB       PHE  29   0.220  -2.104  -1.203
  181    HD1  PHE  29           HD1      PHE  29  -2.177  -0.124   0.792
  182    HD2  PHE  29           HD2      PHE  29   0.281  -0.189  -2.728
  183    HE1  PHE  29           HE1      PHE  29  -2.526   2.312   0.503
  184    HE2  PHE  29           HE2      PHE  29  -0.064   2.247  -3.014
  185    HZ   PHE  29           HZ       PHE  29  -1.469   3.498  -1.400
  186    H    LYS  30           H        LYS  30  -1.828  -4.134  -3.436
  187    HA   LYS  30           HA       LYS  30  -2.226  -6.622  -2.013
  188   1HB   LYS  30          1HB       LYS  30  -1.403  -5.823  -4.799
  189   2HB   LYS  30          2HB       LYS  30  -1.743  -7.491  -4.350
  190   1HG   LYS  30          1HG       LYS  30  -3.873  -5.907  -3.385
  191   2HG   LYS  30          2HG       LYS  30  -3.554  -5.360  -5.020
  192   1HD   LYS  30          1HD       LYS  30  -3.376  -8.150  -5.175
  193   2HD   LYS  30          2HD       LYS  30  -4.767  -7.854  -4.135
  194   1HE   LYS  30          1HE       LYS  30  -5.962  -7.430  -6.020
  195   2HE   LYS  30          2HE       LYS  30  -4.973  -5.973  -6.238
  196   1HZ   LYS  30          1HZ       LYS  30  -3.330  -7.249  -7.397
  197   2HZ   LYS  30          2HZ       LYS  30  -4.831  -7.568  -8.126
  198   3HZ   LYS  30          3HZ       LYS  30  -4.138  -8.705  -7.070
  199    H    ASN  31           H        ASN  31  -0.692  -8.077  -1.378
  200    HA   ASN  31           HA       ASN  31   2.173  -7.248  -1.600
  201   1HB   ASN  31          1HB       ASN  31   0.672  -7.622   0.569
  202   2HB   ASN  31          2HB       ASN  31   1.089  -9.308   0.296
  203   1HD2  ASN  31          1HD2      ASN  31   3.788  -7.683  -0.844
  204   2HD2  ASN  31          2HD2      ASN  31   4.669  -7.600   0.595
  205    H    HIS  32           H        HIS  32   3.201  -8.443  -3.264
  206    HA   HIS  32           HA       HIS  32   2.257 -11.229  -3.751
  207   1HB   HIS  32          1HB       HIS  32   4.283  -9.504  -5.210
  208   2HB   HIS  32          2HB       HIS  32   3.607 -11.021  -5.790
  209    HD1  HIS  32           HD1      HIS  32   1.054 -11.025  -6.439
  210    HD2  HIS  32           HD2      HIS  32   2.584  -7.257  -5.523
  211    HE1  HIS  32           HE1      HIS  32  -0.668  -9.342  -7.227
  212    H    ILE  33           H        ILE  33   5.053  -9.406  -2.589
  213    HA   ILE  33           HA       ILE  33   6.926 -11.592  -2.476
  214    HB   ILE  33           HB       ILE  33   7.975 -10.098  -0.680
  215   1HG1  ILE  33          1HG1      ILE  33   5.870  -8.068  -1.460
  216   2HG1  ILE  33          2HG1      ILE  33   5.620  -9.157  -0.094
  217   1HG2  ILE  33          1HG2      ILE  33   9.001  -9.374  -2.538
  218   2HG2  ILE  33          2HG2      ILE  33   7.801  -8.083  -2.609
  219   3HG2  ILE  33          3HG2      ILE  33   7.538  -9.582  -3.501
  220   1HD1  ILE  33          1HD1      ILE  33   8.155  -8.315   0.417
  221   2HD1  ILE  33          2HD1      ILE  33   6.717  -7.528   1.068
  222   3HD1  ILE  33          3HD1      ILE  33   7.497  -6.884  -0.377
  223    H    ASP  34           H        ASP  34   4.276 -10.537  -0.455
  224    HA   ASP  34           HA       ASP  34   4.838 -12.782   1.458
  225   1HB   ASP  34          1HB       ASP  34   4.758 -10.139   2.002
  226   2HB   ASP  34          2HB       ASP  34   3.043 -10.510   2.165
  227    H    GLN  35           H        GLN  35   2.770 -11.721  -1.019
  228    HA   GLN  35           HA       GLN  35   0.693 -12.501  -1.793
  229   1HB   GLN  35          1HB       GLN  35   2.039 -14.625  -0.325
  230   2HB   GLN  35          2HB       GLN  35   0.287 -14.808  -0.253
  231   1HG   GLN  35          1HG       GLN  35   0.169 -15.383  -2.437
  232   2HG   GLN  35          2HG       GLN  35   1.211 -14.046  -2.919
  233   1HE2  GLN  35          1HE2      GLN  35   3.190 -14.705  -3.762
  234   2HE2  GLN  35          2HE2      GLN  35   3.969 -16.170  -3.400
  235    H    THR  36           H        THR  36  -0.320 -10.620  -0.652
  236    HA   THR  36           HA       THR  36  -2.565 -11.388   0.952
  237    HB   THR  36           HB       THR  36  -1.362  -9.865   2.935
  238    HG1  THR  36           HG1      THR  36   0.670  -9.978   2.181
  239   1HG2  THR  36          1HG2      THR  36  -0.892 -12.748   3.211
  240   2HG2  THR  36          2HG2      THR  36  -2.524 -12.348   2.673
  241   3HG2  THR  36          3HG2      THR  36  -1.901 -11.672   4.179
  242    H    THR  37           H        THR  37  -4.028  -9.657   1.072
  243    HA   THR  37           HA       THR  37  -3.170  -7.126  -0.250
  244    HB   THR  37           HB       THR  37  -5.593  -6.837  -0.562
  245    HG1  THR  37           HG1      THR  37  -5.935  -9.274   0.816
  246   1HG2  THR  37          1HG2      THR  37  -4.499  -9.591  -1.133
  247   2HG2  THR  37          2HG2      THR  37  -4.619  -8.219  -2.231
  248   3HG2  THR  37          3HG2      THR  37  -6.077  -9.067  -1.714
  249    H    THR  38           H        THR  38  -2.949  -5.253   0.972
  250    HA   THR  38           HA       THR  38  -4.163  -5.268   3.719
  251    HB   THR  38           HB       THR  38  -1.678  -5.716   3.601
  252    HG1  THR  38           HG1      THR  38  -1.372  -4.527   5.361
  253   1HG2  THR  38          1HG2      THR  38  -1.215  -4.229   1.666
  254   2HG2  THR  38          2HG2      THR  38  -0.193  -3.848   3.050
  255   3HG2  THR  38          3HG2      THR  38  -1.582  -2.831   2.671
  256    H    TRP  39           H        TRP  39  -4.584  -3.099   4.589
  257    HA   TRP  39           HA       TRP  39  -5.680  -1.292   2.593
  258   1HB   TRP  39          1HB       TRP  39  -5.386  -1.082   5.604
  259   2HB   TRP  39          2HB       TRP  39  -6.456  -0.100   4.607
  260    HD1  TRP  39           HD1      TRP  39  -5.965  -3.715   5.807
  261    HE1  TRP  39           HE1      TRP  39  -8.210  -4.957   5.596
  262    HE3  TRP  39           HE3      TRP  39  -8.739  -0.137   3.439
  263    HZ2  TRP  39           HZ2      TRP  39 -10.833  -4.499   4.564
  264    HZ3  TRP  39           HZ3      TRP  39 -11.110  -0.571   2.857
  265    HH2  TRP  39           HH2      TRP  39 -12.156  -2.749   3.415
  266    H    GLN  40           H        GLN  40  -3.510  -0.609   5.354
  267    HA   GLN  40           HA       GLN  40  -2.534   1.877   4.513
  268   1HB   GLN  40          1HB       GLN  40  -0.625   1.318   6.005
  269   2HB   GLN  40          2HB       GLN  40  -2.167   0.837   6.713
  270   1HG   GLN  40          1HG       GLN  40  -1.618  -1.436   5.414
  271   2HG   GLN  40          2HG       GLN  40   0.035  -0.861   5.622
  272   1HE2  GLN  40          1HE2      GLN  40  -2.967  -1.067   7.637
  273   2HE2  GLN  40          2HE2      GLN  40  -2.163  -1.609   9.031
  274    H    ASP  41           H        ASP  41  -0.229   2.318   3.728
  275    HA   ASP  41           HA       ASP  41   0.289   0.672   1.310
  276   1HB   ASP  41          1HB       ASP  41   0.034   3.101   1.106
  277   2HB   ASP  41          2HB       ASP  41   1.312   3.355   2.293
  278    HA   PRO  42           HA       PRO  42   3.783  -1.236   3.247
  279   1HB   PRO  42          1HB       PRO  42   5.130  -2.034   1.004
  280   2HB   PRO  42          2HB       PRO  42   3.673  -2.850   1.603
  281   1HG   PRO  42          1HG       PRO  42   3.968  -0.861  -0.597
  282   2HG   PRO  42          2HG       PRO  42   2.966  -2.316  -0.528
  283   1HD   PRO  42          1HD       PRO  42   1.990   0.195  -0.142
  284   2HD   PRO  42          2HD       PRO  42   1.282  -1.249   0.611
  285    H    ARG  43           H        ARG  43   4.031   1.427   1.030
  286    HA   ARG  43           HA       ARG  43   6.914   1.836   1.685
  287   1HB   ARG  43          1HB       ARG  43   5.201   2.225  -0.576
  288   2HB   ARG  43          2HB       ARG  43   5.831   3.799  -0.088
  289   1HG   ARG  43          1HG       ARG  43   8.041   2.127   0.122
  290   2HG   ARG  43          2HG       ARG  43   7.223   1.543  -1.327
  291   1HD   ARG  43          1HD       ARG  43   7.675   3.463  -2.498
  292   2HD   ARG  43          2HD       ARG  43   7.410   4.498  -1.082
  293    HE   ARG  43           HE       ARG  43   9.693   3.114  -0.408
  294   1HH1  ARG  43          1HH1      ARG  43   8.732   4.939  -3.213
  295   2HH1  ARG  43          2HH1      ARG  43  10.348   5.420  -3.590
  296   1HH2  ARG  43          1HH2      ARG  43  11.784   3.753  -0.919
  297   2HH2  ARG  43          2HH2      ARG  43  12.066   4.755  -2.302
  298    H    LYS  44           H        LYS  44   3.735   3.037   2.418
  299    HA   LYS  44           HA       LYS  44   4.864   5.538   3.597
  300   1HB   LYS  44          1HB       LYS  44   2.717   5.101   1.994
  301   2HB   LYS  44          2HB       LYS  44   1.947   4.966   3.576
  302   1HG   LYS  44          1HG       LYS  44   3.749   7.278   2.809
  303   2HG   LYS  44          2HG       LYS  44   1.998   7.313   2.600
  304   1HD   LYS  44          1HD       LYS  44   2.172   6.458   5.180
  305   2HD   LYS  44          2HD       LYS  44   3.608   7.476   5.081
  306   1HE   LYS  44          1HE       LYS  44   2.100   9.279   4.061
  307   2HE   LYS  44          2HE       LYS  44   0.729   8.272   4.565
  308   1HZ   LYS  44          1HZ       LYS  44   1.525   9.940   6.259
  309   2HZ   LYS  44          2HZ       LYS  44   2.948   9.022   6.390
  310   3HZ   LYS  44          3HZ       LYS  44   1.450   8.337   6.804
  311    H    ALA  45           H        ALA  45   2.356   3.126   4.484
  312    HA   ALA  45           HA       ALA  45   3.037   3.578   7.355
  313   1HB   ALA  45          1HB       ALA  45   0.672   2.756   5.744
  314   2HB   ALA  45          2HB       ALA  45   0.753   3.796   7.167
  315   3HB   ALA  45          3HB       ALA  45   0.812   2.043   7.351
  316    H    MET  46           H        MET  46   4.981   2.225   7.326
  317    HA   MET  46           HA       MET  46   4.799  -0.585   6.522
  318   1HB   MET  46          1HB       MET  46   6.772   1.377   7.082
  319   2HB   MET  46          2HB       MET  46   7.037   0.060   8.223
  320   1HG   MET  46          1HG       MET  46   6.757  -1.486   6.144
  321   2HG   MET  46          2HG       MET  46   7.061  -0.022   5.210
  322   1HE   MET  46          1HE       MET  46   8.782   1.104   4.883
  323   2HE   MET  46          2HE       MET  46  10.468   0.670   5.147
  324   3HE   MET  46          3HE       MET  46   9.613   1.626   6.355
  325    H    LEU  47           H        LEU  47   5.279   1.097   9.656
  326    HA   LEU  47           HA       LEU  47   3.647  -0.955  11.019
  327   1HB   LEU  47          1HB       LEU  47   6.590  -0.876  10.941
  328   2HB   LEU  47          2HB       LEU  47   5.929  -0.965  12.575
  329    HG   LEU  47           HG       LEU  47   5.226  -2.829  10.285
  330   1HD1  LEU  47          1HD1      LEU  47   6.923  -3.179  12.773
  331   2HD1  LEU  47          2HD1      LEU  47   7.461  -3.292  11.097
  332   3HD1  LEU  47          3HD1      LEU  47   6.379  -4.517  11.760
  333   1HD2  LEU  47          1HD2      LEU  47   4.295  -4.066  12.468
  334   2HD2  LEU  47          2HD2      LEU  47   3.312  -2.905  11.575
  335   3HD2  LEU  47          3HD2      LEU  47   4.155  -2.404  13.041
  336    H    SER  48           H        SER  48   2.439   1.127  11.364
  337    HA   SER  48           HA       SER  48   1.850   2.983  12.706
  338   1HB   SER  48          1HB       SER  48   2.164   1.067  14.330
  339   2HB   SER  48          2HB       SER  48   3.805   1.650  14.605
  340    HG   SER  48           HG       SER  48   2.837   2.822  16.061
  341    H    GLN  49           H        GLN  49   2.923   4.605  11.407
  342    HA   GLN  49           HA       GLN  49   5.598   5.465  12.464
  343   1HB   GLN  49          1HB       GLN  49   4.384   5.220   9.747
  344   2HB   GLN  49          2HB       GLN  49   5.496   6.565  10.015
  345   1HG   GLN  49          1HG       GLN  49   6.782   4.409  11.212
  346   2HG   GLN  49          2HG       GLN  49   6.065   3.706   9.762
  347   1HE2  GLN  49          1HE2      GLN  49   8.953   4.248  10.224
  348   2HE2  GLN  49          2HE2      GLN  49   9.431   5.331   9.008
  349    H    MET  50           H        MET  50   2.872   6.247  13.429
  350    HA   MET  50           HA       MET  50   3.292   9.131  13.500
  351   1HB   MET  50          1HB       MET  50   1.183   9.667  12.289
  352   2HB   MET  50          2HB       MET  50   2.342   8.839  11.249
  353   1HG   MET  50          1HG       MET  50   1.192   6.695  11.677
  354   2HG   MET  50          2HG       MET  50   0.030   7.525  12.711
  355   1HE   MET  50          1HE       MET  50  -1.988   8.312  12.094
  356   2HE   MET  50          2HE       MET  50  -2.456   9.112  10.595
  357   3HE   MET  50          3HE       MET  50  -1.261   9.862  11.650
  358   1H    GLY  51          1H        GLY  51 -11.879  -3.901  12.144
  359   2H    GLY  51          2H        GLY  51 -13.406  -3.535  12.792
  360   3H    GLY  51          3H        GLY  51 -12.204  -2.337  12.711
  361   1HA   GLY  51          1HA       GLY  51 -14.007  -2.209  10.974
  362   2HA   GLY  51          2HA       GLY  51 -12.343  -2.174  10.389
  363    H    THR  52           H        THR  52 -13.493  -2.985   8.367
  364    HA   THR  52           HA       THR  52 -14.273  -5.847   8.465
  365    HB   THR  52           HB       THR  52 -14.657  -5.215   5.942
  366    HG1  THR  52           HG1      THR  52 -14.609  -3.107   5.512
  367   1HG2  THR  52          1HG2      THR  52 -16.672  -5.437   6.984
  368   2HG2  THR  52          2HG2      THR  52 -16.670  -3.674   6.930
  369   3HG2  THR  52          3HG2      THR  52 -16.156  -4.512   8.394
  370    HA   PRO  53           HA       PRO  53 -10.391  -7.256   6.937
  371   1HB   PRO  53          1HB       PRO  53 -11.156  -9.384   5.394
  372   2HB   PRO  53          2HB       PRO  53 -11.181  -9.416   7.168
  373   1HG   PRO  53          1HG       PRO  53 -13.417  -9.002   5.243
  374   2HG   PRO  53          2HG       PRO  53 -13.391  -9.910   6.760
  375   1HD   PRO  53          1HD       PRO  53 -14.458  -7.407   6.507
  376   2HD   PRO  53          2HD       PRO  53 -13.793  -8.043   8.026
  377    HA   PRO  54           HA       PRO  54  -9.786  -5.468   2.952
  378   1HB   PRO  54          1HB       PRO  54  -7.604  -6.871   2.058
  379   2HB   PRO  54          2HB       PRO  54  -7.504  -5.617   3.308
  380   1HG   PRO  54          1HG       PRO  54  -7.594  -8.588   3.593
  381   2HG   PRO  54          2HG       PRO  54  -6.605  -7.406   4.461
  382   1HD   PRO  54          1HD       PRO  54  -8.839  -8.516   5.523
  383   2HD   PRO  54          2HD       PRO  54  -8.301  -6.869   5.922
  384    HA   PRO  55           HA       PRO  55 -11.582  -7.976  -0.187
  385   1HB   PRO  55          1HB       PRO  55 -10.111  -7.454  -2.441
  386   2HB   PRO  55          2HB       PRO  55 -11.247  -6.286  -1.734
  387   1HG   PRO  55          1HG       PRO  55  -8.281  -6.435  -1.467
  388   2HG   PRO  55          2HG       PRO  55  -9.319  -5.023  -1.710
  389   1HD   PRO  55          1HD       PRO  55  -8.301  -5.685   0.707
  390   2HD   PRO  55          2HD       PRO  55  -9.885  -4.899   0.527
  391    HA   PRO  56           HA       PRO  56  -9.400 -11.759  -0.732
  392   1HB   PRO  56          1HB       PRO  56 -10.107 -12.609  -3.237
  393   2HB   PRO  56          2HB       PRO  56 -11.227 -12.627  -1.859
  394   1HG   PRO  56          1HG       PRO  56 -11.008 -10.673  -4.094
  395   2HG   PRO  56          2HG       PRO  56 -12.451 -11.321  -3.296
  396   1HD   PRO  56          1HD       PRO  56 -11.430  -8.849  -2.774
  397   2HD   PRO  56          2HD       PRO  56 -12.355  -9.799  -1.592
  398    H    TYR  57           H        TYR  57  -7.484 -12.680  -1.705
  399    HA   TYR  57           HA       TYR  57  -5.952 -10.735  -3.380
  400   1HB   TYR  57          1HB       TYR  57  -5.106 -11.433  -1.136
  401   2HB   TYR  57          2HB       TYR  57  -5.050 -13.101  -1.706
  402    HD1  TYR  57           HD1      TYR  57  -2.820 -13.720  -2.014
  403    HD2  TYR  57           HD2      TYR  57  -4.132  -9.853  -3.342
  404    HE1  TYR  57           HE1      TYR  57  -0.591 -13.307  -3.015
  405    HE2  TYR  57           HE2      TYR  57  -1.902  -9.438  -4.342
  406    HH   TYR  57           HH       TYR  57   0.340 -10.184  -4.202
  407    H    THR  58           H        THR  58  -4.657 -11.607  -5.153
  408    HA   THR  58           HA       THR  58  -5.168 -14.371  -6.052
  409    HB   THR  58           HB       THR  58  -7.165 -13.139  -6.773
  410    HG1  THR  58           HG1      THR  58  -6.101 -14.660  -8.210
  411   1HG2  THR  58          1HG2      THR  58  -5.313 -11.026  -7.092
  412   2HG2  THR  58          2HG2      THR  58  -7.053 -10.977  -7.373
  413   3HG2  THR  58          3HG2      THR  58  -5.957 -11.370  -8.697
  414    H    VAL  59           H        VAL  59  -4.485 -13.624  -8.833
  415    HA   VAL  59           HA       VAL  59  -1.938 -12.205  -8.803
  416    HB   VAL  59           HB       VAL  59  -1.367 -14.293  -7.616
  417   1HG1  VAL  59          1HG1      VAL  59  -2.011 -16.370  -8.323
  418   2HG1  VAL  59          2HG1      VAL  59  -1.806 -15.963 -10.026
  419   3HG1  VAL  59          3HG1      VAL  59  -3.264 -15.463  -9.169
  420   1HG2  VAL  59          1HG2      VAL  59  -0.242 -14.638 -10.380
  421   2HG2  VAL  59          2HG2      VAL  59   0.581 -14.740  -8.823
  422   3HG2  VAL  59          3HG2      VAL  59   0.117 -13.167  -9.475
  423    H    GLY  60           H        GLY  60  -0.891 -12.332 -10.991
  424   1HA   GLY  60          1HA       GLY  60  -2.753 -13.298 -13.116
  425   2HA   GLY  60          2HA       GLY  60  -2.091 -11.664 -13.193
  Start of MODEL    5
    1    H    PHE   5           H        PHE   5  -2.380  13.377   7.437
    2    HA   PHE   5           HA       PHE   5  -1.213  11.439   6.748
    3   1HB   PHE   5          1HB       PHE   5  -3.528  10.775   8.017
    4   2HB   PHE   5          2HB       PHE   5  -3.771   9.959   6.471
    5    HD1  PHE   5           HD1      PHE   5  -3.117   7.731   6.474
    6    HD2  PHE   5           HD2      PHE   5  -0.859  10.574   8.770
    7    HE1  PHE   5           HE1      PHE   5  -1.564   5.929   7.178
    8    HE2  PHE   5           HE2      PHE   5   0.694   8.772   9.473
    9    HZ   PHE   5           HZ       PHE   5   0.341   6.450   8.677
   10    H    GLU   6           H        GLU   6  -0.530  12.040   4.640
   11    HA   GLU   6           HA       GLU   6  -2.394  11.374   2.388
   12   1HB   GLU   6          1HB       GLU   6  -0.912  12.914   1.114
   13   2HB   GLU   6          2HB       GLU   6  -1.587  13.697   2.545
   14   1HG   GLU   6          1HG       GLU   6   0.846  12.369   3.288
   15   2HG   GLU   6          2HG       GLU   6   1.159  13.371   1.870
   16    H    ILE   7           H        ILE   7  -1.628   9.038   2.971
   17    HA   ILE   7           HA       ILE   7   0.999   8.109   2.623
   18    HB   ILE   7           HB       ILE   7  -1.765   7.000   2.216
   19   1HG1  ILE   7          1HG1      ILE   7   0.527   6.309   4.073
   20   2HG1  ILE   7          2HG1      ILE   7  -0.846   7.337   4.482
   21   1HG2  ILE   7          1HG2      ILE   7  -0.611   4.717   1.993
   22   2HG2  ILE   7          2HG2      ILE   7   0.843   5.613   1.551
   23   3HG2  ILE   7          3HG2      ILE   7  -0.606   5.734   0.551
   24   1HD1  ILE   7          1HD1      ILE   7  -1.631   4.742   3.347
   25   2HD1  ILE   7          2HD1      ILE   7  -2.223   5.561   4.792
   26   3HD1  ILE   7          3HD1      ILE   7  -0.744   4.604   4.865
   27    HA   PRO   8           HA       PRO   8   0.265   7.609  -2.076
   28   1HB   PRO   8          1HB       PRO   8  -1.987   8.726  -3.167
   29   2HB   PRO   8          2HB       PRO   8  -1.927   7.058  -2.567
   30   1HG   PRO   8          1HG       PRO   8  -3.002   9.513  -1.254
   31   2HG   PRO   8          2HG       PRO   8  -3.660   7.869  -1.276
   32   1HD   PRO   8          1HD       PRO   8  -2.312   8.882   0.844
   33   2HD   PRO   8          2HD       PRO   8  -2.300   7.157   0.425
   34    H    ASP   9           H        ASP   9  -0.022   9.373  -4.030
   35    HA   ASP   9           HA       ASP   9   0.781  11.444  -4.841
   36   1HB   ASP   9          1HB       ASP   9  -1.320  11.799  -3.056
   37   2HB   ASP   9          2HB       ASP   9  -0.099  12.929  -2.470
   38    H    ASP  10           H        ASP  10   2.400   9.820  -2.761
   39    HA   ASP  10           HA       ASP  10   4.423  11.943  -2.294
   40   1HB   ASP  10          1HB       ASP  10   3.012  11.966  -0.307
   41   2HB   ASP  10          2HB       ASP  10   3.140  10.217  -0.151
   42    H    VAL  11           H        VAL  11   4.222   8.748  -0.754
   43    HA   VAL  11           HA       VAL  11   6.783   8.016  -2.017
   44    HB   VAL  11           HB       VAL  11   6.555   6.083  -0.410
   45   1HG1  VAL  11          1HG1      VAL  11   7.311   8.656   0.051
   46   2HG1  VAL  11          2HG1      VAL  11   7.438   7.370   1.252
   47   3HG1  VAL  11          3HG1      VAL  11   6.053   8.461   1.272
   48   1HG2  VAL  11          1HG2      VAL  11   4.746   5.890   1.061
   49   2HG2  VAL  11          2HG2      VAL  11   3.962   6.318  -0.459
   50   3HG2  VAL  11          3HG2      VAL  11   4.218   7.549   0.777
   51    HA   PRO  12           HA       PRO  12   4.703   5.497  -5.023
   52   1HB   PRO  12          1HB       PRO  12   6.863   4.061  -5.896
   53   2HB   PRO  12          2HB       PRO  12   6.581   5.750  -6.359
   54   1HG   PRO  12          1HG       PRO  12   8.437   4.618  -4.328
   55   2HG   PRO  12          2HG       PRO  12   8.661   5.991  -5.419
   56   1HD   PRO  12          1HD       PRO  12   8.027   6.215  -2.754
   57   2HD   PRO  12          2HD       PRO  12   7.666   7.452  -3.975
   58    H    LEU  13           H        LEU  13   5.405   2.812  -5.567
   59    HA   LEU  13           HA       LEU  13   4.887   1.538  -2.907
   60   1HB   LEU  13          1HB       LEU  13   3.725   1.329  -5.595
   61   2HB   LEU  13          2HB       LEU  13   4.097  -0.239  -4.882
   62    HG   LEU  13           HG       LEU  13   1.797   0.534  -4.313
   63   1HD1  LEU  13          1HD1      LEU  13   3.633   0.529  -1.901
   64   2HD1  LEU  13          2HD1      LEU  13   3.135  -0.920  -2.767
   65   3HD1  LEU  13          3HD1      LEU  13   1.937   0.065  -1.939
   66   1HD2  LEU  13          1HD2      LEU  13   1.637   2.433  -2.657
   67   2HD2  LEU  13          2HD2      LEU  13   2.114   2.927  -4.282
   68   3HD2  LEU  13          3HD2      LEU  13   3.326   2.800  -3.008
   69    HA   PRO  14           HA       PRO  14   8.638  -0.655  -3.639
   70   1HB   PRO  14          1HB       PRO  14   8.405  -2.521  -1.654
   71   2HB   PRO  14          2HB       PRO  14   8.826  -0.825  -1.367
   72   1HG   PRO  14          1HG       PRO  14   6.331  -2.249  -0.810
   73   2HG   PRO  14          2HG       PRO  14   6.951  -0.753  -0.119
   74   1HD   PRO  14          1HD       PRO  14   4.956  -1.069  -2.128
   75   2HD   PRO  14          2HD       PRO  14   5.594   0.448  -1.468
   76    H    ALA  15           H        ALA  15   9.364  -3.116  -3.792
   77    HA   ALA  15           HA       ALA  15   7.929  -4.295  -5.988
   78   1HB   ALA  15          1HB       ALA  15   9.828  -5.561  -6.098
   79   2HB   ALA  15          2HB       ALA  15   9.758  -5.980  -4.386
   80   3HB   ALA  15          3HB       ALA  15  10.429  -4.428  -4.888
   81    H    GLY  16           H        GLY  16   6.761  -6.322  -6.020
   82   1HA   GLY  16          1HA       GLY  16   5.136  -7.788  -5.214
   83   2HA   GLY  16          2HA       GLY  16   6.197  -7.986  -3.830
   84    H    TRP  17           H        TRP  17   4.742  -4.954  -4.826
   85    HA   TRP  17           HA       TRP  17   2.842  -5.102  -2.547
   86   1HB   TRP  17          1HB       TRP  17   5.228  -3.399  -2.917
   87   2HB   TRP  17          2HB       TRP  17   3.818  -2.638  -2.195
   88    HD1  TRP  17           HD1      TRP  17   6.789  -4.427  -1.192
   89    HE1  TRP  17           HE1      TRP  17   6.502  -5.494   1.147
   90    HE3  TRP  17           HE3      TRP  17   1.737  -4.132  -0.721
   91    HZ2  TRP  17           HZ2      TRP  17   4.376  -6.135   2.973
   92    HZ3  TRP  17           HZ3      TRP  17   0.591  -4.965   1.307
   93    HH2  TRP  17           HH2      TRP  17   1.902  -5.969   3.153
   94    H    GLU  18           H        GLU  18   1.577  -5.311  -4.711
   95    HA   GLU  18           HA       GLU  18   1.206  -2.856  -6.283
   96   1HB   GLU  18          1HB       GLU  18   0.839  -5.527  -6.695
   97   2HB   GLU  18          2HB       GLU  18  -0.811  -5.026  -6.310
   98   1HG   GLU  18          1HG       GLU  18  -1.043  -3.960  -8.288
   99   2HG   GLU  18          2HG       GLU  18   0.518  -3.156  -8.120
  100    H    MET  19           H        MET  19  -1.496  -2.735  -6.534
  101    HA   MET  19           HA       MET  19  -2.875  -2.685  -3.998
  102   1HB   MET  19          1HB       MET  19  -2.865  -0.313  -3.615
  103   2HB   MET  19          2HB       MET  19  -1.200  -0.844  -3.805
  104   1HG   MET  19          1HG       MET  19  -2.754   0.191  -6.172
  105   2HG   MET  19          2HG       MET  19  -1.961   1.302  -5.064
  106   1HE   MET  19          1HE       MET  19   1.425   1.582  -6.180
  107   2HE   MET  19          2HE       MET  19   0.231   1.869  -4.916
  108   3HE   MET  19          3HE       MET  19  -0.114   2.361  -6.572
  109    H    ALA  20           H        ALA  20  -5.040  -2.427  -4.271
  110    HA   ALA  20           HA       ALA  20  -6.046  -1.493  -6.915
  111   1HB   ALA  20          1HB       ALA  20  -7.279  -3.942  -5.847
  112   2HB   ALA  20          2HB       ALA  20  -5.570  -4.130  -6.245
  113   3HB   ALA  20          3HB       ALA  20  -6.710  -3.597  -7.480
  114    H    LYS  21           H        LYS  21  -8.554  -1.399  -6.776
  115    HA   LYS  21           HA       LYS  21  -9.269  -0.240  -4.128
  116   1HB   LYS  21          1HB       LYS  21 -10.155   0.023  -6.982
  117   2HB   LYS  21          2HB       LYS  21 -11.290   0.463  -5.704
  118   1HG   LYS  21          1HG       LYS  21  -9.661   2.030  -4.759
  119   2HG   LYS  21          2HG       LYS  21  -8.467   1.546  -5.964
  120   1HD   LYS  21          1HD       LYS  21 -10.754   2.211  -7.444
  121   2HD   LYS  21          2HD       LYS  21 -10.642   3.458  -6.202
  122   1HE   LYS  21          1HE       LYS  21  -7.995   3.016  -7.155
  123   2HE   LYS  21          2HE       LYS  21  -9.044   3.174  -8.576
  124   1HZ   LYS  21          1HZ       LYS  21 -10.091   5.105  -7.382
  125   2HZ   LYS  21          2HZ       LYS  21  -8.495   5.366  -7.900
  126   3HZ   LYS  21          3HZ       LYS  21  -8.817   5.027  -6.266
  127    H    THR  22           H        THR  22 -10.685  -1.291  -2.800
  128    HA   THR  22           HA       THR  22 -11.908  -3.825  -3.737
  129    HB   THR  22           HB       THR  22 -12.241  -2.708  -0.978
  130    HG1  THR  22           HG1      THR  22 -10.186  -2.708  -0.576
  131   1HG2  THR  22          1HG2      THR  22 -11.707  -5.402  -2.229
  132   2HG2  THR  22          2HG2      THR  22 -13.126  -4.884  -1.317
  133   3HG2  THR  22          3HG2      THR  22 -11.589  -5.137  -0.489
  134    H    SER  23           H        SER  23 -14.101  -4.006  -4.135
  135    HA   SER  23           HA       SER  23 -16.363  -3.385  -4.377
  136   1HB   SER  23          1HB       SER  23 -15.402  -2.526  -1.760
  137   2HB   SER  23          2HB       SER  23 -16.726  -1.511  -2.332
  138    HG   SER  23           HG       SER  23 -17.237  -3.557  -1.164
  139    H    SER  24           H        SER  24 -15.397  -0.257  -3.002
  140    HA   SER  24           HA       SER  24 -16.242   1.028  -5.556
  141   1HB   SER  24          1HB       SER  24 -17.449   1.874  -3.731
  142   2HB   SER  24          2HB       SER  24 -16.051   1.808  -2.657
  143    HG   SER  24           HG       SER  24 -16.886   3.894  -3.883
  144    H    GLY  25           H        GLY  25 -13.984   2.205  -3.067
  145   1HA   GLY  25          1HA       GLY  25 -11.804   2.228  -5.087
  146   2HA   GLY  25          2HA       GLY  25 -12.263   3.760  -4.353
  147    H    GLN  26           H        GLN  26 -12.531   0.972  -2.325
  148    HA   GLN  26           HA       GLN  26 -10.824   1.942  -0.297
  149   1HB   GLN  26          1HB       GLN  26 -11.443  -0.935  -1.052
  150   2HB   GLN  26          2HB       GLN  26 -10.977  -0.357   0.546
  151   1HG   GLN  26          1HG       GLN  26 -13.091   1.274   0.041
  152   2HG   GLN  26          2HG       GLN  26 -13.587  -0.168  -0.846
  153   1HE2  GLN  26          1HE2      GLN  26 -13.009   1.150   2.364
  154   2HE2  GLN  26          2HE2      GLN  26 -13.546  -0.211   3.226
  155    H    ARG  27           H        ARG  27  -8.809   2.661  -1.162
  156    HA   ARG  27           HA       ARG  27  -7.173   1.108  -2.942
  157   1HB   ARG  27          1HB       ARG  27  -7.233   3.665  -1.813
  158   2HB   ARG  27          2HB       ARG  27  -5.735   2.958  -1.219
  159   1HG   ARG  27          1HG       ARG  27  -5.489   2.165  -3.730
  160   2HG   ARG  27          2HG       ARG  27  -6.581   3.518  -4.040
  161   1HD   ARG  27          1HD       ARG  27  -4.558   4.398  -2.198
  162   2HD   ARG  27          2HD       ARG  27  -3.767   3.627  -3.582
  163    HE   ARG  27           HE       ARG  27  -4.645   5.332  -4.979
  164   1HH1  ARG  27          1HH1      ARG  27  -6.221   5.321  -1.873
  165   2HH1  ARG  27          2HH1      ARG  27  -7.079   6.789  -2.182
  166   1HH2  ARG  27          1HH2      ARG  27  -5.771   7.235  -5.354
  167   2HH2  ARG  27          2HH2      ARG  27  -6.829   7.866  -4.135
  168    H    TYR  28           H        TYR  28  -6.679  -0.966  -2.177
  169    HA   TYR  28           HA       TYR  28  -5.191  -1.074   0.420
  170   1HB   TYR  28          1HB       TYR  28  -6.007  -3.326   0.647
  171   2HB   TYR  28          2HB       TYR  28  -7.385  -2.319   0.217
  172    HD1  TYR  28           HD1      TYR  28  -5.161  -5.016  -0.859
  173    HD2  TYR  28           HD2      TYR  28  -8.328  -2.393  -2.079
  174    HE1  TYR  28           HE1      TYR  28  -5.686  -6.527  -2.749
  175    HE2  TYR  28           HE2      TYR  28  -8.838  -3.889  -3.980
  176    HH   TYR  28           HH       TYR  28  -8.034  -5.627  -5.224
  177    H    PHE  29           H        PHE  29  -3.093  -1.838   0.319
  178    HA   PHE  29           HA       PHE  29  -1.970  -2.189  -2.377
  179   1HB   PHE  29          1HB       PHE  29  -0.776  -2.066   0.409
  180   2HB   PHE  29          2HB       PHE  29   0.168  -2.066  -1.083
  181    HD1  PHE  29           HD1      PHE  29   0.137  -0.125  -2.594
  182    HD2  PHE  29           HD2      PHE  29  -2.205  -0.173   1.004
  183    HE1  PHE  29           HE1      PHE  29  -0.297   2.300  -2.841
  184    HE2  PHE  29           HE2      PHE  29  -2.637   2.253   0.759
  185    HZ   PHE  29           HZ       PHE  29  -1.684   3.492  -1.166
  186    H    LYS  30           H        LYS  30  -1.837  -4.113  -3.283
  187    HA   LYS  30           HA       LYS  30  -2.183  -6.613  -1.843
  188   1HB   LYS  30          1HB       LYS  30  -1.536  -5.778  -4.672
  189   2HB   LYS  30          2HB       LYS  30  -1.792  -7.463  -4.212
  190   1HG   LYS  30          1HG       LYS  30  -3.908  -5.962  -3.099
  191   2HG   LYS  30          2HG       LYS  30  -3.720  -5.395  -4.748
  192   1HD   LYS  30          1HD       LYS  30  -3.454  -8.190  -4.900
  193   2HD   LYS  30          2HD       LYS  30  -4.805  -7.914  -3.799
  194   1HE   LYS  30          1HE       LYS  30  -5.972  -7.775  -5.794
  195   2HE   LYS  30          2HE       LYS  30  -5.403  -6.096  -5.731
  196   1HZ   LYS  30          1HZ       LYS  30  -4.779  -7.099  -7.833
  197   2HZ   LYS  30          2HZ       LYS  30  -4.009  -8.384  -7.031
  198   3HZ   LYS  30          3HZ       LYS  30  -3.387  -6.808  -6.908
  199    H    ASN  31           H        ASN  31  -0.592  -8.063  -1.311
  200    HA   ASN  31           HA       ASN  31   2.240  -7.190  -1.742
  201   1HB   ASN  31          1HB       ASN  31   1.016  -7.464   0.570
  202   2HB   ASN  31          2HB       ASN  31   1.301  -9.185   0.304
  203   1HD2  ASN  31          1HD2      ASN  31   2.768  -8.820   2.311
  204   2HD2  ASN  31          2HD2      ASN  31   4.361  -8.310   2.018
  205    H    HIS  32           H        HIS  32   3.185  -8.385  -3.398
  206    HA   HIS  32           HA       HIS  32   2.226 -11.164  -3.860
  207   1HB   HIS  32          1HB       HIS  32   4.216  -9.434  -5.365
  208   2HB   HIS  32          2HB       HIS  32   3.511 -10.941  -5.940
  209    HD1  HIS  32           HD1      HIS  32   0.957 -10.916  -6.552
  210    HD2  HIS  32           HD2      HIS  32   2.494  -7.177  -5.531
  211    HE1  HIS  32           HE1      HIS  32  -0.799  -9.210  -7.212
  212    H    ILE  33           H        ILE  33   4.969  -9.373  -2.618
  213    HA   ILE  33           HA       ILE  33   6.917 -11.496  -2.627
  214    HB   ILE  33           HB       ILE  33   7.864 -10.098  -0.680
  215   1HG1  ILE  33          1HG1      ILE  33   5.770  -8.062  -1.447
  216   2HG1  ILE  33          2HG1      ILE  33   5.464  -9.223  -0.154
  217   1HG2  ILE  33          1HG2      ILE  33   8.959  -9.244  -2.437
  218   2HG2  ILE  33          2HG2      ILE  33   7.719  -7.991  -2.518
  219   3HG2  ILE  33          3HG2      ILE  33   7.556  -9.457  -3.484
  220   1HD1  ILE  33          1HD1      ILE  33   7.948  -8.394   0.545
  221   2HD1  ILE  33          2HD1      ILE  33   6.474  -7.620   1.129
  222   3HD1  ILE  33          3HD1      ILE  33   7.349  -6.932  -0.238
  223    H    ASP  34           H        ASP  34   4.186 -10.696  -0.600
  224    HA   ASP  34           HA       ASP  34   4.756 -13.104   1.096
  225   1HB   ASP  34          1HB       ASP  34   4.731 -10.487   1.883
  226   2HB   ASP  34          2HB       ASP  34   3.048 -10.931   2.161
  227    H    GLN  35           H        GLN  35   2.697 -11.784  -1.231
  228    HA   GLN  35           HA       GLN  35   0.567 -12.410  -2.014
  229   1HB   GLN  35          1HB       GLN  35   1.870 -14.678  -0.776
  230   2HB   GLN  35          2HB       GLN  35   0.124 -14.795  -0.562
  231   1HG   GLN  35          1HG       GLN  35   0.331 -15.764  -2.657
  232   2HG   GLN  35          2HG       GLN  35   0.114 -14.078  -3.124
  233   1HE2  GLN  35          1HE2      GLN  35   1.448 -15.511  -4.999
  234   2HE2  GLN  35          2HE2      GLN  35   3.118 -15.216  -4.955
  235    H    THR  36           H        THR  36  -0.290 -10.550  -0.690
  236    HA   THR  36           HA       THR  36  -2.541 -11.356   0.914
  237    HB   THR  36           HB       THR  36  -1.256  -9.974   2.936
  238    HG1  THR  36           HG1      THR  36   0.803 -10.375   2.882
  239   1HG2  THR  36          1HG2      THR  36  -1.912 -11.821   4.029
  240   2HG2  THR  36          2HG2      THR  36  -0.733 -12.807   3.165
  241   3HG2  THR  36          3HG2      THR  36  -2.329 -12.530   2.470
  242    H    THR  37           H        THR  37  -3.949  -9.607   1.199
  243    HA   THR  37           HA       THR  37  -3.114  -7.033  -0.053
  244    HB   THR  37           HB       THR  37  -5.596  -6.697  -0.120
  245    HG1  THR  37           HG1      THR  37  -5.831  -9.333   0.829
  246   1HG2  THR  37          1HG2      THR  37  -4.898  -9.465  -1.097
  247   2HG2  THR  37          2HG2      THR  37  -4.276  -8.008  -1.872
  248   3HG2  THR  37          3HG2      THR  37  -6.014  -8.307  -1.819
  249    H    THR  38           H        THR  38  -2.835  -5.205   1.221
  250    HA   THR  38           HA       THR  38  -3.879  -5.315   4.033
  251    HB   THR  38           HB       THR  38  -1.413  -5.758   3.764
  252    HG1  THR  38           HG1      THR  38  -2.236  -4.815   5.659
  253   1HG2  THR  38          1HG2      THR  38  -1.304  -2.852   2.908
  254   2HG2  THR  38          2HG2      THR  38  -1.135  -4.212   1.799
  255   3HG2  THR  38          3HG2      THR  38   0.057  -3.962   3.073
  256    H    TRP  39           H        TRP  39  -4.475  -3.264   4.938
  257    HA   TRP  39           HA       TRP  39  -5.579  -1.359   3.075
  258   1HB   TRP  39          1HB       TRP  39  -5.255  -1.614   6.058
  259   2HB   TRP  39          2HB       TRP  39  -5.912  -0.133   5.362
  260    HD1  TRP  39           HD1      TRP  39  -7.244  -2.932   6.943
  261    HE1  TRP  39           HE1      TRP  39  -9.525  -3.673   6.001
  262    HE3  TRP  39           HE3      TRP  39  -7.187  -0.485   2.460
  263    HZ2  TRP  39           HZ2      TRP  39 -11.114  -3.282   3.657
  264    HZ3  TRP  39           HZ3      TRP  39  -9.092  -0.690   0.895
  265    HH2  TRP  39           HH2      TRP  39 -11.056  -2.083   1.486
  266    H    GLN  40           H        GLN  40  -3.346  -0.664   5.773
  267    HA   GLN  40           HA       GLN  40  -2.376   1.803   4.858
  268   1HB   GLN  40          1HB       GLN  40  -0.886  -0.391   6.338
  269   2HB   GLN  40          2HB       GLN  40  -0.498   1.328   6.377
  270   1HG   GLN  40          1HG       GLN  40  -3.085   1.477   7.089
  271   2HG   GLN  40          2HG       GLN  40  -2.734  -0.143   7.689
  272   1HE2  GLN  40          1HE2      GLN  40  -1.649  -0.271   9.680
  273   2HE2  GLN  40          2HE2      GLN  40  -0.909   1.044  10.457
  274    H    ASP  41           H        ASP  41  -0.353   2.355   3.763
  275    HA   ASP  41           HA       ASP  41   0.226   0.574   1.498
  276   1HB   ASP  41          1HB       ASP  41   1.591   2.523   0.788
  277   2HB   ASP  41          2HB       ASP  41  -0.037   3.013   1.257
  278    HA   PRO  42           HA       PRO  42   3.772  -1.297   3.341
  279   1HB   PRO  42          1HB       PRO  42   5.135  -1.992   1.070
  280   2HB   PRO  42          2HB       PRO  42   3.703  -2.864   1.647
  281   1HG   PRO  42          1HG       PRO  42   3.931  -0.790  -0.486
  282   2HG   PRO  42          2HG       PRO  42   2.980  -2.281  -0.467
  283   1HD   PRO  42          1HD       PRO  42   1.907   0.168   0.005
  284   2HD   PRO  42          2HD       PRO  42   1.272  -1.320   0.738
  285    H    ARG  43           H        ARG  43   4.101   1.297   3.751
  286    HA   ARG  43           HA       ARG  43   6.916   1.799   3.364
  287   1HB   ARG  43          1HB       ARG  43   5.250   2.355   1.176
  288   2HB   ARG  43          2HB       ARG  43   5.549   3.927   1.918
  289   1HG   ARG  43          1HG       ARG  43   7.834   3.824   1.537
  290   2HG   ARG  43          2HG       ARG  43   7.863   2.061   1.562
  291   1HD   ARG  43          1HD       ARG  43   6.784   1.977  -0.640
  292   2HD   ARG  43          2HD       ARG  43   6.641   3.745  -0.658
  293    HE   ARG  43           HE       ARG  43   9.338   3.261  -0.143
  294   1HH1  ARG  43          1HH1      ARG  43   7.068   2.372  -2.629
  295   2HH1  ARG  43          2HH1      ARG  43   8.281   2.285  -3.858
  296   1HH2  ARG  43          1HH2      ARG  43  10.894   3.140  -1.758
  297   2HH2  ARG  43          2HH2      ARG  43  10.431   2.716  -3.371
  298    H    LYS  44           H        LYS  44   4.053   3.955   3.333
  299    HA   LYS  44           HA       LYS  44   5.105   5.726   5.340
  300   1HB   LYS  44          1HB       LYS  44   3.377   6.225   3.591
  301   2HB   LYS  44          2HB       LYS  44   2.238   5.218   4.484
  302   1HG   LYS  44          1HG       LYS  44   1.872   6.826   6.041
  303   2HG   LYS  44          2HG       LYS  44   3.588   7.212   6.165
  304   1HD   LYS  44          1HD       LYS  44   2.755   8.071   3.595
  305   2HD   LYS  44          2HD       LYS  44   1.523   8.622   4.730
  306   1HE   LYS  44          1HE       LYS  44   2.924  10.187   5.602
  307   2HE   LYS  44          2HE       LYS  44   4.239   9.006   5.769
  308   1HZ   LYS  44          1HZ       LYS  44   3.400  10.429   3.294
  309   2HZ   LYS  44          2HZ       LYS  44   4.511   9.144   3.315
  310   3HZ   LYS  44          3HZ       LYS  44   4.875  10.598   4.114
  311    H    ALA  45           H        ALA  45   3.384   2.702   5.521
  312    HA   ALA  45           HA       ALA  45   3.196   3.030   8.498
  313   1HB   ALA  45          1HB       ALA  45   1.235   1.201   7.634
  314   2HB   ALA  45          2HB       ALA  45   1.188   2.521   6.465
  315   3HB   ALA  45          3HB       ALA  45   0.964   2.856   8.182
  316    H    MET  46           H        MET  46   5.088   1.807   8.939
  317    HA   MET  46           HA       MET  46   4.973  -1.070   8.093
  318   1HB   MET  46          1HB       MET  46   6.737   0.696   7.139
  319   2HB   MET  46          2HB       MET  46   7.564   0.321   8.651
  320   1HG   MET  46          1HG       MET  46   7.841  -1.938   8.089
  321   2HG   MET  46          2HG       MET  46   6.532  -1.903   6.907
  322   1HE   MET  46          1HE       MET  46   9.539  -3.126   6.464
  323   2HE   MET  46          2HE       MET  46   9.630  -2.724   4.751
  324   3HE   MET  46          3HE       MET  46   8.103  -3.271   5.441
  325    H    LEU  47           H        LEU  47   6.174   1.246  10.534
  326    HA   LEU  47           HA       LEU  47   6.103  -0.984  12.543
  327   1HB   LEU  47          1HB       LEU  47   7.999   1.248  11.945
  328   2HB   LEU  47          2HB       LEU  47   7.805   0.775  13.633
  329    HG   LEU  47           HG       LEU  47   8.103  -1.471  11.728
  330   1HD1  LEU  47          1HD1      LEU  47  10.157  -0.985  10.900
  331   2HD1  LEU  47          2HD1      LEU  47  10.708  -0.317  12.437
  332   3HD1  LEU  47          3HD1      LEU  47   9.786   0.688  11.318
  333   1HD2  LEU  47          1HD2      LEU  47   8.527  -2.437  13.716
  334   2HD2  LEU  47          2HD2      LEU  47   8.479  -0.864  14.513
  335   3HD2  LEU  47          3HD2      LEU  47   9.997  -1.472  13.850
  336    H    SER  48           H        SER  48   3.726  -0.158  12.628
  337    HA   SER  48           HA       SER  48   3.481   1.656  14.922
  338   1HB   SER  48          1HB       SER  48   3.480   2.675  12.288
  339   2HB   SER  48          2HB       SER  48   1.793   2.685  12.805
  340    HG   SER  48           HG       SER  48   3.998   4.043  13.847
  341    H    GLN  49           H        GLN  49   1.376   0.665  12.191
  342    HA   GLN  49           HA       GLN  49  -0.705  -0.460  12.213
  343   1HB   GLN  49          1HB       GLN  49   0.989  -1.720  14.360
  344   2HB   GLN  49          2HB       GLN  49  -0.661  -2.287  14.098
  345   1HG   GLN  49          1HG       GLN  49  -0.175  -2.805  11.778
  346   2HG   GLN  49          2HG       GLN  49   1.425  -2.072  11.907
  347   1HE2  GLN  49          1HE2      GLN  49   1.239  -4.771  11.115
  348   2HE2  GLN  49          2HE2      GLN  49   1.809  -5.769  12.364
  349    H    MET  50           H        MET  50  -0.322   2.043  13.906
  350    HA   MET  50           HA       MET  50  -2.284   1.538  16.096
  351   1HB   MET  50          1HB       MET  50  -0.101   3.451  15.476
  352   2HB   MET  50          2HB       MET  50  -1.485   4.130  16.334
  353   1HG   MET  50          1HG       MET  50  -1.240   2.604  18.146
  354   2HG   MET  50          2HG       MET  50  -0.147   1.570  17.226
  355   1HE   MET  50          1HE       MET  50   1.781   1.427  18.846
  356   2HE   MET  50          2HE       MET  50   0.652   2.164  19.980
  357   3HE   MET  50          3HE       MET  50   2.304   2.768  19.874
  358   1H    GLY  51          1H        GLY  51 -13.316  -3.135  11.388
  359   2H    GLY  51          2H        GLY  51 -14.602  -2.450  12.262
  360   3H    GLY  51          3H        GLY  51 -13.220  -1.526  11.915
  361   1HA   GLY  51          1HA       GLY  51 -15.463  -1.402  10.491
  362   2HA   GLY  51          2HA       GLY  51 -13.865  -1.050   9.830
  363    H    THR  52           H        THR  52 -15.486  -1.875   7.938
  364    HA   THR  52           HA       THR  52 -16.049  -4.605   7.547
  365    HB   THR  52           HB       THR  52 -16.020  -3.983   5.161
  366    HG1  THR  52           HG1      THR  52 -14.648  -1.700   6.135
  367   1HG2  THR  52          1HG2      THR  52 -17.944  -2.935   5.660
  368   2HG2  THR  52          2HG2      THR  52 -17.027  -1.445   5.888
  369   3HG2  THR  52          3HG2      THR  52 -17.337  -2.510   7.260
  370    HA   PRO  53           HA       PRO  53 -12.028  -6.416   7.244
  371   1HB   PRO  53          1HB       PRO  53 -12.673  -8.690   5.864
  372   2HB   PRO  53          2HB       PRO  53 -13.049  -8.463   7.583
  373   1HG   PRO  53          1HG       PRO  53 -14.814  -8.184   5.197
  374   2HG   PRO  53          2HG       PRO  53 -15.173  -8.862   6.790
  375   1HD   PRO  53          1HD       PRO  53 -15.928  -6.357   6.003
  376   2HD   PRO  53          2HD       PRO  53 -15.636  -6.809   7.695
  377    HA   PRO  54           HA       PRO  54 -10.626  -5.121   3.253
  378   1HB   PRO  54          1HB       PRO  54  -8.176  -6.343   3.221
  379   2HB   PRO  54          2HB       PRO  54  -8.521  -4.895   4.183
  380   1HG   PRO  54          1HG       PRO  54  -8.407  -7.754   5.026
  381   2HG   PRO  54          2HG       PRO  54  -7.814  -6.310   5.861
  382   1HD   PRO  54          1HD       PRO  54 -10.144  -7.559   6.509
  383   2HD   PRO  54          2HD       PRO  54  -9.880  -5.816   6.736
  384    HA   PRO  55           HA       PRO  55 -11.295  -8.411   0.398
  385   1HB   PRO  55          1HB       PRO  55  -9.457  -7.954  -1.586
  386   2HB   PRO  55          2HB       PRO  55 -10.891  -6.937  -1.346
  387   1HG   PRO  55          1HG       PRO  55  -8.072  -6.452  -0.529
  388   2HG   PRO  55          2HG       PRO  55  -9.270  -5.321  -1.174
  389   1HD   PRO  55          1HD       PRO  55  -8.627  -5.492   1.472
  390   2HD   PRO  55          2HD       PRO  55 -10.220  -4.964   0.886
  391    HA   PRO  56           HA       PRO  56  -8.441 -11.649   1.258
  392   1HB   PRO  56          1HB       PRO  56  -8.755 -13.316  -0.895
  393   2HB   PRO  56          2HB       PRO  56  -9.971 -13.149   0.386
  394   1HG   PRO  56          1HG       PRO  56  -9.907 -11.924  -2.326
  395   2HG   PRO  56          2HG       PRO  56 -11.276 -12.583  -1.417
  396   1HD   PRO  56          1HD       PRO  56 -10.757  -9.913  -1.631
  397   2HD   PRO  56          2HD       PRO  56 -11.606 -10.643  -0.251
  398    H    TYR  57           H        TYR  57  -7.936 -12.146  -2.187
  399    HA   TYR  57           HA       TYR  57  -5.750 -10.348  -2.601
  400   1HB   TYR  57          1HB       TYR  57  -4.772 -11.711  -0.764
  401   2HB   TYR  57          2HB       TYR  57  -5.016 -13.166  -1.725
  402    HD1  TYR  57           HD1      TYR  57  -3.081 -10.059  -1.367
  403    HD2  TYR  57           HD2      TYR  57  -3.668 -13.598  -3.725
  404    HE1  TYR  57           HE1      TYR  57  -0.933  -9.637  -2.526
  405    HE2  TYR  57           HE2      TYR  57  -1.517 -13.178  -4.886
  406    HH   TYR  57           HH       TYR  57   0.503 -12.001  -4.636
  407    H    THR  58           H        THR  58  -4.732 -10.732  -4.682
  408    HA   THR  58           HA       THR  58  -5.465 -13.090  -6.265
  409    HB   THR  58           HB       THR  58  -6.586 -11.318  -7.934
  410    HG1  THR  58           HG1      THR  58  -7.412  -9.623  -6.935
  411   1HG2  THR  58          1HG2      THR  58  -7.490 -13.392  -6.509
  412   2HG2  THR  58          2HG2      THR  58  -8.580 -12.319  -7.386
  413   3HG2  THR  58          3HG2      THR  58  -8.335 -12.102  -5.653
  414    H    VAL  59           H        VAL  59  -4.780 -12.584  -8.684
  415    HA   VAL  59           HA       VAL  59  -2.852 -10.494  -9.168
  416    HB   VAL  59           HB       VAL  59  -1.635 -11.831  -7.480
  417   1HG1  VAL  59          1HG1      VAL  59  -1.196 -14.146  -9.215
  418   2HG1  VAL  59          2HG1      VAL  59  -2.881 -13.981  -8.722
  419   3HG1  VAL  59          3HG1      VAL  59  -1.613 -14.093  -7.503
  420   1HG2  VAL  59          1HG2      VAL  59  -0.422 -10.733  -9.392
  421   2HG2  VAL  59          2HG2      VAL  59  -0.482 -12.274 -10.249
  422   3HG2  VAL  59          3HG2      VAL  59   0.417 -12.139  -8.737
  423    H    GLY  60           H        GLY  60  -2.807 -10.305 -11.376
  424   1HA   GLY  60          1HA       GLY  60  -3.406 -12.754 -12.988
  425   2HA   GLY  60          2HA       GLY  60  -3.924 -11.135 -13.460
  Start of MODEL    6
    1    H    PHE   5           H        PHE   5  -8.489   9.599   5.517
    2    HA   PHE   5           HA       PHE   5  -6.184   7.682   5.345
    3   1HB   PHE   5          1HB       PHE   5  -8.611   7.111   4.502
    4   2HB   PHE   5          2HB       PHE   5  -8.182   8.153   3.145
    5    HD1  PHE   5           HD1      PHE   5  -7.687   6.795   1.305
    6    HD2  PHE   5           HD2      PHE   5  -6.152   5.740   5.175
    7    HE1  PHE   5           HE1      PHE   5  -6.393   4.941   0.286
    8    HE2  PHE   5           HE2      PHE   5  -4.858   3.886   4.156
    9    HZ   PHE   5           HZ       PHE   5  -4.979   3.487   1.712
   10    H    GLU   6           H        GLU   6  -4.379   8.523   4.361
   11    HA   GLU   6           HA       GLU   6  -4.700  10.859   2.523
   12   1HB   GLU   6          1HB       GLU   6  -2.789  11.923   3.751
   13   2HB   GLU   6          2HB       GLU   6  -4.220  11.716   4.762
   14   1HG   GLU   6          1HG       GLU   6  -2.600   9.332   4.881
   15   2HG   GLU   6          2HG       GLU   6  -1.610  10.742   5.264
   16    H    ILE   7           H        ILE   7  -4.192   9.264   0.834
   17    HA   ILE   7           HA       ILE   7  -1.328   8.362   0.866
   18    HB   ILE   7           HB       ILE   7  -3.705   7.203  -0.629
   19   1HG1  ILE   7          1HG1      ILE   7  -4.046   6.971   1.789
   20   2HG1  ILE   7          2HG1      ILE   7  -3.627   5.405   1.094
   21   1HG2  ILE   7          1HG2      ILE   7  -1.545   6.671  -1.650
   22   2HG2  ILE   7          2HG2      ILE   7  -2.190   5.234  -0.854
   23   3HG2  ILE   7          3HG2      ILE   7  -0.905   6.165  -0.086
   24   1HD1  ILE   7          1HD1      ILE   7  -1.873   7.268   2.701
   25   2HD1  ILE   7          2HD1      ILE   7  -1.192   5.985   1.701
   26   3HD1  ILE   7          3HD1      ILE   7  -2.271   5.584   3.037
   27    HA   PRO   8           HA       PRO   8  -1.532  11.454  -2.479
   28   1HB   PRO   8          1HB       PRO   8   1.152  11.998  -2.464
   29   2HB   PRO   8          2HB       PRO   8   0.002  12.759  -1.348
   30   1HG   PRO   8          1HG       PRO   8   1.868  10.476  -0.896
   31   2HG   PRO   8          2HG       PRO   8   1.444  11.815   0.184
   32   1HD   PRO   8          1HD       PRO   8   0.401   9.315   0.429
   33   2HD   PRO   8          2HD       PRO   8  -0.459  10.786   0.931
   34    H    ASP   9           H        ASP   9   0.516  11.577  -4.324
   35    HA   ASP   9           HA       ASP   9   0.698   8.756  -5.333
   36   1HB   ASP   9          1HB       ASP   9  -0.263  11.291  -6.448
   37   2HB   ASP   9          2HB       ASP   9   0.888  10.475  -7.506
   38    H    ASP  10           H        ASP  10   2.637  10.626  -3.752
   39    HA   ASP  10           HA       ASP  10   4.804  11.474  -5.335
   40   1HB   ASP  10          1HB       ASP  10   4.213  10.773  -2.576
   41   2HB   ASP  10          2HB       ASP  10   5.865  10.322  -2.998
   42    H    VAL  11           H        VAL  11   5.213   8.529  -3.397
   43    HA   VAL  11           HA       VAL  11   6.865   7.340  -5.532
   44    HB   VAL  11           HB       VAL  11   6.046   6.460  -2.743
   45   1HG1  VAL  11          1HG1      VAL  11   7.690   4.724  -2.923
   46   2HG1  VAL  11          2HG1      VAL  11   8.286   5.361  -4.457
   47   3HG1  VAL  11          3HG1      VAL  11   6.693   4.610  -4.373
   48   1HG2  VAL  11          1HG2      VAL  11   8.829   7.236  -3.454
   49   2HG2  VAL  11          2HG2      VAL  11   7.929   7.520  -1.964
   50   3HG2  VAL  11          3HG2      VAL  11   7.645   8.541  -3.374
   51    HA   PRO  12           HA       PRO  12   3.519   4.939  -7.119
   52   1HB   PRO  12          1HB       PRO  12   4.933   2.983  -8.401
   53   2HB   PRO  12          2HB       PRO  12   4.780   4.636  -9.023
   54   1HG   PRO  12          1HG       PRO  12   7.039   3.357  -7.561
   55   2HG   PRO  12          2HG       PRO  12   7.074   4.510  -8.903
   56   1HD   PRO  12          1HD       PRO  12   7.507   5.190  -6.283
   57   2HD   PRO  12          2HD       PRO  12   6.896   6.318  -7.511
   58    H    LEU  13           H        LEU  13   5.657   2.185  -6.799
   59    HA   LEU  13           HA       LEU  13   4.409   1.341  -4.240
   60   1HB   LEU  13          1HB       LEU  13   3.922   0.229  -6.987
   61   2HB   LEU  13          2HB       LEU  13   3.942  -0.889  -5.625
   62    HG   LEU  13           HG       LEU  13   2.235   1.612  -5.748
   63   1HD1  LEU  13          1HD1      LEU  13   0.787   0.439  -7.006
   64   2HD1  LEU  13          2HD1      LEU  13   0.695  -0.783  -5.737
   65   3HD1  LEU  13          3HD1      LEU  13   1.894  -0.933  -7.022
   66   1HD2  LEU  13          1HD2      LEU  13   3.056   0.146  -3.564
   67   2HD2  LEU  13          2HD2      LEU  13   1.520  -0.614  -3.968
   68   3HD2  LEU  13          3HD2      LEU  13   1.585   1.115  -3.630
   69    HA   PRO  14           HA       PRO  14   8.455  -0.456  -4.027
   70   1HB   PRO  14          1HB       PRO  14   8.125  -2.002  -1.795
   71   2HB   PRO  14          2HB       PRO  14   8.325  -0.242  -1.743
   72   1HG   PRO  14          1HG       PRO  14   5.899  -1.882  -1.386
   73   2HG   PRO  14          2HG       PRO  14   6.302  -0.303  -0.712
   74   1HD   PRO  14          1HD       PRO  14   4.588  -0.798  -2.868
   75   2HD   PRO  14          2HD       PRO  14   5.249   0.778  -2.401
   76    H    ALA  15           H        ALA  15   9.423  -2.799  -3.760
   77    HA   ALA  15           HA       ALA  15   8.438  -4.452  -5.857
   78   1HB   ALA  15          1HB       ALA  15  10.572  -5.082  -5.472
   79   2HB   ALA  15          2HB       ALA  15   9.962  -6.043  -4.124
   80   3HB   ALA  15          3HB       ALA  15  10.539  -4.399  -3.846
   81    H    GLY  16           H        GLY  16   7.060  -6.227  -5.870
   82   1HA   GLY  16          1HA       GLY  16   5.364  -7.636  -5.151
   83   2HA   GLY  16          2HA       GLY  16   6.343  -7.862  -3.706
   84    H    TRP  17           H        TRP  17   4.832  -4.881  -4.903
   85    HA   TRP  17           HA       TRP  17   2.924  -4.965  -2.624
   86   1HB   TRP  17          1HB       TRP  17   5.266  -3.168  -3.052
   87   2HB   TRP  17          2HB       TRP  17   3.809  -2.466  -2.350
   88    HD1  TRP  17           HD1      TRP  17   6.862  -4.053  -1.289
   89    HE1  TRP  17           HE1      TRP  17   6.636  -5.048   1.083
   90    HE3  TRP  17           HE3      TRP  17   1.807  -4.016  -0.822
   91    HZ2  TRP  17           HZ2      TRP  17   4.553  -5.734   2.938
   92    HZ3  TRP  17           HZ3      TRP  17   0.707  -4.829   1.238
   93    HH2  TRP  17           HH2      TRP  17   2.075  -5.696   3.123
   94    H    GLU  18           H        GLU  18   1.588  -5.261  -4.711
   95    HA   GLU  18           HA       GLU  18   1.204  -2.858  -6.385
   96   1HB   GLU  18          1HB       GLU  18   0.908  -5.550  -6.741
   97   2HB   GLU  18          2HB       GLU  18  -0.756  -5.077  -6.385
   98   1HG   GLU  18          1HG       GLU  18  -0.984  -3.979  -8.357
   99   2HG   GLU  18          2HG       GLU  18   0.624  -3.262  -8.247
  100    H    MET  19           H        MET  19  -1.512  -2.845  -6.649
  101    HA   MET  19           HA       MET  19  -2.880  -2.736  -4.094
  102   1HB   MET  19          1HB       MET  19  -3.041  -0.324  -3.929
  103   2HB   MET  19          2HB       MET  19  -1.349  -0.805  -3.963
  104   1HG   MET  19          1HG       MET  19  -1.062  -0.077  -6.194
  105   2HG   MET  19          2HG       MET  19  -2.797  -0.057  -6.501
  106   1HE   MET  19          1HE       MET  19   0.256   1.623  -4.956
  107   2HE   MET  19          2HE       MET  19  -0.170   3.296  -5.308
  108   3HE   MET  19          3HE       MET  19  -0.126   2.113  -6.612
  109    H    ALA  20           H        ALA  20  -5.089  -2.266  -4.307
  110    HA   ALA  20           HA       ALA  20  -6.171  -1.586  -6.966
  111   1HB   ALA  20          1HB       ALA  20  -5.479  -4.164  -6.422
  112   2HB   ALA  20          2HB       ALA  20  -6.795  -3.725  -7.511
  113   3HB   ALA  20          3HB       ALA  20  -7.143  -4.151  -5.835
  114    H    LYS  21           H        LYS  21  -8.296  -0.794  -6.766
  115    HA   LYS  21           HA       LYS  21  -9.230  -0.262  -4.025
  116   1HB   LYS  21          1HB       LYS  21  -9.811   0.617  -6.824
  117   2HB   LYS  21          2HB       LYS  21 -11.090   0.830  -5.629
  118   1HG   LYS  21          1HG       LYS  21 -10.030   2.747  -5.061
  119   2HG   LYS  21          2HG       LYS  21  -8.826   1.713  -4.293
  120   1HD   LYS  21          1HD       LYS  21  -7.343   1.883  -6.081
  121   2HD   LYS  21          2HD       LYS  21  -8.623   2.247  -7.238
  122   1HE   LYS  21          1HE       LYS  21  -8.907   4.487  -6.246
  123   2HE   LYS  21          2HE       LYS  21  -7.651   4.122  -5.049
  124   1HZ   LYS  21          1HZ       LYS  21  -7.341   4.151  -8.009
  125   2HZ   LYS  21          2HZ       LYS  21  -6.143   3.622  -6.926
  126   3HZ   LYS  21          3HZ       LYS  21  -6.647   5.244  -6.913
  127    H    THR  22           H        THR  22 -10.925  -1.302  -3.040
  128    HA   THR  22           HA       THR  22 -11.986  -3.754  -4.161
  129    HB   THR  22           HB       THR  22 -13.204  -3.824  -2.059
  130    HG1  THR  22           HG1      THR  22 -13.198  -1.939  -0.735
  131   1HG2  THR  22          1HG2      THR  22 -10.510  -3.747  -2.228
  132   2HG2  THR  22          2HG2      THR  22 -11.370  -3.999  -0.708
  133   3HG2  THR  22          3HG2      THR  22 -10.776  -2.393  -1.130
  134    H    SER  23           H        SER  23 -14.711  -3.407  -3.239
  135    HA   SER  23           HA       SER  23 -15.903  -2.360  -5.673
  136   1HB   SER  23          1HB       SER  23 -16.540  -4.177  -3.721
  137   2HB   SER  23          2HB       SER  23 -17.601  -2.830  -3.305
  138    HG   SER  23           HG       SER  23 -17.605  -4.488  -5.514
  139    H    SER  24           H        SER  24 -14.721  -0.709  -2.997
  140    HA   SER  24           HA       SER  24 -16.775   1.458  -3.314
  141   1HB   SER  24          1HB       SER  24 -15.956  -0.005  -1.065
  142   2HB   SER  24          2HB       SER  24 -15.163   1.561  -0.894
  143    HG   SER  24           HG       SER  24 -17.029   2.232  -0.250
  144    H    GLY  25           H        GLY  25 -13.348   0.657  -3.170
  145   1HA   GLY  25          1HA       GLY  25 -12.027   2.266  -4.702
  146   2HA   GLY  25          2HA       GLY  25 -12.674   3.529  -3.659
  147    H    GLN  26           H        GLN  26 -12.233   0.990  -1.614
  148    HA   GLN  26           HA       GLN  26  -9.997   2.159  -0.275
  149   1HB   GLN  26          1HB       GLN  26 -11.241  -0.609  -0.222
  150   2HB   GLN  26          2HB       GLN  26 -10.068  -0.035   0.963
  151   1HG   GLN  26          1HG       GLN  26 -11.940   2.013   0.880
  152   2HG   GLN  26          2HG       GLN  26 -12.927   0.559   0.738
  153   1HE2  GLN  26          1HE2      GLN  26 -13.178  -0.740   2.613
  154   2HE2  GLN  26          2HE2      GLN  26 -12.414  -0.412   4.093
  155    H    ARG  27           H        ARG  27  -8.442   2.385  -2.088
  156    HA   ARG  27           HA       ARG  27  -7.396   0.237  -3.626
  157   1HB   ARG  27          1HB       ARG  27  -5.388   1.789  -3.765
  158   2HB   ARG  27          2HB       ARG  27  -6.926   2.545  -4.162
  159   1HG   ARG  27          1HG       ARG  27  -6.815   3.950  -2.395
  160   2HG   ARG  27          2HG       ARG  27  -6.311   2.656  -1.304
  161   1HD   ARG  27          1HD       ARG  27  -4.150   3.320  -1.439
  162   2HD   ARG  27          2HD       ARG  27  -4.206   3.260  -3.210
  163    HE   ARG  27           HE       ARG  27  -5.624   5.546  -2.020
  164   1HH1  ARG  27          1HH1      ARG  27  -2.624   4.334  -3.312
  165   2HH1  ARG  27          2HH1      ARG  27  -2.034   5.909  -3.708
  166   1HH2  ARG  27          1HH2      ARG  27  -4.833   7.576  -2.546
  167   2HH2  ARG  27          2HH2      ARG  27  -3.271   7.732  -3.279
  168    H    TYR  28           H        TYR  28  -7.226  -1.547  -2.092
  169    HA   TYR  28           HA       TYR  28  -5.384  -1.346   0.166
  170   1HB   TYR  28          1HB       TYR  28  -5.889  -3.755   0.380
  171   2HB   TYR  28          2HB       TYR  28  -7.361  -2.809   0.182
  172    HD1  TYR  28           HD1      TYR  28  -8.747  -3.038  -1.762
  173    HD2  TYR  28           HD2      TYR  28  -4.987  -5.096  -1.536
  174    HE1  TYR  28           HE1      TYR  28  -9.412  -4.454  -3.675
  175    HE2  TYR  28           HE2      TYR  28  -5.661  -6.510  -3.447
  176    HH   TYR  28           HH       TYR  28  -8.648  -6.939  -4.481
  177    H    PHE  29           H        PHE  29  -3.229  -1.688   0.071
  178    HA   PHE  29           HA       PHE  29  -1.966  -2.153  -2.498
  179   1HB   PHE  29          1HB       PHE  29  -0.976  -1.865   0.351
  180   2HB   PHE  29          2HB       PHE  29   0.093  -1.939  -1.055
  181    HD1  PHE  29           HD1      PHE  29  -2.540   0.032   0.648
  182    HD2  PHE  29           HD2      PHE  29   0.190  -0.120  -2.658
  183    HE1  PHE  29           HE1      PHE  29  -2.991   2.415   0.165
  184    HE2  PHE  29           HE2      PHE  29  -0.252   2.264  -3.138
  185    HZ   PHE  29           HZ       PHE  29  -1.845   3.533  -1.727
  186    H    LYS  30           H        LYS  30  -1.861  -4.099  -3.355
  187    HA   LYS  30           HA       LYS  30  -2.095  -6.580  -1.896
  188   1HB   LYS  30          1HB       LYS  30  -1.389  -5.742  -4.702
  189   2HB   LYS  30          2HB       LYS  30  -1.557  -7.434  -4.243
  190   1HG   LYS  30          1HG       LYS  30  -3.810  -6.045  -3.236
  191   2HG   LYS  30          2HG       LYS  30  -3.575  -5.497  -4.887
  192   1HD   LYS  30          1HD       LYS  30  -3.135  -8.245  -5.043
  193   2HD   LYS  30          2HD       LYS  30  -4.493  -8.099  -3.929
  194   1HE   LYS  30          1HE       LYS  30  -5.720  -7.994  -5.874
  195   2HE   LYS  30          2HE       LYS  30  -5.210  -6.295  -5.867
  196   1HZ   LYS  30          1HZ       LYS  30  -4.638  -7.474  -7.956
  197   2HZ   LYS  30          2HZ       LYS  30  -3.643  -8.524  -7.064
  198   3HZ   LYS  30          3HZ       LYS  30  -3.276  -6.868  -7.147
  199    H    ASN  31           H        ASN  31  -0.451  -7.924  -1.256
  200    HA   ASN  31           HA       ASN  31   2.350  -6.933  -1.659
  201   1HB   ASN  31          1HB       ASN  31   1.161  -7.130   0.649
  202   2HB   ASN  31          2HB       ASN  31   1.386  -8.865   0.449
  203   1HD2  ASN  31          1HD2      ASN  31   2.852  -8.473   2.452
  204   2HD2  ASN  31          2HD2      ASN  31   4.466  -8.040   2.152
  205    H    HIS  32           H        HIS  32   3.272  -8.137  -3.342
  206    HA   HIS  32           HA       HIS  32   2.467 -10.977  -3.642
  207   1HB   HIS  32          1HB       HIS  32   4.435  -9.256  -5.183
  208   2HB   HIS  32          2HB       HIS  32   3.812 -10.819  -5.692
  209    HD1  HIS  32           HD1      HIS  32   1.241 -10.942  -6.294
  210    HD2  HIS  32           HD2      HIS  32   2.671  -7.082  -5.625
  211    HE1  HIS  32           HE1      HIS  32  -0.539  -9.356  -7.151
  212    H    ILE  33           H        ILE  33   4.556  -9.338  -1.656
  213    HA   ILE  33           HA       ILE  33   6.981 -10.888  -1.830
  214    HB   ILE  33           HB       ILE  33   5.651  -9.411   0.477
  215   1HG1  ILE  33          1HG1      ILE  33   5.930  -7.897  -1.400
  216   2HG1  ILE  33          2HG1      ILE  33   7.205  -7.553  -0.227
  217   1HG2  ILE  33          1HG2      ILE  33   8.421  -9.198   0.688
  218   2HG2  ILE  33          2HG2      ILE  33   8.162 -10.874   0.206
  219   3HG2  ILE  33          3HG2      ILE  33   7.385 -10.245   1.659
  220   1HD1  ILE  33          1HD1      ILE  33   8.735  -9.063  -1.516
  221   2HD1  ILE  33          2HD1      ILE  33   8.213  -7.651  -2.437
  222   3HD1  ILE  33          3HD1      ILE  33   7.476  -9.225  -2.740
  223    H    ASP  34           H        ASP  34   4.042 -11.045   0.135
  224    HA   ASP  34           HA       ASP  34   4.646 -13.912   0.666
  225   1HB   ASP  34          1HB       ASP  34   4.674 -11.769   2.482
  226   2HB   ASP  34          2HB       ASP  34   3.142 -12.591   2.781
  227    H    GLN  35           H        GLN  35   2.775 -12.173  -1.158
  228    HA   GLN  35           HA       GLN  35   0.601 -12.371  -2.026
  229   1HB   GLN  35          1HB       GLN  35   1.569 -14.853  -1.485
  230   2HB   GLN  35          2HB       GLN  35   0.121 -14.860  -0.479
  231   1HG   GLN  35          1HG       GLN  35  -1.290 -14.389  -2.361
  232   2HG   GLN  35          2HG       GLN  35   0.095 -14.022  -3.389
  233   1HE2  GLN  35          1HE2      GLN  35  -0.771 -15.775  -4.856
  234   2HE2  GLN  35          2HE2      GLN  35  -0.437 -17.397  -4.484
  235    H    THR  36           H        THR  36  -0.095 -10.529  -0.637
  236    HA   THR  36           HA       THR  36  -2.362 -11.246   1.054
  237    HB   THR  36           HB       THR  36  -1.052  -9.836   2.968
  238    HG1  THR  36           HG1      THR  36   1.048 -10.119   2.868
  239   1HG2  THR  36          1HG2      THR  36  -0.229 -12.621   3.094
  240   2HG2  THR  36          2HG2      THR  36  -1.907 -12.465   2.571
  241   3HG2  THR  36          3HG2      THR  36  -1.388 -11.752   4.098
  242    H    THR  37           H        THR  37  -3.805  -9.550   1.022
  243    HA   THR  37           HA       THR  37  -2.924  -6.980  -0.196
  244    HB   THR  37           HB       THR  37  -5.403  -6.670  -0.426
  245    HG1  THR  37           HG1      THR  37  -5.666  -9.300   0.541
  246   1HG2  THR  37          1HG2      THR  37  -5.518  -8.044  -2.254
  247   2HG2  THR  37          2HG2      THR  37  -4.953  -9.455  -1.361
  248   3HG2  THR  37          3HG2      THR  37  -3.799  -8.238  -1.909
  249    H    THR  38           H        THR  38  -2.888  -5.066   1.010
  250    HA   THR  38           HA       THR  38  -4.027  -5.182   3.782
  251    HB   THR  38           HB       THR  38  -1.530  -5.542   3.618
  252    HG1  THR  38           HG1      THR  38  -2.368  -3.141   4.871
  253   1HG2  THR  38          1HG2      THR  38  -0.161  -3.497   3.135
  254   2HG2  THR  38          2HG2      THR  38  -1.631  -2.691   2.587
  255   3HG2  THR  38          3HG2      THR  38  -1.025  -4.102   1.724
  256    H    TRP  39           H        TRP  39  -4.751  -3.149   4.617
  257    HA   TRP  39           HA       TRP  39  -5.736  -1.264   2.643
  258   1HB   TRP  39          1HB       TRP  39  -5.649  -1.259   5.678
  259   2HB   TRP  39          2HB       TRP  39  -6.606  -0.147   4.702
  260    HD1  TRP  39           HD1      TRP  39  -7.109  -3.103   6.612
  261    HE1  TRP  39           HE1      TRP  39  -9.096  -4.503   5.761
  262    HE3  TRP  39           HE3      TRP  39  -7.727  -1.043   1.977
  263    HZ2  TRP  39           HZ2      TRP  39 -10.730  -4.724   3.430
  264    HZ3  TRP  39           HZ3      TRP  39  -9.506  -1.874   0.463
  265    HH2  TRP  39           HH2      TRP  39 -11.004  -3.713   1.185
  266    H    GLN  40           H        GLN  40  -3.343  -1.118   5.292
  267    HA   GLN  40           HA       GLN  40  -2.498   1.563   4.994
  268   1HB   GLN  40          1HB       GLN  40  -1.518  -0.980   6.122
  269   2HB   GLN  40          2HB       GLN  40  -0.240   0.168   5.721
  270   1HG   GLN  40          1HG       GLN  40  -0.760   1.445   7.503
  271   2HG   GLN  40          2HG       GLN  40  -2.445   1.540   6.993
  272   1HE2  GLN  40          1HE2      GLN  40  -0.544  -1.358   7.968
  273   2HE2  GLN  40          2HE2      GLN  40  -1.563  -1.778   9.259
  274    H    ASP  41           H        ASP  41  -0.144   2.068   4.192
  275    HA   ASP  41           HA       ASP  41   0.086   1.007   1.403
  276   1HB   ASP  41          1HB       ASP  41   1.106   3.564   2.679
  277   2HB   ASP  41          2HB       ASP  41   1.158   3.174   0.961
  278    HA   PRO  42           HA       PRO  42   3.966  -0.699   2.711
  279   1HB   PRO  42          1HB       PRO  42   4.890  -1.481   0.273
  280   2HB   PRO  42          2HB       PRO  42   3.601  -2.334   1.136
  281   1HG   PRO  42          1HG       PRO  42   3.438  -0.518  -1.190
  282   2HG   PRO  42          2HG       PRO  42   2.400  -1.874  -0.740
  283   1HD   PRO  42          1HD       PRO  42   1.840   0.850  -0.369
  284   2HD   PRO  42          2HD       PRO  42   0.966  -0.513   0.356
  285    H    ARG  43           H        ARG  43   3.622   2.238   1.272
  286    HA   ARG  43           HA       ARG  43   6.570   2.706   1.273
  287   1HB   ARG  43          1HB       ARG  43   6.288   3.989  -0.832
  288   2HB   ARG  43          2HB       ARG  43   5.797   2.308  -1.038
  289   1HG   ARG  43          1HG       ARG  43   3.421   3.129  -0.442
  290   2HG   ARG  43          2HG       ARG  43   4.047   4.749  -0.745
  291   1HD   ARG  43          1HD       ARG  43   4.951   3.497  -2.973
  292   2HD   ARG  43          2HD       ARG  43   3.480   2.555  -2.669
  293    HE   ARG  43           HE       ARG  43   3.568   5.343  -3.480
  294   1HH1  ARG  43          1HH1      ARG  43   1.836   3.008  -1.565
  295   2HH1  ARG  43          2HH1      ARG  43   0.347   3.882  -1.647
  296   1HH2  ARG  43          1HH2      ARG  43   1.622   6.458  -3.574
  297   2HH2  ARG  43          2HH2      ARG  43   0.224   5.820  -2.777
  298    H    LYS  44           H        LYS  44   3.304   4.151   1.252
  299    HA   LYS  44           HA       LYS  44   4.366   6.690   2.355
  300   1HB   LYS  44          1HB       LYS  44   1.602   5.727   1.550
  301   2HB   LYS  44          2HB       LYS  44   1.984   7.376   2.043
  302   1HG   LYS  44          1HG       LYS  44   3.858   6.525   0.027
  303   2HG   LYS  44          2HG       LYS  44   2.216   6.249  -0.552
  304   1HD   LYS  44          1HD       LYS  44   2.004   8.452  -0.961
  305   2HD   LYS  44          2HD       LYS  44   2.251   8.787   0.753
  306   1HE   LYS  44          1HE       LYS  44   4.821   8.223  -0.162
  307   2HE   LYS  44          2HE       LYS  44   4.101   9.164  -1.482
  308   1HZ   LYS  44          1HZ       LYS  44   3.707   9.951   1.341
  309   2HZ   LYS  44          2HZ       LYS  44   3.572  10.906  -0.058
  310   3HZ   LYS  44          3HZ       LYS  44   5.103  10.431   0.506
  311    H    ALA  45           H        ALA  45   2.882   3.746   3.444
  312    HA   ALA  45           HA       ALA  45   2.752   4.866   6.209
  313   1HB   ALA  45          1HB       ALA  45   0.569   4.179   4.459
  314   2HB   ALA  45          2HB       ALA  45   0.496   4.823   6.098
  315   3HB   ALA  45          3HB       ALA  45   0.571   3.081   5.838
  316    H    MET  46           H        MET  46   4.816   3.511   6.218
  317    HA   MET  46           HA       MET  46   4.688   0.638   5.907
  318   1HB   MET  46          1HB       MET  46   6.580   2.564   7.285
  319   2HB   MET  46          2HB       MET  46   6.907   0.837   7.138
  320   1HG   MET  46          1HG       MET  46   7.137   0.945   4.815
  321   2HG   MET  46          2HG       MET  46   6.179   2.420   4.689
  322   1HE   MET  46          1HE       MET  46   9.535   0.759   5.444
  323   2HE   MET  46          2HE       MET  46  10.580   1.991   4.739
  324   3HE   MET  46          3HE       MET  46   9.288   1.283   3.773
  325    H    LEU  47           H        LEU  47   5.643   2.187   8.953
  326    HA   LEU  47           HA       LEU  47   4.221   0.099  10.472
  327   1HB   LEU  47          1HB       LEU  47   6.313   2.160  10.876
  328   2HB   LEU  47          2HB       LEU  47   5.322   1.807  12.292
  329    HG   LEU  47           HG       LEU  47   6.539  -0.406  10.638
  330   1HD1  LEU  47          1HD1      LEU  47   8.285  -0.407  12.553
  331   2HD1  LEU  47          2HD1      LEU  47   7.784   1.262  12.823
  332   3HD1  LEU  47          3HD1      LEU  47   8.477   0.789  11.272
  333   1HD2  LEU  47          1HD2      LEU  47   6.302  -1.622  12.797
  334   2HD2  LEU  47          2HD2      LEU  47   4.756  -1.017  12.203
  335   3HD2  LEU  47          3HD2      LEU  47   5.590  -0.176  13.511
  336    H    SER  48           H        SER  48   2.057   1.020   9.624
  337    HA   SER  48           HA       SER  48   1.147   3.224  11.447
  338   1HB   SER  48          1HB       SER  48   1.419   3.320   8.706
  339   2HB   SER  48          2HB       SER  48  -0.275   2.863   8.890
  340    HG   SER  48           HG       SER  48  -0.445   4.962   9.129
  341    H    GLN  49           H        GLN  49   0.915   0.595  12.295
  342    HA   GLN  49           HA       GLN  49  -2.021   0.082  11.965
  343   1HB   GLN  49          1HB       GLN  49  -0.303  -1.427  10.708
  344   2HB   GLN  49          2HB       GLN  49   0.041  -2.093  12.305
  345   1HG   GLN  49          1HG       GLN  49  -2.381  -2.593  12.585
  346   2HG   GLN  49          2HG       GLN  49  -2.672  -2.000  10.951
  347   1HE2  GLN  49          1HE2      GLN  49  -3.455  -4.390  10.724
  348   2HE2  GLN  49          2HE2      GLN  49  -2.283  -5.537  10.286
  349    H    MET  50           H        MET  50  -2.924  -1.148  13.842
  350    HA   MET  50           HA       MET  50  -3.239  -1.364  16.175
  351   1HB   MET  50          1HB       MET  50  -0.330  -1.916  15.632
  352   2HB   MET  50          2HB       MET  50  -0.932  -1.951  17.288
  353   1HG   MET  50          1HG       MET  50  -2.567  -3.650  16.720
  354   2HG   MET  50          2HG       MET  50  -2.161  -3.526  15.008
  355   1HE   MET  50          1HE       MET  50  -1.170  -6.507  14.848
  356   2HE   MET  50          2HE       MET  50  -2.495  -5.891  15.832
  357   3HE   MET  50          3HE       MET  50  -1.267  -6.921  16.565
  358   1H    GLY  51          1H        GLY  51 -13.365  -4.244  11.207
  359   2H    GLY  51          2H        GLY  51 -13.547  -5.922  11.008
  360   3H    GLY  51          3H        GLY  51 -14.120  -5.162  12.416
  361   1HA   GLY  51          1HA       GLY  51 -16.026  -5.535  11.133
  362   2HA   GLY  51          2HA       GLY  51 -15.636  -3.827  10.922
  363    H    THR  52           H        THR  52 -13.301  -4.370   9.223
  364    HA   THR  52           HA       THR  52 -14.557  -5.613   6.815
  365    HB   THR  52           HB       THR  52 -13.214  -2.897   6.825
  366    HG1  THR  52           HG1      THR  52 -15.344  -2.083   6.777
  367   1HG2  THR  52          1HG2      THR  52 -14.388  -4.686   4.820
  368   2HG2  THR  52          2HG2      THR  52 -13.295  -3.320   4.604
  369   3HG2  THR  52          3HG2      THR  52 -15.032  -3.047   4.749
  370    HA   PRO  53           HA       PRO  53 -10.181  -6.895   7.226
  371   1HB   PRO  53          1HB       PRO  53 -10.541  -9.363   6.099
  372   2HB   PRO  53          2HB       PRO  53 -10.842  -9.030   7.816
  373   1HG   PRO  53          1HG       PRO  53 -12.771  -9.257   5.556
  374   2HG   PRO  53          2HG       PRO  53 -12.920  -9.823   7.226
  375   1HD   PRO  53          1HD       PRO  53 -14.108  -7.550   6.280
  376   2HD   PRO  53          2HD       PRO  53 -13.648  -7.785   7.979
  377    HA   PRO  54           HA       PRO  54  -8.947  -6.051   3.087
  378   1HB   PRO  54          1HB       PRO  54  -6.847  -7.765   2.683
  379   2HB   PRO  54          2HB       PRO  54  -6.740  -6.319   3.704
  380   1HG   PRO  54          1HG       PRO  54  -7.175  -9.169   4.490
  381   2HG   PRO  54          2HG       PRO  54  -6.128  -7.948   5.231
  382   1HD   PRO  54          1HD       PRO  54  -8.536  -8.602   6.264
  383   2HD   PRO  54          2HD       PRO  54  -7.880  -6.951   6.365
  384    HA   PRO  55           HA       PRO  55 -10.702  -8.904   0.253
  385   1HB   PRO  55          1HB       PRO  55  -9.073  -8.756  -1.951
  386   2HB   PRO  55          2HB       PRO  55 -10.186  -7.457  -1.476
  387   1HG   PRO  55          1HG       PRO  55  -7.253  -7.686  -1.050
  388   2HG   PRO  55          2HG       PRO  55  -8.226  -6.272  -1.469
  389   1HD   PRO  55          1HD       PRO  55  -7.299  -6.773   1.045
  390   2HD   PRO  55          2HD       PRO  55  -8.779  -5.848   0.712
  391    HA   PRO  56           HA       PRO  56  -8.661 -12.801   0.372
  392   1HB   PRO  56          1HB       PRO  56  -9.444 -14.036  -1.935
  393   2HB   PRO  56          2HB       PRO  56 -10.544 -13.737  -0.576
  394   1HG   PRO  56          1HG       PRO  56 -10.290 -12.298  -3.152
  395   2HG   PRO  56          2HG       PRO  56 -11.725 -12.615  -2.169
  396   1HD   PRO  56          1HD       PRO  56 -10.366 -10.206  -2.271
  397   2HD   PRO  56          2HD       PRO  56 -11.464 -10.710  -0.970
  398    H    TYR  57           H        TYR  57  -7.550 -10.506  -1.757
  399    HA   TYR  57           HA       TYR  57  -5.566 -10.297  -3.007
  400   1HB   TYR  57          1HB       TYR  57  -4.716 -11.314  -0.868
  401   2HB   TYR  57          2HB       TYR  57  -4.881 -12.903  -1.607
  402    HD1  TYR  57           HD1      TYR  57  -3.558 -13.471  -3.665
  403    HD2  TYR  57           HD2      TYR  57  -2.878  -9.882  -1.410
  404    HE1  TYR  57           HE1      TYR  57  -1.348 -13.203  -4.757
  405    HE2  TYR  57           HE2      TYR  57  -0.670  -9.611  -2.501
  406    HH   TYR  57           HH       TYR  57   0.815 -12.089  -4.272
  407    H    THR  58           H        THR  58  -4.606 -11.100  -4.968
  408    HA   THR  58           HA       THR  58  -5.606 -13.689  -6.043
  409    HB   THR  58           HB       THR  58  -6.565 -12.586  -7.995
  410    HG1  THR  58           HG1      THR  58  -5.343 -10.836  -8.321
  411   1HG2  THR  58          1HG2      THR  58  -7.889 -12.736  -5.831
  412   2HG2  THR  58          2HG2      THR  58  -8.444 -11.524  -6.986
  413   3HG2  THR  58          3HG2      THR  58  -7.497 -11.036  -5.580
  414    H    VAL  59           H        VAL  59  -4.825 -13.043  -8.735
  415    HA   VAL  59           HA       VAL  59  -2.171 -11.952  -8.849
  416    HB   VAL  59           HB       VAL  59  -1.699 -13.926  -7.469
  417   1HG1  VAL  59          1HG1      VAL  59  -3.027 -15.726  -7.760
  418   2HG1  VAL  59          2HG1      VAL  59  -2.104 -16.082  -9.220
  419   3HG1  VAL  59          3HG1      VAL  59  -3.585 -15.130  -9.323
  420   1HG2  VAL  59          1HG2      VAL  59   0.238 -13.963  -8.620
  421   2HG2  VAL  59          2HG2      VAL  59  -0.580 -13.450 -10.096
  422   3HG2  VAL  59          3HG2      VAL  59  -0.482 -15.164  -9.692
  423    H    GLY  60           H        GLY  60  -3.804 -11.213 -10.647
  424   1HA   GLY  60          1HA       GLY  60  -3.215 -12.836 -13.064
  425   2HA   GLY  60          2HA       GLY  60  -4.896 -12.411 -12.742
  Start of MODEL    7
    1    H    PHE   5           H        PHE   5  -5.267   4.494   5.125
    2    HA   PHE   5           HA       PHE   5  -5.924   6.798   6.936
    3   1HB   PHE   5          1HB       PHE   5  -4.192   5.303   7.834
    4   2HB   PHE   5          2HB       PHE   5  -3.278   5.436   6.332
    5    HD1  PHE   5           HD1      PHE   5  -1.672   7.126   6.088
    6    HD2  PHE   5           HD2      PHE   5  -4.740   7.540   9.065
    7    HE1  PHE   5           HE1      PHE   5  -0.572   9.179   6.935
    8    HE2  PHE   5           HE2      PHE   5  -3.640   9.595   9.913
    9    HZ   PHE   5           HZ       PHE   5  -1.556  10.414   8.848
   10    H    GLU   6           H        GLU   6  -6.073   6.222   3.844
   11    HA   GLU   6           HA       GLU   6  -5.794   7.522   1.894
   12   1HB   GLU   6          1HB       GLU   6  -6.023   9.250   4.163
   13   2HB   GLU   6          2HB       GLU   6  -4.832   9.951   3.065
   14   1HG   GLU   6          1HG       GLU   6  -6.820  10.812   2.200
   15   2HG   GLU   6          2HG       GLU   6  -6.607   9.362   1.217
   16    H    ILE   7           H        ILE   7  -4.072   7.118   0.577
   17    HA   ILE   7           HA       ILE   7  -1.317   7.683   1.631
   18    HB   ILE   7           HB       ILE   7  -2.240   5.681  -0.462
   19   1HG1  ILE   7          1HG1      ILE   7  -3.125   5.141   1.785
   20   2HG1  ILE   7          2HG1      ILE   7  -1.879   3.991   1.304
   21   1HG2  ILE   7          1HG2      ILE   7   0.379   5.827   1.052
   22   2HG2  ILE   7          2HG2      ILE   7   0.152   6.531  -0.549
   23   3HG2  ILE   7          3HG2      ILE   7  -0.011   4.790  -0.319
   24   1HD1  ILE   7          1HD1      ILE   7  -1.354   4.588   3.554
   25   2HD1  ILE   7          2HD1      ILE   7  -1.633   6.302   3.239
   26   3HD1  ILE   7          3HD1      ILE   7  -0.222   5.497   2.553
   27    HA   PRO   8           HA       PRO   8  -2.242  10.329  -2.124
   28   1HB   PRO   8          1HB       PRO   8  -1.602  12.735  -0.981
   29   2HB   PRO   8          2HB       PRO   8  -3.232  12.038  -0.924
   30   1HG   PRO   8          1HG       PRO   8  -1.096  12.063   1.156
   31   2HG   PRO   8          2HG       PRO   8  -2.845  12.265   1.335
   32   1HD   PRO   8          1HD       PRO   8  -1.533   9.940   1.889
   33   2HD   PRO   8          2HD       PRO   8  -3.233  10.014   1.379
   34    H    ASP   9           H        ASP   9  -0.479  12.464  -2.527
   35    HA   ASP   9           HA       ASP   9   1.747  12.986  -3.099
   36   1HB   ASP   9          1HB       ASP   9   1.756  11.817  -0.531
   37   2HB   ASP   9          2HB       ASP   9   3.077  11.044  -1.408
   38    H    ASP  10           H        ASP  10   0.231  10.263  -3.951
   39    HA   ASP  10           HA       ASP  10   0.731   8.434  -5.367
   40   1HB   ASP  10          1HB       ASP  10   1.886  10.922  -6.260
   41   2HB   ASP  10          2HB       ASP  10   2.897   9.577  -6.790
   42    H    VAL  11           H        VAL  11   1.689   7.295  -3.363
   43    HA   VAL  11           HA       VAL  11   4.466   7.275  -2.776
   44    HB   VAL  11           HB       VAL  11   3.864   5.051  -1.778
   45   1HG1  VAL  11          1HG1      VAL  11   3.398   7.205  -0.614
   46   2HG1  VAL  11          2HG1      VAL  11   2.229   5.950  -0.202
   47   3HG1  VAL  11          3HG1      VAL  11   1.793   7.220  -1.345
   48   1HG2  VAL  11          1HG2      VAL  11   2.214   4.598  -3.736
   49   2HG2  VAL  11          2HG2      VAL  11   1.070   5.544  -2.785
   50   3HG2  VAL  11          3HG2      VAL  11   1.757   4.062  -2.120
   51    HA   PRO  12           HA       PRO  12   6.060   5.178  -6.326
   52   1HB   PRO  12          1HB       PRO  12   8.434   4.303  -5.287
   53   2HB   PRO  12          2HB       PRO  12   8.139   5.993  -5.734
   54   1HG   PRO  12          1HG       PRO  12   8.092   4.699  -3.051
   55   2HG   PRO  12          2HG       PRO  12   8.693   6.295  -3.522
   56   1HD   PRO  12          1HD       PRO  12   6.279   5.869  -2.303
   57   2HD   PRO  12          2HD       PRO  12   6.621   7.255  -3.358
   58    H    LEU  13           H        LEU  13   5.527   3.614  -3.282
   59    HA   LEU  13           HA       LEU  13   4.966   1.395  -2.742
   60   1HB   LEU  13          1HB       LEU  13   4.201   1.879  -5.500
   61   2HB   LEU  13          2HB       LEU  13   4.645   0.190  -5.263
   62    HG   LEU  13           HG       LEU  13   2.258   0.515  -4.793
   63   1HD1  LEU  13          1HD1      LEU  13   3.869  -0.971  -3.355
   64   2HD1  LEU  13          2HD1      LEU  13   2.209  -0.717  -2.818
   65   3HD1  LEU  13          3HD1      LEU  13   3.523   0.212  -2.096
   66   1HD2  LEU  13          1HD2      LEU  13   1.882   1.886  -2.557
   67   2HD2  LEU  13          2HD2      LEU  13   1.930   2.708  -4.116
   68   3HD2  LEU  13          3HD2      LEU  13   3.355   2.705  -3.076
   69    HA   PRO  14           HA       PRO  14   8.883  -0.574  -3.449
   70   1HB   PRO  14          1HB       PRO  14   8.648  -2.461  -1.474
   71   2HB   PRO  14          2HB       PRO  14   9.051  -0.763  -1.170
   72   1HG   PRO  14          1HG       PRO  14   6.606  -2.211  -0.566
   73   2HG   PRO  14          2HG       PRO  14   7.143  -0.638   0.012
   74   1HD   PRO  14          1HD       PRO  14   5.242  -1.257  -2.077
   75   2HD   PRO  14          2HD       PRO  14   5.622   0.317  -1.357
   76    H    ALA  15           H        ALA  15   9.606  -3.063  -3.607
   77    HA   ALA  15           HA       ALA  15   8.182  -4.200  -5.835
   78   1HB   ALA  15          1HB       ALA  15   9.950  -5.989  -4.330
   79   2HB   ALA  15          2HB       ALA  15  10.662  -4.400  -4.607
   80   3HB   ALA  15          3HB       ALA  15  10.117  -5.373  -5.974
   81    H    GLY  16           H        GLY  16   6.960  -6.171  -5.921
   82   1HA   GLY  16          1HA       GLY  16   5.409  -7.728  -5.166
   83   2HA   GLY  16          2HA       GLY  16   6.387  -7.847  -3.706
   84    H    TRP  17           H        TRP  17   4.940  -4.846  -4.840
   85    HA   TRP  17           HA       TRP  17   2.886  -5.057  -2.692
   86   1HB   TRP  17          1HB       TRP  17   5.208  -3.193  -2.943
   87   2HB   TRP  17          2HB       TRP  17   3.714  -2.577  -2.241
   88    HD1  TRP  17           HD1      TRP  17   6.774  -4.287  -1.240
   89    HE1  TRP  17           HE1      TRP  17   6.491  -5.401   1.072
   90    HE3  TRP  17           HE3      TRP  17   1.716  -4.121  -0.816
   91    HZ2  TRP  17           HZ2      TRP  17   4.369  -6.126   2.866
   92    HZ3  TRP  17           HZ3      TRP  17   0.571  -5.016   1.185
   93    HH2  TRP  17           HH2      TRP  17   1.890  -6.023   3.028
   94    H    GLU  18           H        GLU  18   1.520  -5.248  -4.711
   95    HA   GLU  18           HA       GLU  18   1.227  -2.811  -6.366
   96   1HB   GLU  18          1HB       GLU  18   0.842  -5.486  -6.777
   97   2HB   GLU  18          2HB       GLU  18  -0.806  -4.968  -6.404
   98   1HG   GLU  18          1HG       GLU  18  -1.008  -3.839  -8.358
   99   2HG   GLU  18          2HG       GLU  18   0.611  -3.150  -8.229
  100    H    MET  19           H        MET  19  -1.477  -2.669  -6.616
  101    HA   MET  19           HA       MET  19  -2.857  -2.638  -4.077
  102   1HB   MET  19          1HB       MET  19  -2.885  -0.239  -3.733
  103   2HB   MET  19          2HB       MET  19  -1.219  -0.799  -3.803
  104   1HG   MET  19          1HG       MET  19  -2.565   0.157  -6.316
  105   2HG   MET  19          2HG       MET  19  -1.923   1.331  -5.172
  106   1HE   MET  19          1HE       MET  19  -0.064   2.394  -6.561
  107   2HE   MET  19          2HE       MET  19   1.508   1.736  -6.114
  108   3HE   MET  19          3HE       MET  19   0.284   1.994  -4.873
  109    H    ALA  20           H        ALA  20  -5.030  -2.256  -4.324
  110    HA   ALA  20           HA       ALA  20  -6.022  -1.319  -6.965
  111   1HB   ALA  20          1HB       ALA  20  -5.912  -4.048  -5.862
  112   2HB   ALA  20          2HB       ALA  20  -6.103  -3.523  -7.535
  113   3HB   ALA  20          3HB       ALA  20  -7.504  -3.589  -6.467
  114    H    LYS  21           H        LYS  21  -8.605  -1.445  -6.780
  115    HA   LYS  21           HA       LYS  21  -9.289  -0.194  -4.155
  116   1HB   LYS  21          1HB       LYS  21 -10.189   0.023  -7.003
  117   2HB   LYS  21          2HB       LYS  21 -11.343   0.433  -5.735
  118   1HG   LYS  21          1HG       LYS  21  -9.690   2.010  -4.765
  119   2HG   LYS  21          2HG       LYS  21  -8.570   1.621  -6.071
  120   1HD   LYS  21          1HD       LYS  21 -11.006   2.245  -7.336
  121   2HD   LYS  21          2HD       LYS  21 -10.810   3.462  -6.075
  122   1HE   LYS  21          1HE       LYS  21  -9.673   4.312  -8.031
  123   2HE   LYS  21          2HE       LYS  21  -8.402   3.747  -6.932
  124   1HZ   LYS  21          1HZ       LYS  21  -9.565   2.329  -9.266
  125   2HZ   LYS  21          2HZ       LYS  21  -8.652   1.528  -8.078
  126   3HZ   LYS  21          3HZ       LYS  21  -7.943   2.756  -9.014
  127    H    THR  22           H        THR  22 -10.581  -1.341  -2.771
  128    HA   THR  22           HA       THR  22 -11.848  -3.848  -3.718
  129    HB   THR  22           HB       THR  22 -11.847  -2.662  -0.934
  130    HG1  THR  22           HG1      THR  22  -9.774  -2.851  -0.995
  131   1HG2  THR  22          1HG2      THR  22 -12.505  -5.239  -2.187
  132   2HG2  THR  22          2HG2      THR  22 -13.034  -4.568  -0.645
  133   3HG2  THR  22          3HG2      THR  22 -11.470  -5.374  -0.765
  134    H    SER  23           H        SER  23 -14.073  -4.061  -3.936
  135    HA   SER  23           HA       SER  23 -16.339  -3.428  -4.076
  136   1HB   SER  23          1HB       SER  23 -16.502  -3.507  -1.769
  137   2HB   SER  23          2HB       SER  23 -15.253  -2.286  -1.534
  138    HG   SER  23           HG       SER  23 -17.781  -1.723  -2.667
  139    H    SER  24           H        SER  24 -15.380  -0.316  -2.670
  140    HA   SER  24           HA       SER  24 -16.346   1.015  -5.152
  141   1HB   SER  24          1HB       SER  24 -17.408   1.760  -3.160
  142   2HB   SER  24          2HB       SER  24 -15.883   1.815  -2.275
  143    HG   SER  24           HG       SER  24 -15.685   3.782  -2.921
  144    H    GLY  25           H        GLY  25 -13.908   2.110  -2.795
  145   1HA   GLY  25          1HA       GLY  25 -11.845   2.118  -4.920
  146   2HA   GLY  25          2HA       GLY  25 -12.281   3.679  -4.234
  147    H    GLN  26           H        GLN  26 -12.430   0.956  -2.099
  148    HA   GLN  26           HA       GLN  26 -10.653   2.026  -0.176
  149   1HB   GLN  26          1HB       GLN  26 -11.608  -0.752  -0.878
  150   2HB   GLN  26          2HB       GLN  26 -10.570  -0.468   0.517
  151   1HG   GLN  26          1HG       GLN  26 -12.190   0.949   1.552
  152   2HG   GLN  26          2HG       GLN  26 -13.134   1.073   0.068
  153   1HE2  GLN  26          1HE2      GLN  26 -14.771   0.261   1.943
  154   2HE2  GLN  26          2HE2      GLN  26 -14.985  -1.422   2.000
  155    H    ARG  27           H        ARG  27  -8.696   2.733  -1.196
  156    HA   ARG  27           HA       ARG  27  -7.123   1.163  -2.984
  157   1HB   ARG  27          1HB       ARG  27  -7.107   3.708  -1.814
  158   2HB   ARG  27          2HB       ARG  27  -5.595   2.966  -1.293
  159   1HG   ARG  27          1HG       ARG  27  -5.468   2.210  -3.824
  160   2HG   ARG  27          2HG       ARG  27  -6.549   3.586  -4.066
  161   1HD   ARG  27          1HD       ARG  27  -4.358   4.297  -2.286
  162   2HD   ARG  27          2HD       ARG  27  -3.750   3.693  -3.839
  163    HE   ARG  27           HE       ARG  27  -6.001   5.468  -4.231
  164   1HH1  ARG  27          1HH1      ARG  27  -2.599   5.398  -3.492
  165   2HH1  ARG  27          2HH1      ARG  27  -2.313   6.972  -4.150
  166   1HH2  ARG  27          1HH2      ARG  27  -5.603   7.508  -5.077
  167   2HH2  ARG  27          2HH2      ARG  27  -3.998   8.159  -5.041
  168    H    TYR  28           H        TYR  28  -6.749  -0.948  -2.196
  169    HA   TYR  28           HA       TYR  28  -5.215  -1.137   0.365
  170   1HB   TYR  28          1HB       TYR  28  -6.047  -3.390   0.497
  171   2HB   TYR  28          2HB       TYR  28  -7.415  -2.372   0.060
  172    HD1  TYR  28           HD1      TYR  28  -5.268  -5.114  -0.949
  173    HD2  TYR  28           HD2      TYR  28  -8.164  -2.278  -2.355
  174    HE1  TYR  28           HE1      TYR  28  -5.700  -6.536  -2.932
  175    HE2  TYR  28           HE2      TYR  28  -8.587  -3.690  -4.343
  176    HH   TYR  28           HH       TYR  28  -7.612  -5.412  -5.615
  177    H    PHE  29           H        PHE  29  -3.095  -1.805   0.234
  178    HA   PHE  29           HA       PHE  29  -1.956  -2.137  -2.453
  179   1HB   PHE  29          1HB       PHE  29  -0.803  -1.992   0.347
  180   2HB   PHE  29          2HB       PHE  29   0.178  -2.045  -1.121
  181    HD1  PHE  29           HD1      PHE  29  -2.360  -0.090   0.751
  182    HD2  PHE  29           HD2      PHE  29   0.374  -0.109  -2.564
  183    HE1  PHE  29           HE1      PHE  29  -2.726   2.337   0.439
  184    HE2  PHE  29           HE2      PHE  29   0.009   2.323  -2.871
  185    HZ   PHE  29           HZ       PHE  29  -1.541   3.546  -1.371
  186    H    LYS  30           H        LYS  30  -1.837  -4.072  -3.364
  187    HA   LYS  30           HA       LYS  30  -2.158  -6.569  -1.922
  188   1HB   LYS  30          1HB       LYS  30  -1.466  -5.752  -4.748
  189   2HB   LYS  30          2HB       LYS  30  -1.736  -7.430  -4.276
  190   1HG   LYS  30          1HG       LYS  30  -3.878  -5.942  -3.215
  191   2HG   LYS  30          2HG       LYS  30  -3.649  -5.350  -4.853
  192   1HD   LYS  30          1HD       LYS  30  -3.374  -8.132  -5.062
  193   2HD   LYS  30          2HD       LYS  30  -4.730  -7.901  -3.960
  194   1HE   LYS  30          1HE       LYS  30  -6.021  -7.482  -5.781
  195   2HE   LYS  30          2HE       LYS  30  -5.084  -5.998  -6.029
  196   1HZ   LYS  30          1HZ       LYS  30  -3.527  -7.135  -7.354
  197   2HZ   LYS  30          2HZ       LYS  30  -5.036  -7.692  -7.905
  198   3HZ   LYS  30          3HZ       LYS  30  -4.092  -8.661  -6.877
  199    H    ASN  31           H        ASN  31  -0.539  -8.028  -1.408
  200    HA   ASN  31           HA       ASN  31   2.277  -7.066  -1.777
  201   1HB   ASN  31          1HB       ASN  31   1.112  -7.343   0.523
  202   2HB   ASN  31          2HB       ASN  31   1.276  -9.073   0.241
  203   1HD2  ASN  31          1HD2      ASN  31   2.786  -8.937   2.200
  204   2HD2  ASN  31          2HD2      ASN  31   4.403  -8.499   1.927
  205    H    HIS  32           H        HIS  32   3.193  -8.205  -3.505
  206    HA   HIS  32           HA       HIS  32   2.366 -11.028  -3.920
  207   1HB   HIS  32          1HB       HIS  32   4.289  -9.236  -5.443
  208   2HB   HIS  32          2HB       HIS  32   3.650 -10.779  -6.001
  209    HD1  HIS  32           HD1      HIS  32   1.051 -10.871  -6.520
  210    HD2  HIS  32           HD2      HIS  32   2.540  -7.052  -5.762
  211    HE1  HIS  32           HE1      HIS  32  -0.745  -9.242  -7.258
  212    H    ILE  33           H        ILE  33   4.338  -9.650  -1.769
  213    HA   ILE  33           HA       ILE  33   6.752 -11.321  -2.161
  214    HB   ILE  33           HB       ILE  33   6.031  -9.805   0.349
  215   1HG1  ILE  33          1HG1      ILE  33   7.246  -8.476  -2.089
  216   2HG1  ILE  33          2HG1      ILE  33   5.567  -8.252  -1.580
  217   1HG2  ILE  33          1HG2      ILE  33   8.713  -9.598  -0.836
  218   2HG2  ILE  33          2HG2      ILE  33   8.226 -11.246  -0.436
  219   3HG2  ILE  33          3HG2      ILE  33   8.234 -10.001   0.813
  220   1HD1  ILE  33          1HD1      ILE  33   7.197  -6.507  -0.718
  221   2HD1  ILE  33          2HD1      ILE  33   7.906  -7.786   0.269
  222   3HD1  ILE  33          3HD1      ILE  33   6.224  -7.316   0.511
  223    H    ASP  34           H        ASP  34   4.359 -10.777   0.402
  224    HA   ASP  34           HA       ASP  34   4.662 -13.588   1.287
  225   1HB   ASP  34          1HB       ASP  34   4.684 -11.258   2.654
  226   2HB   ASP  34          2HB       ASP  34   2.957 -11.614   2.721
  227    H    GLN  35           H        GLN  35   2.851 -11.993  -0.936
  228    HA   GLN  35           HA       GLN  35   0.774 -12.389  -1.955
  229   1HB   GLN  35          1HB       GLN  35   1.757 -14.839  -0.751
  230   2HB   GLN  35          2HB       GLN  35  -0.006 -14.815  -0.741
  231   1HG   GLN  35          1HG       GLN  35   0.431 -13.893  -3.240
  232   2HG   GLN  35          2HG       GLN  35   1.877 -14.883  -3.042
  233   1HE2  GLN  35          1HE2      GLN  35   1.619 -17.127  -3.299
  234   2HE2  GLN  35          2HE2      GLN  35   0.118 -17.914  -3.399
  235    H    THR  36           H        THR  36   0.036 -10.530  -0.476
  236    HA   THR  36           HA       THR  36  -2.374 -11.377   0.981
  237    HB   THR  36           HB       THR  36  -1.332  -9.997   3.029
  238    HG1  THR  36           HG1      THR  36   0.755  -9.863   2.960
  239   1HG2  THR  36          1HG2      THR  36  -1.426 -12.006   4.057
  240   2HG2  THR  36          2HG2      THR  36  -0.193 -12.694   3.001
  241   3HG2  THR  36          3HG2      THR  36  -1.877 -12.653   2.479
  242    H    THR  37           H        THR  37  -3.887  -9.755   0.852
  243    HA   THR  37           HA       THR  37  -3.082  -7.153  -0.323
  244    HB   THR  37           HB       THR  37  -5.568  -6.943  -0.583
  245    HG1  THR  37           HG1      THR  37  -6.869  -8.427   0.274
  246   1HG2  THR  37          1HG2      THR  37  -5.690  -8.438  -2.347
  247   2HG2  THR  37          2HG2      THR  37  -4.890  -9.728  -1.447
  248   3HG2  THR  37          3HG2      THR  37  -3.946  -8.384  -2.091
  249    H    THR  38           H        THR  38  -2.989  -5.281   0.915
  250    HA   THR  38           HA       THR  38  -4.280  -5.356   3.624
  251    HB   THR  38           HB       THR  38  -1.773  -5.732   3.576
  252    HG1  THR  38           HG1      THR  38  -1.474  -4.396   5.303
  253   1HG2  THR  38          1HG2      THR  38  -1.697  -3.816   1.674
  254   2HG2  THR  38          2HG2      THR  38  -0.315  -4.195   2.700
  255   3HG2  THR  38          3HG2      THR  38  -1.356  -2.829   3.094
  256    H    TRP  39           H        TRP  39  -4.734  -3.157   4.491
  257    HA   TRP  39           HA       TRP  39  -5.810  -1.397   2.431
  258   1HB   TRP  39          1HB       TRP  39  -5.644  -1.173   5.452
  259   2HB   TRP  39          2HB       TRP  39  -6.680  -0.199   4.409
  260    HD1  TRP  39           HD1      TRP  39  -6.221  -3.791   5.671
  261    HE1  TRP  39           HE1      TRP  39  -8.431  -5.066   5.332
  262    HE3  TRP  39           HE3      TRP  39  -8.877  -0.289   3.066
  263    HZ2  TRP  39           HZ2      TRP  39 -10.986  -4.662   4.119
  264    HZ3  TRP  39           HZ3      TRP  39 -11.197  -0.766   2.332
  265    HH2  TRP  39           HH2      TRP  39 -12.250  -2.948   2.854
  266    H    GLN  40           H        GLN  40  -3.702  -0.704   5.245
  267    HA   GLN  40           HA       GLN  40  -2.755   1.810   4.422
  268   1HB   GLN  40          1HB       GLN  40  -1.764  -0.445   6.127
  269   2HB   GLN  40          2HB       GLN  40  -0.662   0.891   5.796
  270   1HG   GLN  40          1HG       GLN  40  -1.815   2.316   7.133
  271   2HG   GLN  40          2HG       GLN  40  -3.373   1.763   6.521
  272   1HE2  GLN  40          1HE2      GLN  40  -3.988   1.848   8.922
  273   2HE2  GLN  40          2HE2      GLN  40  -3.618   0.501   9.885
  274    H    ASP  41           H        ASP  41  -0.418   2.259   3.688
  275    HA   ASP  41           HA       ASP  41   0.169   0.547   1.320
  276   1HB   ASP  41          1HB       ASP  41   1.404   2.545   0.574
  277   2HB   ASP  41          2HB       ASP  41  -0.230   2.986   1.067
  278    HA   PRO  42           HA       PRO  42   3.765  -1.057   3.328
  279   1HB   PRO  42          1HB       PRO  42   5.189  -1.828   1.126
  280   2HB   PRO  42          2HB       PRO  42   3.774  -2.718   1.721
  281   1HG   PRO  42          1HG       PRO  42   3.990  -0.775  -0.523
  282   2HG   PRO  42          2HG       PRO  42   3.065  -2.276  -0.428
  283   1HD   PRO  42          1HD       PRO  42   1.961   0.198  -0.124
  284   2HD   PRO  42          2HD       PRO  42   1.305  -1.267   0.637
  285    H    ARG  43           H        ARG  43   3.962   1.597   3.541
  286    HA   ARG  43           HA       ARG  43   6.766   2.180   3.190
  287   1HB   ARG  43          1HB       ARG  43   4.894   2.745   1.022
  288   2HB   ARG  43          2HB       ARG  43   5.730   4.202   1.560
  289   1HG   ARG  43          1HG       ARG  43   7.816   2.484   1.511
  290   2HG   ARG  43          2HG       ARG  43   6.818   1.766   0.246
  291   1HD   ARG  43          1HD       ARG  43   7.547   3.373  -1.177
  292   2HD   ARG  43          2HD       ARG  43   6.779   4.596  -0.147
  293    HE   ARG  43           HE       ARG  43   8.915   5.070   0.749
  294   1HH1  ARG  43          1HH1      ARG  43   8.879   1.918  -0.729
  295   2HH1  ARG  43          2HH1      ARG  43  10.569   1.660  -0.479
  296   1HH2  ARG  43          1HH2      ARG  43  11.109   4.712   1.062
  297   2HH2  ARG  43          2HH2      ARG  43  11.825   3.228   0.527
  298    H    LYS  44           H        LYS  44   4.131   4.505   2.696
  299    HA   LYS  44           HA       LYS  44   4.986   6.269   4.771
  300   1HB   LYS  44          1HB       LYS  44   2.235   5.891   3.543
  301   2HB   LYS  44          2HB       LYS  44   2.834   7.356   4.321
  302   1HG   LYS  44          1HG       LYS  44   4.799   6.833   2.455
  303   2HG   LYS  44          2HG       LYS  44   3.333   6.338   1.609
  304   1HD   LYS  44          1HD       LYS  44   2.535   8.472   1.486
  305   2HD   LYS  44          2HD       LYS  44   3.115   8.883   3.099
  306   1HE   LYS  44          1HE       LYS  44   5.173   8.434   0.972
  307   2HE   LYS  44          2HE       LYS  44   4.252   9.950   0.928
  308   1HZ   LYS  44          1HZ       LYS  44   6.067  10.319   2.386
  309   2HZ   LYS  44          2HZ       LYS  44   5.834   8.838   3.184
  310   3HZ   LYS  44          3HZ       LYS  44   4.714  10.100   3.385
  311    H    ALA  45           H        ALA  45   3.037   3.380   4.855
  312    HA   ALA  45           HA       ALA  45   2.292   3.961   7.703
  313   1HB   ALA  45          1HB       ALA  45   1.042   2.263   5.523
  314   2HB   ALA  45          2HB       ALA  45   0.371   3.719   6.259
  315   3HB   ALA  45          3HB       ALA  45   0.497   2.232   7.200
  316    H    MET  46           H        MET  46   4.875   2.821   6.721
  317    HA   MET  46           HA       MET  46   4.723   0.201   8.169
  318   1HB   MET  46          1HB       MET  46   4.783  -0.168   5.744
  319   2HB   MET  46          2HB       MET  46   6.189   0.886   5.599
  320   1HG   MET  46          1HG       MET  46   7.443  -0.663   7.115
  321   2HG   MET  46          2HG       MET  46   6.052  -1.747   7.100
  322   1HE   MET  46          1HE       MET  46   8.851  -3.434   4.913
  323   2HE   MET  46          2HE       MET  46   8.004  -3.419   6.458
  324   3HE   MET  46          3HE       MET  46   9.229  -2.197   6.122
  325    H    LEU  47           H        LEU  47   6.782  -0.399   9.183
  326    HA   LEU  47           HA       LEU  47   8.642   0.145  10.540
  327   1HB   LEU  47          1HB       LEU  47   9.185   0.426   7.913
  328   2HB   LEU  47          2HB       LEU  47   9.524   2.072   8.451
  329    HG   LEU  47           HG       LEU  47  10.751   0.607  10.412
  330   1HD1  LEU  47          1HD1      LEU  47  10.343  -1.521   9.297
  331   2HD1  LEU  47          2HD1      LEU  47  12.062  -1.145   9.195
  332   3HD1  LEU  47          3HD1      LEU  47  11.022  -0.899   7.792
  333   1HD2  LEU  47          1HD2      LEU  47  12.852   1.167   9.223
  334   2HD2  LEU  47          2HD2      LEU  47  11.711   2.512   9.182
  335   3HD2  LEU  47          3HD2      LEU  47  11.926   1.494   7.758
  336    H    SER  48           H        SER  48   6.181   1.975  10.618
  337    HA   SER  48           HA       SER  48   7.259   3.960  12.423
  338   1HB   SER  48          1HB       SER  48   7.421   4.488   9.642
  339   2HB   SER  48          2HB       SER  48   6.125   5.510  10.265
  340    HG   SER  48           HG       SER  48   8.374   6.327  10.385
  341    H    GLN  49           H        GLN  49   5.562   3.855  13.856
  342    HA   GLN  49           HA       GLN  49   2.791   3.516  12.896
  343   1HB   GLN  49          1HB       GLN  49   4.321   2.821  15.148
  344   2HB   GLN  49          2HB       GLN  49   3.162   4.013  15.737
  345   1HG   GLN  49          1HG       GLN  49   1.361   2.677  14.532
  346   2HG   GLN  49          2HG       GLN  49   2.574   1.419  14.291
  347   1HE2  GLN  49          1HE2      GLN  49   0.562   3.028  16.708
  348   2HE2  GLN  49          2HE2      GLN  49   0.917   1.960  17.980
  349    H    MET  50           H        MET  50   4.889   6.074  13.997
  350    HA   MET  50           HA       MET  50   2.543   7.948  14.026
  351   1HB   MET  50          1HB       MET  50   3.589   7.519  16.241
  352   2HB   MET  50          2HB       MET  50   5.141   8.051  15.595
  353   1HG   MET  50          1HG       MET  50   4.533  10.264  15.589
  354   2HG   MET  50          2HG       MET  50   2.845   9.906  15.223
  355   1HE   MET  50          1HE       MET  50   4.511  11.676  18.397
  356   2HE   MET  50          2HE       MET  50   5.459  10.735  17.249
  357   3HE   MET  50          3HE       MET  50   5.249  10.148  18.897
  358   1H    GLY  51          1H        GLY  51 -13.215  -8.196  11.051
  359   2H    GLY  51          2H        GLY  51 -13.046  -7.174  12.399
  360   3H    GLY  51          3H        GLY  51 -12.169  -6.863  10.977
  361   1HA   GLY  51          1HA       GLY  51 -15.064  -6.978  10.703
  362   2HA   GLY  51          2HA       GLY  51 -14.408  -5.595  11.579
  363    H    THR  52           H        THR  52 -15.466  -6.280   8.649
  364    HA   THR  52           HA       THR  52 -15.030  -5.427   6.486
  365    HB   THR  52           HB       THR  52 -13.496  -3.461   8.220
  366    HG1  THR  52           HG1      THR  52 -15.380  -2.629   8.658
  367   1HG2  THR  52          1HG2      THR  52 -12.917  -2.540   6.246
  368   2HG2  THR  52          2HG2      THR  52 -14.623  -2.143   6.035
  369   3HG2  THR  52          3HG2      THR  52 -13.973  -3.634   5.352
  370    HA   PRO  53           HA       PRO  53 -10.738  -7.291   6.630
  371   1HB   PRO  53          1HB       PRO  53 -11.304  -9.509   5.128
  372   2HB   PRO  53          2HB       PRO  53 -11.471  -9.467   6.893
  373   1HG   PRO  53          1HG       PRO  53 -13.557  -9.217   4.780
  374   2HG   PRO  53          2HG       PRO  53 -13.624 -10.060   6.333
  375   1HD   PRO  53          1HD       PRO  53 -14.751  -7.612   5.887
  376   2HD   PRO  53          2HD       PRO  53 -14.186  -8.159   7.480
  377    HA   PRO  54           HA       PRO  54  -9.848  -5.675   2.627
  378   1HB   PRO  54          1HB       PRO  54  -7.607  -7.101   1.937
  379   2HB   PRO  54          2HB       PRO  54  -7.597  -5.801   3.144
  380   1HG   PRO  54          1HG       PRO  54  -7.703  -8.760   3.532
  381   2HG   PRO  54          2HG       PRO  54  -6.775  -7.543   4.420
  382   1HD   PRO  54          1HD       PRO  54  -9.073  -8.618   5.373
  383   2HD   PRO  54          2HD       PRO  54  -8.567  -6.953   5.739
  384    HA   PRO  55           HA       PRO  55 -11.419  -8.298  -0.538
  385   1HB   PRO  55          1HB       PRO  55  -9.783  -7.867  -2.697
  386   2HB   PRO  55          2HB       PRO  55 -10.969  -6.677  -2.126
  387   1HG   PRO  55          1HG       PRO  55  -8.030  -6.803  -1.636
  388   2HG   PRO  55          2HG       PRO  55  -9.052  -5.406  -2.007
  389   1HD   PRO  55          1HD       PRO  55  -8.207  -5.971   0.500
  390   2HD   PRO  55          2HD       PRO  55  -9.774  -5.197   0.176
  391    HA   PRO  56           HA       PRO  56  -9.200 -12.102  -0.580
  392   1HB   PRO  56          1HB       PRO  56 -10.103 -13.278  -2.882
  393   2HB   PRO  56          2HB       PRO  56 -11.101 -13.122  -1.422
  394   1HG   PRO  56          1HG       PRO  56 -11.103 -11.472  -3.901
  395   2HG   PRO  56          2HG       PRO  56 -12.463 -12.023  -2.911
  396   1HD   PRO  56          1HD       PRO  56 -11.456  -9.497  -2.791
  397   2HD   PRO  56          2HD       PRO  56 -12.250 -10.300  -1.420
  398    H    TYR  57           H        TYR  57  -7.010 -11.980  -0.961
  399    HA   TYR  57           HA       TYR  57  -5.692 -10.634  -3.042
  400   1HB   TYR  57          1HB       TYR  57  -4.753 -11.596  -0.911
  401   2HB   TYR  57          2HB       TYR  57  -4.809 -13.189  -1.666
  402    HD1  TYR  57           HD1      TYR  57  -3.545 -13.538  -3.863
  403    HD2  TYR  57           HD2      TYR  57  -2.977 -10.110  -1.349
  404    HE1  TYR  57           HE1      TYR  57  -1.385 -13.069  -4.986
  405    HE2  TYR  57           HE2      TYR  57  -0.818  -9.638  -2.466
  406    HH   TYR  57           HH       TYR  57   0.691 -11.905  -4.554
  407    H    THR  58           H        THR  58  -4.689 -11.418  -5.002
  408    HA   THR  58           HA       THR  58  -5.359 -14.090  -6.029
  409    HB   THR  58           HB       THR  58  -7.447 -12.845  -6.355
  410    HG1  THR  58           HG1      THR  58  -7.573 -13.090  -8.593
  411   1HG2  THR  58          1HG2      THR  58  -6.957 -10.892  -8.217
  412   2HG2  THR  58          2HG2      THR  58  -5.545 -10.749  -7.170
  413   3HG2  THR  58          3HG2      THR  58  -7.166 -10.598  -6.490
  414    H    VAL  59           H        VAL  59  -5.101 -13.114  -8.822
  415    HA   VAL  59           HA       VAL  59  -2.507 -11.742  -8.981
  416    HB   VAL  59           HB       VAL  59  -1.888 -14.019  -8.294
  417   1HG1  VAL  59          1HG1      VAL  59  -2.840 -15.903  -9.154
  418   2HG1  VAL  59          2HG1      VAL  59  -2.862 -15.260 -10.796
  419   3HG1  VAL  59          3HG1      VAL  59  -4.125 -14.803  -9.652
  420   1HG2  VAL  59          1HG2      VAL  59  -0.422 -12.864  -9.902
  421   2HG2  VAL  59          2HG2      VAL  59  -1.373 -13.506 -11.241
  422   3HG2  VAL  59          3HG2      VAL  59  -0.440 -14.598 -10.218
  423    H    GLY  60           H        GLY  60  -2.562 -10.605 -10.882
  424   1HA   GLY  60          1HA       GLY  60  -2.754 -10.889 -13.400
  425   2HA   GLY  60          2HA       GLY  60  -4.309 -11.652 -13.075
  Start of MODEL    8
    1    H    PHE   5           H        PHE   5  -7.392   7.099   7.680
    2    HA   PHE   5           HA       PHE   5  -5.129   8.422   6.472
    3   1HB   PHE   5          1HB       PHE   5  -5.922   5.851   7.394
    4   2HB   PHE   5          2HB       PHE   5  -5.384   5.652   5.726
    5    HD1  PHE   5           HD1      PHE   5  -4.306   5.781   9.069
    6    HD2  PHE   5           HD2      PHE   5  -3.179   7.046   5.123
    7    HE1  PHE   5           HE1      PHE   5  -1.946   5.973   9.805
    8    HE2  PHE   5           HE2      PHE   5  -0.818   7.238   5.858
    9    HZ   PHE   5           HZ       PHE   5  -0.201   6.702   8.200
   10    H    GLU   6           H        GLU   6  -4.859   9.039   4.357
   11    HA   GLU   6           HA       GLU   6  -6.884   8.085   2.357
   12   1HB   GLU   6          1HB       GLU   6  -6.439  10.287   1.276
   13   2HB   GLU   6          2HB       GLU   6  -7.007  10.473   2.935
   14   1HG   GLU   6          1HG       GLU   6  -4.797  10.910   3.742
   15   2HG   GLU   6          2HG       GLU   6  -4.069  10.405   2.217
   16    H    ILE   7           H        ILE   7  -3.496   8.391   3.126
   17    HA   ILE   7           HA       ILE   7  -1.561   7.701   1.953
   18    HB   ILE   7           HB       ILE   7  -3.678   5.986   0.611
   19   1HG1  ILE   7          1HG1      ILE   7  -3.741   5.852   3.081
   20   2HG1  ILE   7          2HG1      ILE   7  -3.134   4.352   2.381
   21   1HG2  ILE   7          1HG2      ILE   7  -1.462   5.983  -0.517
   22   2HG2  ILE   7          2HG2      ILE   7  -1.832   4.423   0.217
   23   3HG2  ILE   7          3HG2      ILE   7  -0.706   5.525   1.009
   24   1HD1  ILE   7          1HD1      ILE   7  -0.788   5.309   2.710
   25   2HD1  ILE   7          2HD1      ILE   7  -1.654   4.876   4.184
   26   3HD1  ILE   7          3HD1      ILE   7  -1.542   6.566   3.692
   27    HA   PRO   8           HA       PRO   8  -2.407  10.430  -1.615
   28   1HB   PRO   8          1HB       PRO   8   0.029  11.677  -1.553
   29   2HB   PRO   8          2HB       PRO   8  -1.341  12.178  -0.544
   30   1HG   PRO   8          1HG       PRO   8   1.045  10.539   0.162
   31   2HG   PRO   8          2HG       PRO   8   0.202  11.770   1.115
   32   1HD   PRO   8          1HD       PRO   8  -0.114   9.085   1.496
   33   2HD   PRO   8          2HD       PRO   8  -1.357  10.291   1.889
   34    H    ASP   9           H        ASP   9  -1.256  10.534  -3.745
   35    HA   ASP   9           HA       ASP   9   0.028   7.955  -4.373
   36   1HB   ASP   9          1HB       ASP   9  -1.794   9.110  -5.708
   37   2HB   ASP   9          2HB       ASP   9  -0.601  10.331  -6.150
   38    H    ASP  10           H        ASP  10   1.757   9.332  -2.725
   39    HA   ASP  10           HA       ASP  10   3.763  10.593  -4.557
   40   1HB   ASP  10          1HB       ASP  10   2.960  11.962  -2.691
   41   2HB   ASP  10          2HB       ASP  10   3.359  10.679  -1.549
   42    H    VAL  11           H        VAL  11   3.196   7.935  -2.331
   43    HA   VAL  11           HA       VAL  11   5.865   7.125  -1.809
   44    HB   VAL  11           HB       VAL  11   4.718   4.889  -1.467
   45   1HG1  VAL  11          1HG1      VAL  11   3.334   7.334  -0.323
   46   2HG1  VAL  11          2HG1      VAL  11   4.799   6.589   0.318
   47   3HG1  VAL  11          3HG1      VAL  11   3.270   5.710   0.362
   48   1HG2  VAL  11          1HG2      VAL  11   2.906   5.939  -3.315
   49   2HG2  VAL  11          2HG2      VAL  11   2.040   5.985  -1.779
   50   3HG2  VAL  11          3HG2      VAL  11   2.702   4.461  -2.375
   51    HA   PRO  12           HA       PRO  12   6.992   5.686  -5.872
   52   1HB   PRO  12          1HB       PRO  12   9.254   4.314  -5.174
   53   2HB   PRO  12          2HB       PRO  12   9.195   6.083  -5.285
   54   1HG   PRO  12          1HG       PRO  12   9.079   4.323  -2.885
   55   2HG   PRO  12          2HG       PRO  12   9.882   5.885  -3.099
   56   1HD   PRO  12          1HD       PRO  12   7.485   5.556  -1.813
   57   2HD   PRO  12          2HD       PRO  12   7.983   7.062  -2.609
   58    H    LEU  13           H        LEU  13   5.909   3.826  -3.262
   59    HA   LEU  13           HA       LEU  13   4.977   1.698  -3.123
   60   1HB   LEU  13          1HB       LEU  13   4.798   2.567  -5.852
   61   2HB   LEU  13          2HB       LEU  13   5.092   0.828  -5.822
   62    HG   LEU  13           HG       LEU  13   2.677   1.310  -5.713
   63   1HD1  LEU  13          1HD1      LEU  13   3.429   0.420  -2.953
   64   2HD1  LEU  13          2HD1      LEU  13   3.893  -0.562  -4.343
   65   3HD1  LEU  13          3HD1      LEU  13   2.190  -0.225  -4.029
   66   1HD2  LEU  13          1HD2      LEU  13   1.760   2.852  -4.315
   67   2HD2  LEU  13          2HD2      LEU  13   3.403   3.489  -4.231
   68   3HD2  LEU  13          3HD2      LEU  13   2.816   2.396  -2.977
   69    HA   PRO  14           HA       PRO  14   8.733  -0.690  -3.229
   70   1HB   PRO  14          1HB       PRO  14   7.935  -2.573  -1.414
   71   2HB   PRO  14          2HB       PRO  14   8.445  -0.940  -0.956
   72   1HG   PRO  14          1HG       PRO  14   5.778  -2.129  -0.934
   73   2HG   PRO  14          2HG       PRO  14   6.370  -0.686  -0.111
   74   1HD   PRO  14          1HD       PRO  14   4.827  -0.868  -2.535
   75   2HD   PRO  14          2HD       PRO  14   5.327   0.581  -1.657
   76    H    ALA  15           H        ALA  15   9.358  -2.936  -3.841
   77    HA   ALA  15           HA       ALA  15   7.762  -4.002  -5.995
   78   1HB   ALA  15          1HB       ALA  15   9.997  -5.359  -4.466
   79   2HB   ALA  15          2HB       ALA  15  10.292  -4.059  -5.621
   80   3HB   ALA  15          3HB       ALA  15   9.570  -5.574  -6.164
   81    H    GLY  16           H        GLY  16   6.531  -5.956  -6.031
   82   1HA   GLY  16          1HA       GLY  16   5.188  -7.656  -5.160
   83   2HA   GLY  16          2HA       GLY  16   6.307  -7.746  -3.809
   84    H    TRP  17           H        TRP  17   4.729  -4.767  -4.679
   85    HA   TRP  17           HA       TRP  17   2.790  -5.086  -2.447
   86   1HB   TRP  17          1HB       TRP  17   5.132  -3.305  -2.686
   87   2HB   TRP  17          2HB       TRP  17   3.679  -2.582  -2.014
   88    HD1  TRP  17           HD1      TRP  17   6.638  -4.272  -0.887
   89    HE1  TRP  17           HE1      TRP  17   6.295  -5.386   1.416
   90    HE3  TRP  17           HE3      TRP  17   1.560  -4.216  -0.648
   91    HZ2  TRP  17           HZ2      TRP  17   4.127  -6.154   3.131
   92    HZ3  TRP  17           HZ3      TRP  17   0.369  -5.139   1.316
   93    HH2  TRP  17           HH2      TRP  17   1.647  -6.113   3.208
   94    H    GLU  18           H        GLU  18   1.610  -5.250  -4.684
   95    HA   GLU  18           HA       GLU  18   1.181  -2.746  -6.152
   96   1HB   GLU  18          1HB       GLU  18   0.907  -5.398  -6.693
   97   2HB   GLU  18          2HB       GLU  18  -0.765  -4.982  -6.301
   98   1HG   GLU  18          1HG       GLU  18  -1.023  -3.756  -8.189
   99   2HG   GLU  18          2HG       GLU  18   0.571  -3.015  -8.035
  100    H    MET  19           H        MET  19  -1.521  -2.722  -6.466
  101    HA   MET  19           HA       MET  19  -2.960  -2.785  -3.957
  102   1HB   MET  19          1HB       MET  19  -3.110  -0.388  -3.612
  103   2HB   MET  19          2HB       MET  19  -1.422  -0.886  -3.617
  104   1HG   MET  19          1HG       MET  19  -1.927  -0.354  -6.291
  105   2HG   MET  19          2HG       MET  19  -2.843   0.900  -5.460
  106   1HE   MET  19          1HE       MET  19   1.111   0.944  -6.816
  107   2HE   MET  19          2HE       MET  19  -0.075  -0.356  -6.897
  108   3HE   MET  19          3HE       MET  19   1.225  -0.432  -5.710
  109    H    ALA  20           H        ALA  20  -5.124  -2.519  -4.243
  110    HA   ALA  20           HA       ALA  20  -6.114  -1.606  -6.895
  111   1HB   ALA  20          1HB       ALA  20  -5.995  -3.864  -7.369
  112   2HB   ALA  20          2HB       ALA  20  -7.552  -3.861  -6.539
  113   3HB   ALA  20          3HB       ALA  20  -6.088  -4.325  -5.670
  114    H    LYS  21           H        LYS  21  -8.386  -0.984  -6.766
  115    HA   LYS  21           HA       LYS  21  -9.180  -0.212  -4.028
  116   1HB   LYS  21          1HB       LYS  21 -10.860   1.131  -5.286
  117   2HB   LYS  21          2HB       LYS  21  -9.220   1.408  -5.872
  118   1HG   LYS  21          1HG       LYS  21  -9.892   0.801  -7.933
  119   2HG   LYS  21          2HG       LYS  21 -10.242  -0.813  -7.316
  120   1HD   LYS  21          1HD       LYS  21 -12.490   0.003  -6.586
  121   2HD   LYS  21          2HD       LYS  21 -12.134   1.556  -7.341
  122   1HE   LYS  21          1HE       LYS  21 -13.379   0.305  -8.976
  123   2HE   LYS  21          2HE       LYS  21 -11.688   0.212  -9.501
  124   1HZ   LYS  21          1HZ       LYS  21 -12.831  -1.986  -9.390
  125   2HZ   LYS  21          2HZ       LYS  21 -12.992  -1.775  -7.712
  126   3HZ   LYS  21          3HZ       LYS  21 -11.448  -1.889  -8.413
  127    H    THR  22           H        THR  22 -10.154  -1.916  -2.957
  128    HA   THR  22           HA       THR  22 -11.958  -3.775  -4.327
  129    HB   THR  22           HB       THR  22 -10.465  -4.415  -2.448
  130    HG1  THR  22           HG1      THR  22 -12.330  -5.613  -2.703
  131   1HG2  THR  22          1HG2      THR  22 -11.227  -3.658  -0.132
  132   2HG2  THR  22          2HG2      THR  22 -12.166  -2.414  -0.955
  133   3HG2  THR  22          3HG2      THR  22 -10.410  -2.440  -1.110
  134    H    SER  23           H        SER  23 -14.260  -3.981  -3.632
  135    HA   SER  23           HA       SER  23 -16.401  -3.056  -3.285
  136   1HB   SER  23          1HB       SER  23 -15.583  -3.000  -1.004
  137   2HB   SER  23          2HB       SER  23 -14.698  -1.507  -1.310
  138    HG   SER  23           HG       SER  23 -16.730  -1.171  -0.278
  139    H    SER  24           H        SER  24 -14.793   0.014  -2.519
  140    HA   SER  24           HA       SER  24 -15.955   1.131  -5.050
  141   1HB   SER  24          1HB       SER  24 -15.724   2.151  -2.218
  142   2HB   SER  24          2HB       SER  24 -16.030   3.249  -3.565
  143    HG   SER  24           HG       SER  24 -17.960   2.403  -3.857
  144    H    GLY  25           H        GLY  25 -13.780   2.655  -2.688
  145   1HA   GLY  25          1HA       GLY  25 -11.699   2.816  -4.834
  146   2HA   GLY  25          2HA       GLY  25 -12.125   4.223  -3.865
  147    H    GLN  26           H        GLN  26 -12.118   1.165  -2.246
  148    HA   GLN  26           HA       GLN  26 -10.034   2.043  -0.424
  149   1HB   GLN  26          1HB       GLN  26 -11.413  -0.623  -0.870
  150   2HB   GLN  26          2HB       GLN  26 -10.439  -0.216   0.543
  151   1HG   GLN  26          1HG       GLN  26 -12.437   1.831   0.001
  152   2HG   GLN  26          2HG       GLN  26 -13.181   0.250   0.225
  153   1HE2  GLN  26          1HE2      GLN  26 -13.505  -0.355   2.376
  154   2HE2  GLN  26          2HE2      GLN  26 -12.688   0.310   3.707
  155    H    ARG  27           H        ARG  27  -8.251   2.358  -1.947
  156    HA   ARG  27           HA       ARG  27  -7.192   0.324  -3.651
  157   1HB   ARG  27          1HB       ARG  27  -5.026   1.737  -3.304
  158   2HB   ARG  27          2HB       ARG  27  -6.412   2.478  -4.086
  159   1HG   ARG  27          1HG       ARG  27  -5.198   3.842  -2.277
  160   2HG   ARG  27          2HG       ARG  27  -6.954   3.769  -2.179
  161   1HD   ARG  27          1HD       ARG  27  -6.664   1.876  -0.490
  162   2HD   ARG  27          2HD       ARG  27  -4.932   2.250  -0.498
  163    HE   ARG  27           HE       ARG  27  -6.201   4.714  -0.169
  164   1HH1  ARG  27          1HH1      ARG  27  -6.170   1.656   1.496
  165   2HH1  ARG  27          2HH1      ARG  27  -6.481   2.368   3.041
  166   1HH2  ARG  27          1HH2      ARG  27  -6.603   5.615   1.847
  167   2HH2  ARG  27          2HH2      ARG  27  -6.724   4.593   3.240
  168    H    TYR  28           H        TYR  28  -7.483  -1.516  -1.929
  169    HA   TYR  28           HA       TYR  28  -5.641  -1.649   0.281
  170   1HB   TYR  28          1HB       TYR  28  -6.319  -3.981   0.363
  171   2HB   TYR  28          2HB       TYR  28  -7.726  -2.991  -0.010
  172    HD1  TYR  28           HD1      TYR  28  -5.300  -5.423  -1.337
  173    HD2  TYR  28           HD2      TYR  28  -8.752  -3.035  -2.217
  174    HE1  TYR  28           HE1      TYR  28  -5.747  -6.798  -3.341
  175    HE2  TYR  28           HE2      TYR  28  -9.187  -4.400  -4.233
  176    HH   TYR  28           HH       TYR  28  -8.602  -6.842  -4.960
  177    H    PHE  29           H        PHE  29  -3.491  -1.854   0.169
  178    HA   PHE  29           HA       PHE  29  -2.117  -2.268  -2.329
  179   1HB   PHE  29          1HB       PHE  29  -1.308  -2.094   0.578
  180   2HB   PHE  29          2HB       PHE  29  -0.128  -2.242  -0.726
  181    HD1  PHE  29           HD1      PHE  29  -2.830  -0.106   0.678
  182    HD2  PHE  29           HD2      PHE  29   0.328  -0.401  -2.221
  183    HE1  PHE  29           HE1      PHE  29  -3.025   2.314   0.217
  184    HE2  PHE  29           HE2      PHE  29   0.133   2.022  -2.677
  185    HZ   PHE  29           HZ       PHE  29  -1.544   3.382  -1.461
  186    H    LYS  30           H        LYS  30  -1.908  -4.171  -3.284
  187    HA   LYS  30           HA       LYS  30  -2.226  -6.725  -1.937
  188   1HB   LYS  30          1HB       LYS  30  -1.493  -5.769  -4.703
  189   2HB   LYS  30          2HB       LYS  30  -1.679  -7.477  -4.313
  190   1HG   LYS  30          1HG       LYS  30  -3.936  -6.146  -3.263
  191   2HG   LYS  30          2HG       LYS  30  -3.683  -5.487  -4.871
  192   1HD   LYS  30          1HD       LYS  30  -3.239  -8.211  -5.221
  193   2HD   LYS  30          2HD       LYS  30  -4.597  -8.158  -4.100
  194   1HE   LYS  30          1HE       LYS  30  -5.342  -6.227  -5.890
  195   2HE   LYS  30          2HE       LYS  30  -4.480  -7.359  -6.947
  196   1HZ   LYS  30          1HZ       LYS  30  -5.804  -9.144  -6.205
  197   2HZ   LYS  30          2HZ       LYS  30  -6.904  -7.882  -6.495
  198   3HZ   LYS  30          3HZ       LYS  30  -6.435  -8.257  -4.905
  199    H    ASN  31           H        ASN  31  -0.597  -8.097  -1.337
  200    HA   ASN  31           HA       ASN  31   2.220  -7.140  -1.695
  201   1HB   ASN  31          1HB       ASN  31   0.988  -7.443   0.595
  202   2HB   ASN  31          2HB       ASN  31   1.257  -9.163   0.318
  203   1HD2  ASN  31          1HD2      ASN  31   2.719  -8.903   2.317
  204   2HD2  ASN  31          2HD2      ASN  31   4.314  -8.382   2.060
  205    H    HIS  32           H        HIS  32   3.230  -8.300  -3.331
  206    HA   HIS  32           HA       HIS  32   2.343 -11.100  -3.832
  207   1HB   HIS  32          1HB       HIS  32   4.338  -9.338  -5.298
  208   2HB   HIS  32          2HB       HIS  32   3.627 -10.833  -5.897
  209    HD1  HIS  32           HD1      HIS  32   1.219 -10.743  -6.791
  210    HD2  HIS  32           HD2      HIS  32   2.503  -7.098  -5.225
  211    HE1  HIS  32           HE1      HIS  32  -0.546  -9.031  -7.409
  212    H    ILE  33           H        ILE  33   5.030  -9.245  -2.552
  213    HA   ILE  33           HA       ILE  33   7.033 -11.317  -2.557
  214    HB   ILE  33           HB       ILE  33   7.943  -9.894  -0.613
  215   1HG1  ILE  33          1HG1      ILE  33   5.800  -7.910  -1.386
  216   2HG1  ILE  33          2HG1      ILE  33   5.520  -9.076  -0.093
  217   1HG2  ILE  33          1HG2      ILE  33   7.781  -7.790  -2.430
  218   2HG2  ILE  33          2HG2      ILE  33   7.587  -9.235  -3.421
  219   3HG2  ILE  33          3HG2      ILE  33   9.012  -9.052  -2.398
  220   1HD1  ILE  33          1HD1      ILE  33   7.069  -6.642  -0.031
  221   2HD1  ILE  33          2HD1      ILE  33   8.102  -8.018   0.355
  222   3HD1  ILE  33          3HD1      ILE  33   6.645  -7.716   1.303
  223    H    ASP  34           H        ASP  34   4.312 -10.551  -0.498
  224    HA   ASP  34           HA       ASP  34   4.928 -12.966   1.177
  225   1HB   ASP  34          1HB       ASP  34   4.887 -10.339   1.966
  226   2HB   ASP  34          2HB       ASP  34   3.227 -10.829   2.305
  227    H    GLN  35           H        GLN  35   2.875 -11.753  -1.160
  228    HA   GLN  35           HA       GLN  35   0.724 -12.359  -1.889
  229   1HB   GLN  35          1HB       GLN  35   1.304 -14.680  -0.021
  230   2HB   GLN  35          2HB       GLN  35   0.146 -14.684  -1.351
  231   1HG   GLN  35          1HG       GLN  35   1.775 -15.184  -2.824
  232   2HG   GLN  35          2HG       GLN  35   2.718 -13.788  -2.304
  233   1HE2  GLN  35          1HE2      GLN  35   4.668 -15.236  -2.535
  234   2HE2  GLN  35          2HE2      GLN  35   5.039 -16.326  -1.288
  235    H    THR  36           H        THR  36  -0.212 -10.515  -0.648
  236    HA   THR  36           HA       THR  36  -2.336 -11.366   1.130
  237    HB   THR  36           HB       THR  36  -1.114  -9.709   2.946
  238    HG1  THR  36           HG1      THR  36   1.044 -10.344   3.031
  239   1HG2  THR  36          1HG2      THR  36  -0.299 -12.548   3.113
  240   2HG2  THR  36          2HG2      THR  36  -2.026 -12.261   2.896
  241   3HG2  THR  36          3HG2      THR  36  -1.181 -11.557   4.274
  242    H    THR  37           H        THR  37  -3.926  -9.789   1.135
  243    HA   THR  37           HA       THR  37  -3.294  -7.206  -0.220
  244    HB   THR  37           HB       THR  37  -5.711  -7.157  -0.620
  245    HG1  THR  37           HG1      THR  37  -5.869  -9.545   0.883
  246   1HG2  THR  37          1HG2      THR  37  -3.990  -9.289  -1.436
  247   2HG2  THR  37          2HG2      THR  37  -5.355  -8.591  -2.308
  248   3HG2  THR  37          3HG2      THR  37  -5.611  -9.945  -1.207
  249    H    THR  38           H        THR  38  -3.301  -5.310   0.979
  250    HA   THR  38           HA       THR  38  -4.618  -5.370   3.674
  251    HB   THR  38           HB       THR  38  -2.138  -5.748   3.752
  252    HG1  THR  38           HG1      THR  38  -2.604  -4.823   5.576
  253   1HG2  THR  38          1HG2      THR  38  -1.992  -3.949   1.724
  254   2HG2  THR  38          2HG2      THR  38  -0.630  -4.339   2.774
  255   3HG2  THR  38          3HG2      THR  38  -1.608  -2.907   3.093
  256    H    TRP  39           H        TRP  39  -5.001  -3.121   4.524
  257    HA   TRP  39           HA       TRP  39  -6.031  -1.390   2.397
  258   1HB   TRP  39          1HB       TRP  39  -6.021  -1.059   5.411
  259   2HB   TRP  39          2HB       TRP  39  -7.073  -0.225   4.270
  260    HD1  TRP  39           HD1      TRP  39  -6.516  -3.615   5.925
  261    HE1  TRP  39           HE1      TRP  39  -8.615  -5.065   5.577
  262    HE3  TRP  39           HE3      TRP  39  -9.124  -0.641   2.689
  263    HZ2  TRP  39           HZ2      TRP  39 -11.072  -4.980   4.123
  264    HZ3  TRP  39           HZ3      TRP  39 -11.339  -1.356   1.839
  265    HH2  TRP  39           HH2      TRP  39 -12.314  -3.521   2.552
  266    H    GLN  40           H        GLN  40  -4.054  -0.741   5.310
  267    HA   GLN  40           HA       GLN  40  -3.113   1.805   4.689
  268   1HB   GLN  40          1HB       GLN  40  -1.652  -0.524   5.976
  269   2HB   GLN  40          2HB       GLN  40  -1.207   1.172   6.157
  270   1HG   GLN  40          1HG       GLN  40  -2.660   1.322   7.870
  271   2HG   GLN  40          2HG       GLN  40  -3.973   1.014   6.733
  272   1HE2  GLN  40          1HE2      GLN  40  -2.734  -0.127   9.588
  273   2HE2  GLN  40          2HE2      GLN  40  -3.208  -1.754   9.477
  274    H    ASP  41           H        ASP  41  -0.817   2.386   3.993
  275    HA   ASP  41           HA       ASP  41  -0.214   1.029   1.426
  276   1HB   ASP  41          1HB       ASP  41  -0.499   3.529   1.744
  277   2HB   ASP  41          2HB       ASP  41   0.989   3.510   2.689
  278    HA   PRO  42           HA       PRO  42   3.228  -1.118   3.201
  279   1HB   PRO  42          1HB       PRO  42   4.654  -1.602   0.914
  280   2HB   PRO  42          2HB       PRO  42   3.185  -2.496   1.347
  281   1HG   PRO  42          1HG       PRO  42   3.534  -0.220  -0.550
  282   2HG   PRO  42          2HG       PRO  42   2.547  -1.679  -0.715
  283   1HD   PRO  42          1HD       PRO  42   1.523   0.742  -0.024
  284   2HD   PRO  42          2HD       PRO  42   0.818  -0.796   0.513
  285    H    ARG  43           H        ARG  43   3.563   1.781   1.294
  286    HA   ARG  43           HA       ARG  43   6.393   2.138   2.174
  287   1HB   ARG  43          1HB       ARG  43   5.252   2.456  -0.234
  288   2HB   ARG  43          2HB       ARG  43   4.940   4.066   0.414
  289   1HG   ARG  43          1HG       ARG  43   7.055   4.594  -0.173
  290   2HG   ARG  43          2HG       ARG  43   7.591   3.532   1.128
  291   1HD   ARG  43          1HD       ARG  43   6.887   1.903  -1.134
  292   2HD   ARG  43          2HD       ARG  43   8.000   3.177  -1.669
  293    HE   ARG  43           HE       ARG  43   8.649   1.012   0.169
  294   1HH1  ARG  43          1HH1      ARG  43   9.291   4.332  -0.659
  295   2HH1  ARG  43          2HH1      ARG  43  10.872   4.315   0.039
  296   1HH2  ARG  43          1HH2      ARG  43  10.705   1.015   1.068
  297   2HH2  ARG  43          2HH2      ARG  43  11.670   2.453   1.010
  298    H    LYS  44           H        LYS  44   3.576   4.324   1.783
  299    HA   LYS  44           HA       LYS  44   4.418   6.298   3.622
  300   1HB   LYS  44          1HB       LYS  44   2.595   6.542   1.994
  301   2HB   LYS  44          2HB       LYS  44   1.639   5.338   2.859
  302   1HG   LYS  44          1HG       LYS  44   0.815   7.441   3.613
  303   2HG   LYS  44          2HG       LYS  44   1.866   6.871   4.909
  304   1HD   LYS  44          1HD       LYS  44   3.337   8.568   4.606
  305   2HD   LYS  44          2HD       LYS  44   3.297   8.398   2.851
  306   1HE   LYS  44          1HE       LYS  44   1.573   9.927   2.611
  307   2HE   LYS  44          2HE       LYS  44   0.870   9.535   4.192
  308   1HZ   LYS  44          1HZ       LYS  44   2.962  10.483   5.175
  309   2HZ   LYS  44          2HZ       LYS  44   1.949  11.623   4.427
  310   3HZ   LYS  44          3HZ       LYS  44   3.348  11.077   3.634
  311    H    ALA  45           H        ALA  45   2.395   3.403   4.180
  312    HA   ALA  45           HA       ALA  45   2.432   3.949   7.110
  313   1HB   ALA  45          1HB       ALA  45   0.753   2.523   5.140
  314   2HB   ALA  45          2HB       ALA  45   0.285   3.330   6.638
  315   3HB   ALA  45          3HB       ALA  45   0.931   1.689   6.685
  316    H    MET  46           H        MET  46   4.778   3.365   7.256
  317    HA   MET  46           HA       MET  46   5.545   0.587   6.662
  318   1HB   MET  46          1HB       MET  46   6.809   3.031   6.818
  319   2HB   MET  46          2HB       MET  46   7.292   2.271   8.333
  320   1HG   MET  46          1HG       MET  46   8.934   1.587   6.752
  321   2HG   MET  46          2HG       MET  46   7.860   0.199   6.924
  322   1HE   MET  46          1HE       MET  46   8.861   0.037   3.213
  323   2HE   MET  46          2HE       MET  46   8.369  -0.968   4.575
  324   3HE   MET  46          3HE       MET  46   9.697   0.174   4.766
  325    H    LEU  47           H        LEU  47   5.748   2.544   9.664
  326    HA   LEU  47           HA       LEU  47   5.099   0.048  11.201
  327   1HB   LEU  47          1HB       LEU  47   7.354   1.672  11.221
  328   2HB   LEU  47          2HB       LEU  47   6.439   2.237  12.619
  329    HG   LEU  47           HG       LEU  47   6.443  -0.676  12.416
  330   1HD1  LEU  47          1HD1      LEU  47   9.098   0.251  13.295
  331   2HD1  LEU  47          2HD1      LEU  47   8.817   0.419  11.563
  332   3HD1  LEU  47          3HD1      LEU  47   8.662  -1.160  12.333
  333   1HD2  LEU  47          1HD2      LEU  47   7.287  -0.369  14.787
  334   2HD2  LEU  47          2HD2      LEU  47   5.760   0.440  14.438
  335   3HD2  LEU  47          3HD2      LEU  47   7.256   1.370  14.496
  336    H    SER  48           H        SER  48   2.899   1.431  10.348
  337    HA   SER  48           HA       SER  48   2.128   3.299  12.546
  338   1HB   SER  48          1HB       SER  48   0.760   2.594   9.929
  339   2HB   SER  48          2HB       SER  48   0.356   3.943  10.990
  340    HG   SER  48           HG       SER  48   2.356   4.846  10.562
  341    H    GLN  49           H        GLN  49   2.075   1.162  13.904
  342    HA   GLN  49           HA       GLN  49   0.172  -0.891  13.517
  343   1HB   GLN  49          1HB       GLN  49   2.024  -0.676  15.237
  344   2HB   GLN  49          2HB       GLN  49   0.964   0.406  16.141
  345   1HG   GLN  49          1HG       GLN  49   0.085  -1.436  17.107
  346   2HG   GLN  49          2HG       GLN  49  -0.645  -1.804  15.543
  347   1HE2  GLN  49          1HE2      GLN  49  -0.336  -4.102  15.596
  348   2HE2  GLN  49          2HE2      GLN  49   1.200  -4.824  15.612
  349    H    MET  50           H        MET  50  -0.270   2.429  14.568
  350    HA   MET  50           HA       MET  50  -3.219   1.936  14.695
  351   1HB   MET  50          1HB       MET  50  -2.067   1.993  16.955
  352   2HB   MET  50          2HB       MET  50  -1.629   3.667  16.611
  353   1HG   MET  50          1HG       MET  50  -4.472   3.062  16.149
  354   2HG   MET  50          2HG       MET  50  -3.968   2.875  17.829
  355   1HE   MET  50          1HE       MET  50  -6.132   5.035  17.088
  356   2HE   MET  50          2HE       MET  50  -5.483   4.963  15.452
  357   3HE   MET  50          3HE       MET  50  -5.546   6.506  16.300
  358   1H    GLY  51          1H        GLY  51 -15.523  -5.340  11.629
  359   2H    GLY  51          2H        GLY  51 -14.911  -3.780  11.352
  360   3H    GLY  51          3H        GLY  51 -14.761  -4.495  12.886
  361   1HA   GLY  51          1HA       GLY  51 -12.698  -4.992  12.189
  362   2HA   GLY  51          2HA       GLY  51 -13.535  -6.334  11.407
  363    H    THR  52           H        THR  52 -11.268  -5.594  10.179
  364    HA   THR  52           HA       THR  52 -12.228  -4.058   7.788
  365    HB   THR  52           HB       THR  52  -9.466  -4.009   9.046
  366    HG1  THR  52           HG1      THR  52 -11.046  -3.006  10.349
  367   1HG2  THR  52          1HG2      THR  52 -10.399  -3.263   6.485
  368   2HG2  THR  52          2HG2      THR  52  -8.827  -2.902   7.198
  369   3HG2  THR  52          3HG2      THR  52 -10.160  -1.761   7.379
  370    HA   PRO  53           HA       PRO  53 -10.395  -8.253   6.761
  371   1HB   PRO  53          1HB       PRO  53 -12.581  -9.262   5.460
  372   2HB   PRO  53          2HB       PRO  53 -12.320  -9.451   7.204
  373   1HG   PRO  53          1HG       PRO  53 -14.071  -7.534   5.739
  374   2HG   PRO  53          2HG       PRO  53 -14.372  -8.407   7.248
  375   1HD   PRO  53          1HD       PRO  53 -13.634  -5.779   7.138
  376   2HD   PRO  53          2HD       PRO  53 -13.277  -6.844   8.514
  377    HA   PRO  54           HA       PRO  54  -9.726  -6.052   2.859
  378   1HB   PRO  54          1HB       PRO  54  -7.497  -7.473   2.133
  379   2HB   PRO  54          2HB       PRO  54  -7.457  -6.119   3.279
  380   1HG   PRO  54          1HG       PRO  54  -7.514  -9.059   3.814
  381   2HG   PRO  54          2HG       PRO  54  -6.547  -7.795   4.591
  382   1HD   PRO  54          1HD       PRO  54  -8.775  -8.815   5.729
  383   2HD   PRO  54          2HD       PRO  54  -8.288  -7.118   5.948
  384    HA   PRO  55           HA       PRO  55 -11.397  -8.831  -0.102
  385   1HB   PRO  55          1HB       PRO  55  -9.955  -8.337  -2.383
  386   2HB   PRO  55          2HB       PRO  55 -11.156  -7.205  -1.729
  387   1HG   PRO  55          1HG       PRO  55  -8.190  -7.157  -1.508
  388   2HG   PRO  55          2HG       PRO  55  -9.328  -5.827  -1.749
  389   1HD   PRO  55          1HD       PRO  55  -8.184  -6.407   0.653
  390   2HD   PRO  55          2HD       PRO  55  -9.777  -5.635   0.489
  391    HA   PRO  56           HA       PRO  56  -8.989 -12.510  -0.292
  392   1HB   PRO  56          1HB       PRO  56  -9.992 -13.754  -2.514
  393   2HB   PRO  56          2HB       PRO  56 -10.889 -13.633  -0.987
  394   1HG   PRO  56          1HG       PRO  56 -11.158 -12.017  -3.472
  395   2HG   PRO  56          2HG       PRO  56 -12.410 -12.620  -2.377
  396   1HD   PRO  56          1HD       PRO  56 -11.520 -10.046  -2.361
  397   2HD   PRO  56          2HD       PRO  56 -12.181 -10.865  -0.930
  398    H    TYR  57           H        TYR  57  -6.841 -12.173  -0.812
  399    HA   TYR  57           HA       TYR  57  -5.763 -10.845  -3.035
  400   1HB   TYR  57          1HB       TYR  57  -4.601 -11.595  -0.951
  401   2HB   TYR  57          2HB       TYR  57  -4.644 -13.250  -1.558
  402    HD1  TYR  57           HD1      TYR  57  -4.004 -10.025  -3.351
  403    HD2  TYR  57           HD2      TYR  57  -2.432 -13.818  -2.090
  404    HE1  TYR  57           HE1      TYR  57  -1.936  -9.599  -4.652
  405    HE2  TYR  57           HE2      TYR  57  -0.366 -13.392  -3.391
  406    HH   TYR  57           HH       TYR  57   0.395 -12.061  -5.241
  407    H    THR  58           H        THR  58  -5.016 -11.564  -5.091
  408    HA   THR  58           HA       THR  58  -5.956 -14.284  -5.941
  409    HB   THR  58           HB       THR  58  -6.129 -11.613  -7.366
  410    HG1  THR  58           HG1      THR  58  -8.424 -12.265  -7.219
  411   1HG2  THR  58          1HG2      THR  58  -6.019 -12.912  -9.223
  412   2HG2  THR  58          2HG2      THR  58  -7.661 -13.388  -8.787
  413   3HG2  THR  58          3HG2      THR  58  -6.296 -14.397  -8.311
  414    H    VAL  59           H        VAL  59  -3.278 -12.293  -5.583
  415    HA   VAL  59           HA       VAL  59  -1.093 -12.365  -6.476
  416    HB   VAL  59           HB       VAL  59  -2.121 -15.081  -7.370
  417   1HG1  VAL  59          1HG1      VAL  59   0.395 -13.747  -7.714
  418   2HG1  VAL  59          2HG1      VAL  59  -0.055 -15.380  -8.204
  419   3HG1  VAL  59          3HG1      VAL  59   0.617 -15.093  -6.599
  420   1HG2  VAL  59          1HG2      VAL  59  -0.501 -14.615  -4.894
  421   2HG2  VAL  59          2HG2      VAL  59  -1.656 -15.899  -5.247
  422   3HG2  VAL  59          3HG2      VAL  59  -2.232 -14.282  -4.845
  423    H    GLY  60           H        GLY  60  -3.499 -11.517  -8.208
  424   1HA   GLY  60          1HA       GLY  60  -2.375 -12.116 -10.900
  425   2HA   GLY  60          2HA       GLY  60  -3.991 -11.480 -10.595
  Start of MODEL    9
    1    H    PHE   5           H        PHE   5  -6.308  11.380   8.507
    2    HA   PHE   5           HA       PHE   5  -3.887  11.540   7.012
    3   1HB   PHE   5          1HB       PHE   5  -4.596   9.882   8.797
    4   2HB   PHE   5          2HB       PHE   5  -5.583   9.089   7.570
    5    HD1  PHE   5           HD1      PHE   5  -4.558   7.103   6.897
    6    HD2  PHE   5           HD2      PHE   5  -2.155  10.615   7.486
    7    HE1  PHE   5           HE1      PHE   5  -2.564   5.875   6.084
    8    HE2  PHE   5           HE2      PHE   5  -0.160   9.386   6.674
    9    HZ   PHE   5           HZ       PHE   5  -0.364   7.016   5.972
   10    H    GLU   6           H        GLU   6  -3.407  10.354   4.968
   11    HA   GLU   6           HA       GLU   6  -5.516   9.477   3.192
   12   1HB   GLU   6          1HB       GLU   6  -5.004  12.298   3.472
   13   2HB   GLU   6          2HB       GLU   6  -4.571  11.791   1.839
   14   1HG   GLU   6          1HG       GLU   6  -6.728  11.330   1.272
   15   2HG   GLU   6          2HG       GLU   6  -7.104  10.659   2.859
   16    H    ILE   7           H        ILE   7  -4.458   8.054   1.867
   17    HA   ILE   7           HA       ILE   7  -1.545   8.087   1.636
   18    HB   ILE   7           HB       ILE   7  -3.673   6.432   0.241
   19   1HG1  ILE   7          1HG1      ILE   7  -3.863   6.348   2.710
   20   2HG1  ILE   7          2HG1      ILE   7  -3.298   4.810   2.060
   21   1HG2  ILE   7          1HG2      ILE   7  -1.889   4.806  -0.077
   22   2HG2  ILE   7          2HG2      ILE   7  -0.760   5.821   0.819
   23   3HG2  ILE   7          3HG2      ILE   7  -1.372   6.353  -0.746
   24   1HD1  ILE   7          1HD1      ILE   7  -1.943   6.676   3.858
   25   2HD1  ILE   7          2HD1      ILE   7  -0.951   6.247   2.465
   26   3HD1  ILE   7          3HD1      ILE   7  -1.581   4.983   3.521
   27    HA   PRO   8           HA       PRO   8  -1.436  10.519  -2.062
   28   1HB   PRO   8          1HB       PRO   8   1.043   9.802  -2.971
   29   2HB   PRO   8          2HB       PRO   8   0.796  10.906  -1.605
   30   1HG   PRO   8          1HG       PRO   8   1.501   8.011  -1.609
   31   2HG   PRO   8          2HG       PRO   8   2.070   9.309  -0.549
   32   1HD   PRO   8          1HD       PRO   8   0.164   7.485   0.169
   33   2HD   PRO   8          2HD       PRO   8   0.285   9.116   0.861
   34    H    ASP   9           H        ASP   9  -1.272  10.181  -4.460
   35    HA   ASP   9           HA       ASP   9  -1.857   7.332  -5.211
   36   1HB   ASP   9          1HB       ASP   9  -3.385   9.700  -5.396
   37   2HB   ASP   9          2HB       ASP   9  -2.867   9.338  -7.042
   38    H    ASP  10           H        ASP  10   0.719   9.084  -5.254
   39    HA   ASP  10           HA       ASP  10   1.320   8.734  -8.174
   40   1HB   ASP  10          1HB       ASP  10   1.247  11.067  -7.129
   41   2HB   ASP  10          2HB       ASP  10   2.671  10.595  -6.203
   42    H    VAL  11           H        VAL  11   2.163   7.825  -4.937
   43    HA   VAL  11           HA       VAL  11   4.906   7.195  -5.167
   44    HB   VAL  11           HB       VAL  11   4.335   5.601  -3.331
   45   1HG1  VAL  11          1HG1      VAL  11   4.550   8.078  -2.958
   46   2HG1  VAL  11          2HG1      VAL  11   3.488   7.278  -1.800
   47   3HG1  VAL  11          3HG1      VAL  11   2.800   8.204  -3.134
   48   1HG2  VAL  11          1HG2      VAL  11   2.302   4.639  -3.324
   49   2HG2  VAL  11          2HG2      VAL  11   1.796   5.665  -4.666
   50   3HG2  VAL  11          3HG2      VAL  11   1.582   6.217  -3.004
   51    HA   PRO  12           HA       PRO  12   4.618   3.867  -8.120
   52   1HB   PRO  12          1HB       PRO  12   7.214   3.029  -7.990
   53   2HB   PRO  12          2HB       PRO  12   6.715   4.496  -8.851
   54   1HG   PRO  12          1HG       PRO  12   8.004   4.197  -6.193
   55   2HG   PRO  12          2HG       PRO  12   8.209   5.461  -7.411
   56   1HD   PRO  12          1HD       PRO  12   6.683   5.697  -5.117
   57   2HD   PRO  12          2HD       PRO  12   6.497   6.699  -6.570
   58    H    LEU  13           H        LEU  13   4.908   3.540  -4.799
   59    HA   LEU  13           HA       LEU  13   4.645   1.697  -3.351
   60   1HB   LEU  13          1HB       LEU  13   3.301   1.163  -5.802
   61   2HB   LEU  13          2HB       LEU  13   4.098  -0.334  -5.319
   62    HG   LEU  13           HG       LEU  13   3.084  -0.121  -3.062
   63   1HD1  LEU  13          1HD1      LEU  13   1.307   2.048  -4.122
   64   2HD1  LEU  13          2HD1      LEU  13   2.877   2.477  -3.448
   65   3HD1  LEU  13          3HD1      LEU  13   1.688   1.639  -2.450
   66   1HD2  LEU  13          1HD2      LEU  13   1.463  -1.395  -3.951
   67   2HD2  LEU  13          2HD2      LEU  13   1.727  -0.661  -5.533
   68   3HD2  LEU  13          3HD2      LEU  13   0.589   0.068  -4.401
   69    HA   PRO  14           HA       PRO  14   8.508  -0.404  -3.678
   70   1HB   PRO  14          1HB       PRO  14   8.217  -2.202  -1.643
   71   2HB   PRO  14          2HB       PRO  14   8.507  -0.473  -1.387
   72   1HG   PRO  14          1HG       PRO  14   6.046  -2.036  -1.035
   73   2HG   PRO  14          2HG       PRO  14   6.534  -0.521  -0.283
   74   1HD   PRO  14          1HD       PRO  14   4.720  -0.883  -2.424
   75   2HD   PRO  14          2HD       PRO  14   5.314   0.653  -1.776
   76    H    ALA  15           H        ALA  15   9.379  -2.809  -3.706
   77    HA   ALA  15           HA       ALA  15   8.086  -4.186  -5.897
   78   1HB   ALA  15          1HB       ALA  15  10.574  -4.090  -4.637
   79   2HB   ALA  15          2HB       ALA  15  10.137  -5.153  -5.974
   80   3HB   ALA  15          3HB       ALA  15  10.001  -5.727  -4.311
   81    H    GLY  16           H        GLY  16   7.031  -6.278  -5.824
   82   1HA   GLY  16          1HA       GLY  16   5.589  -7.863  -4.912
   83   2HA   GLY  16          2HA       GLY  16   6.606  -7.806  -3.474
   84    H    TRP  17           H        TRP  17   5.091  -4.938  -4.743
   85    HA   TRP  17           HA       TRP  17   2.978  -5.049  -2.649
   86   1HB   TRP  17          1HB       TRP  17   5.331  -3.217  -2.907
   87   2HB   TRP  17          2HB       TRP  17   3.823  -2.564  -2.272
   88    HD1  TRP  17           HD1      TRP  17   6.857  -4.215  -1.133
   89    HE1  TRP  17           HE1      TRP  17   6.527  -5.208   1.234
   90    HE3  TRP  17           HE3      TRP  17   1.796  -4.004  -0.810
   91    HZ2  TRP  17           HZ2      TRP  17   4.361  -5.821   3.027
   92    HZ3  TRP  17           HZ3      TRP  17   0.605  -4.779   1.214
   93    HH2  TRP  17           HH2      TRP  17   1.880  -5.691   3.134
   94    H    GLU  18           H        GLU  18   1.418  -5.120  -4.378
   95    HA   GLU  18           HA       GLU  18   1.348  -2.784  -6.250
   96   1HB   GLU  18          1HB       GLU  18   1.038  -5.452  -6.670
   97   2HB   GLU  18          2HB       GLU  18  -0.641  -4.981  -6.383
   98   1HG   GLU  18          1HG       GLU  18  -0.772  -4.016  -8.415
   99   2HG   GLU  18          2HG       GLU  18   0.675  -3.056  -8.103
  100    H    MET  19           H        MET  19  -1.355  -2.699  -6.677
  101    HA   MET  19           HA       MET  19  -2.812  -2.554  -4.160
  102   1HB   MET  19          1HB       MET  19  -2.908  -0.181  -3.962
  103   2HB   MET  19          2HB       MET  19  -1.216  -0.618  -4.147
  104   1HG   MET  19          1HG       MET  19  -2.909   0.166  -6.529
  105   2HG   MET  19          2HG       MET  19  -2.093   1.375  -5.546
  106   1HE   MET  19          1HE       MET  19   1.349   1.359  -6.089
  107   2HE   MET  19          2HE       MET  19  -0.152   1.962  -5.394
  108   3HE   MET  19          3HE       MET  19   0.218   2.283  -7.085
  109    H    ALA  20           H        ALA  20  -5.010  -1.911  -4.426
  110    HA   ALA  20           HA       ALA  20  -6.084  -1.296  -7.065
  111   1HB   ALA  20          1HB       ALA  20  -6.456  -3.422  -7.777
  112   2HB   ALA  20          2HB       ALA  20  -7.080  -3.911  -6.200
  113   3HB   ALA  20          3HB       ALA  20  -5.343  -3.923  -6.504
  114    H    LYS  21           H        LYS  21  -8.208  -0.543  -6.816
  115    HA   LYS  21           HA       LYS  21  -9.194  -0.296  -4.057
  116   1HB   LYS  21          1HB       LYS  21 -10.782   1.245  -5.080
  117   2HB   LYS  21          2HB       LYS  21  -9.185   1.552  -5.756
  118   1HG   LYS  21          1HG       LYS  21  -9.762   0.168  -7.729
  119   2HG   LYS  21          2HG       LYS  21 -11.369  -0.104  -7.056
  120   1HD   LYS  21          1HD       LYS  21 -12.098   1.954  -7.654
  121   2HD   LYS  21          2HD       LYS  21 -10.594   2.728  -7.155
  122   1HE   LYS  21          1HE       LYS  21 -10.302   3.005  -9.422
  123   2HE   LYS  21          2HE       LYS  21  -9.756   1.318  -9.357
  124   1HZ   LYS  21          1HZ       LYS  21 -12.549   2.252  -9.800
  125   2HZ   LYS  21          2HZ       LYS  21 -12.079   0.627  -9.649
  126   3HZ   LYS  21          3HZ       LYS  21 -11.538   1.551 -10.968
  127    H    THR  22           H        THR  22 -10.754  -1.577  -3.185
  128    HA   THR  22           HA       THR  22 -11.840  -3.811  -4.743
  129    HB   THR  22           HB       THR  22 -12.788  -3.104  -2.001
  130    HG1  THR  22           HG1      THR  22 -10.874  -3.403  -1.097
  131   1HG2  THR  22          1HG2      THR  22 -12.873  -5.409  -1.729
  132   2HG2  THR  22          2HG2      THR  22 -11.555  -5.691  -2.866
  133   3HG2  THR  22          3HG2      THR  22 -13.157  -5.270  -3.464
  134    H    SER  23           H        SER  23 -14.401  -3.799  -3.301
  135    HA   SER  23           HA       SER  23 -15.929  -2.144  -5.175
  136   1HB   SER  23          1HB       SER  23 -17.790  -3.198  -3.607
  137   2HB   SER  23          2HB       SER  23 -16.912  -4.206  -4.756
  138    HG   SER  23           HG       SER  23 -16.337  -5.306  -3.080
  139    H    SER  24           H        SER  24 -14.470  -0.344  -3.699
  140    HA   SER  24           HA       SER  24 -16.431   1.397  -2.560
  141   1HB   SER  24          1HB       SER  24 -15.275  -0.680  -0.837
  142   2HB   SER  24          2HB       SER  24 -15.072   0.943  -0.178
  143    HG   SER  24           HG       SER  24 -17.512  -0.154  -1.117
  144    H    GLY  25           H        GLY  25 -14.026   1.453  -4.280
  145   1HA   GLY  25          1HA       GLY  25 -12.124   2.784  -4.633
  146   2HA   GLY  25          2HA       GLY  25 -12.867   3.911  -3.503
  147    H    GLN  26           H        GLN  26 -12.203   0.699  -2.371
  148    HA   GLN  26           HA       GLN  26 -10.291   1.800  -0.422
  149   1HB   GLN  26          1HB       GLN  26 -11.557  -0.907  -0.915
  150   2HB   GLN  26          2HB       GLN  26 -10.437  -0.594   0.411
  151   1HG   GLN  26          1HG       GLN  26 -13.064   0.843  -0.079
  152   2HG   GLN  26          2HG       GLN  26 -12.750  -0.346   1.179
  153   1HE2  GLN  26          1HE2      GLN  26 -11.631   0.352   3.082
  154   2HE2  GLN  26          2HE2      GLN  26 -11.159   1.962   3.335
  155    H    ARG  27           H        ARG  27  -8.665   2.312  -2.100
  156    HA   ARG  27           HA       ARG  27  -7.394   0.367  -3.764
  157   1HB   ARG  27          1HB       ARG  27  -5.532   2.066  -3.714
  158   2HB   ARG  27          2HB       ARG  27  -7.108   2.767  -4.059
  159   1HG   ARG  27          1HG       ARG  27  -7.120   3.969  -2.140
  160   2HG   ARG  27          2HG       ARG  27  -6.515   2.606  -1.193
  161   1HD   ARG  27          1HD       ARG  27  -4.424   3.467  -1.223
  162   2HD   ARG  27          2HD       ARG  27  -4.456   3.541  -2.995
  163    HE   ARG  27           HE       ARG  27  -6.059   5.613  -1.656
  164   1HH1  ARG  27          1HH1      ARG  27  -2.964   4.741  -2.997
  165   2HH1  ARG  27          2HH1      ARG  27  -2.492   6.383  -3.250
  166   1HH2  ARG  27          1HH2      ARG  27  -5.419   7.733  -1.998
  167   2HH2  ARG  27          2HH2      ARG  27  -3.867   8.065  -2.691
  168    H    TYR  28           H        TYR  28  -7.266  -1.482  -2.210
  169    HA   TYR  28           HA       TYR  28  -5.452  -1.242   0.071
  170   1HB   TYR  28          1HB       TYR  28  -5.884  -3.652   0.306
  171   2HB   TYR  28          2HB       TYR  28  -7.387  -2.771   0.065
  172    HD1  TYR  28           HD1      TYR  28  -8.656  -2.984  -1.986
  173    HD2  TYR  28           HD2      TYR  28  -4.962  -5.111  -1.472
  174    HE1  TYR  28           HE1      TYR  28  -9.253  -4.455  -3.879
  175    HE2  TYR  28           HE2      TYR  28  -5.564  -6.582  -3.370
  176    HH   TYR  28           HH       TYR  28  -8.343  -5.938  -5.403
  177    H    PHE  29           H        PHE  29  -3.305  -1.671   0.069
  178    HA   PHE  29           HA       PHE  29  -1.984  -2.031  -2.505
  179   1HB   PHE  29          1HB       PHE  29  -1.044  -1.719   0.362
  180   2HB   PHE  29          2HB       PHE  29   0.048  -1.768  -1.028
  181    HD1  PHE  29           HD1      PHE  29   0.279   0.108  -2.495
  182    HD2  PHE  29           HD2      PHE  29  -2.786   0.103   0.510
  183    HE1  PHE  29           HE1      PHE  29  -0.204   2.487  -2.981
  184    HE2  PHE  29           HE2      PHE  29  -3.268   2.479   0.027
  185    HZ   PHE  29           HZ       PHE  29  -1.976   3.675  -1.719
  186    H    LYS  30           H        LYS  30  -1.944  -3.998  -3.339
  187    HA   LYS  30           HA       LYS  30  -2.166  -6.471  -1.911
  188   1HB   LYS  30          1HB       LYS  30  -1.240  -5.654  -4.667
  189   2HB   LYS  30          2HB       LYS  30  -1.509  -7.334  -4.209
  190   1HG   LYS  30          1HG       LYS  30  -3.780  -5.855  -3.401
  191   2HG   LYS  30          2HG       LYS  30  -3.403  -5.335  -5.035
  192   1HD   LYS  30          1HD       LYS  30  -3.056  -8.046  -5.242
  193   2HD   LYS  30          2HD       LYS  30  -4.373  -7.955  -4.074
  194   1HE   LYS  30          1HE       LYS  30  -5.136  -6.075  -5.952
  195   2HE   LYS  30          2HE       LYS  30  -4.393  -7.340  -6.951
  196   1HZ   LYS  30          1HZ       LYS  30  -6.717  -7.860  -6.489
  197   2HZ   LYS  30          2HZ       LYS  30  -6.428  -7.763  -4.818
  198   3HZ   LYS  30          3HZ       LYS  30  -5.699  -8.991  -5.739
  199    H    ASN  31           H        ASN  31  -0.512  -7.996  -1.483
  200    HA   ASN  31           HA       ASN  31   2.289  -6.925  -1.593
  201   1HB   ASN  31          1HB       ASN  31   1.017  -7.107   0.654
  202   2HB   ASN  31          2HB       ASN  31   1.170  -8.851   0.451
  203   1HD2  ASN  31          1HD2      ASN  31   2.558  -8.552   2.520
  204   2HD2  ASN  31          2HD2      ASN  31   4.202  -8.190   2.301
  205    H    HIS  32           H        HIS  32   3.194  -8.112  -3.316
  206    HA   HIS  32           HA       HIS  32   2.416 -10.960  -3.603
  207   1HB   HIS  32          1HB       HIS  32   4.384  -9.283  -5.200
  208   2HB   HIS  32          2HB       HIS  32   3.636 -10.794  -5.703
  209    HD1  HIS  32           HD1      HIS  32   1.477 -10.574  -6.978
  210    HD2  HIS  32           HD2      HIS  32   2.319  -7.144  -4.761
  211    HE1  HIS  32           HE1      HIS  32  -0.374  -8.913  -7.484
  212    H    ILE  33           H        ILE  33   4.324  -9.487  -1.471
  213    HA   ILE  33           HA       ILE  33   6.865 -10.873  -1.725
  214    HB   ILE  33           HB       ILE  33   5.396  -9.516   0.572
  215   1HG1  ILE  33          1HG1      ILE  33   5.887  -7.953  -1.237
  216   2HG1  ILE  33          2HG1      ILE  33   7.017  -7.663   0.089
  217   1HG2  ILE  33          1HG2      ILE  33   7.809  -9.332   1.465
  218   2HG2  ILE  33          2HG2      ILE  33   8.196 -10.612   0.316
  219   3HG2  ILE  33          3HG2      ILE  33   7.018 -10.902   1.595
  220   1HD1  ILE  33          1HD1      ILE  33   8.325  -7.700  -1.931
  221   2HD1  ILE  33          2HD1      ILE  33   7.558  -9.197  -2.464
  222   3HD1  ILE  33          3HD1      ILE  33   8.647  -9.210  -1.078
  223    H    ASP  34           H        ASP  34   4.040 -11.170   0.399
  224    HA   ASP  34           HA       ASP  34   4.658 -14.077   0.705
  225   1HB   ASP  34          1HB       ASP  34   5.040 -12.429   2.681
  226   2HB   ASP  34          2HB       ASP  34   3.280 -12.347   2.768
  227    H    GLN  35           H        GLN  35   2.848 -12.438  -1.135
  228    HA   GLN  35           HA       GLN  35   0.697 -12.616  -2.051
  229   1HB   GLN  35          1HB       GLN  35   1.254 -15.165  -0.601
  230   2HB   GLN  35          2HB       GLN  35  -0.402 -14.896  -1.141
  231   1HG   GLN  35          1HG       GLN  35   0.190 -15.449  -3.239
  232   2HG   GLN  35          2HG       GLN  35   1.354 -14.124  -3.261
  233   1HE2  GLN  35          1HE2      GLN  35   1.133 -17.469  -3.542
  234   2HE2  GLN  35          2HE2      GLN  35   2.732 -17.872  -3.137
  235    H    THR  36           H        THR  36  -0.223 -10.787  -0.936
  236    HA   THR  36           HA       THR  36  -2.414 -11.432   0.878
  237    HB   THR  36           HB       THR  36  -1.172  -9.713   2.579
  238    HG1  THR  36           HG1      THR  36   0.905  -9.759   2.352
  239   1HG2  THR  36          1HG2      THR  36  -0.204 -12.417   3.037
  240   2HG2  THR  36          2HG2      THR  36  -1.895 -12.404   2.542
  241   3HG2  THR  36          3HG2      THR  36  -1.383 -11.481   3.954
  242    H    THR  37           H        THR  37  -3.345  -9.239   1.768
  243    HA   THR  37           HA       THR  37  -2.838  -6.969  -0.110
  244    HB   THR  37           HB       THR  37  -5.227  -6.841  -0.621
  245    HG1  THR  37           HG1      THR  37  -6.666  -8.213   0.340
  246   1HG2  THR  37          1HG2      THR  37  -4.222  -9.691  -0.846
  247   2HG2  THR  37          2HG2      THR  37  -3.906  -8.391  -1.996
  248   3HG2  THR  37          3HG2      THR  37  -5.548  -8.997  -1.779
  249    H    THR  38           H        THR  38  -2.846  -5.029   1.035
  250    HA   THR  38           HA       THR  38  -4.179  -5.045   3.729
  251    HB   THR  38           HB       THR  38  -1.683  -5.272   3.769
  252    HG1  THR  38           HG1      THR  38  -2.937  -4.116   5.390
  253   1HG2  THR  38          1HG2      THR  38  -1.838  -2.570   2.409
  254   2HG2  THR  38          2HG2      THR  38  -1.093  -4.036   1.776
  255   3HG2  THR  38          3HG2      THR  38  -0.375  -3.210   3.158
  256    H    TRP  39           H        TRP  39  -4.799  -2.867   4.495
  257    HA   TRP  39           HA       TRP  39  -5.990  -1.254   2.391
  258   1HB   TRP  39          1HB       TRP  39  -5.732  -0.825   5.383
  259   2HB   TRP  39          2HB       TRP  39  -6.872  -0.004   4.319
  260    HD1  TRP  39           HD1      TRP  39  -6.219  -3.330   6.035
  261    HE1  TRP  39           HE1      TRP  39  -8.323  -4.804   5.832
  262    HE3  TRP  39           HE3      TRP  39  -8.977  -0.499   2.798
  263    HZ2  TRP  39           HZ2      TRP  39 -10.839  -4.788   4.479
  264    HZ3  TRP  39           HZ3      TRP  39 -11.221  -1.256   2.068
  265    HH2  TRP  39           HH2      TRP  39 -12.152  -3.396   2.903
  266    H    GLN  40           H        GLN  40  -3.804  -0.353   5.084
  267    HA   GLN  40           HA       GLN  40  -3.033   2.182   4.162
  268   1HB   GLN  40          1HB       GLN  40  -1.054   1.797   5.611
  269   2HB   GLN  40          2HB       GLN  40  -2.531   1.206   6.373
  270   1HG   GLN  40          1HG       GLN  40  -1.755  -1.007   4.979
  271   2HG   GLN  40          2HG       GLN  40  -0.189  -0.300   5.373
  272   1HE2  GLN  40          1HE2      GLN  40  -3.301  -1.245   6.921
  273   2HE2  GLN  40          2HE2      GLN  40  -2.614  -1.603   8.431
  274    H    ASP  41           H        ASP  41  -0.742   2.724   3.323
  275    HA   ASP  41           HA       ASP  41  -0.159   0.952   0.990
  276   1HB   ASP  41          1HB       ASP  41   0.767   3.003   0.015
  277   2HB   ASP  41          2HB       ASP  41  -0.849   3.326   0.640
  278    HA   PRO  42           HA       PRO  42   3.666  -0.093   2.984
  279   1HB   PRO  42          1HB       PRO  42   4.975  -1.132   0.816
  280   2HB   PRO  42          2HB       PRO  42   3.696  -2.003   1.683
  281   1HG   PRO  42          1HG       PRO  42   3.562  -0.483  -0.877
  282   2HG   PRO  42          2HG       PRO  42   2.776  -2.002  -0.427
  283   1HD   PRO  42          1HD       PRO  42   1.504   0.416  -0.453
  284   2HD   PRO  42          2HD       PRO  42   1.029  -0.933   0.599
  285    H    ARG  43           H        ARG  43   3.667   2.554   2.758
  286    HA   ARG  43           HA       ARG  43   6.373   3.254   1.998
  287   1HB   ARG  43          1HB       ARG  43   4.287   3.296   0.007
  288   2HB   ARG  43          2HB       ARG  43   4.859   4.940   0.288
  289   1HG   ARG  43          1HG       ARG  43   7.114   4.346  -0.223
  290   2HG   ARG  43          2HG       ARG  43   6.753   2.621  -0.144
  291   1HD   ARG  43          1HD       ARG  43   6.073   2.588  -2.314
  292   2HD   ARG  43          2HD       ARG  43   5.055   4.021  -2.083
  293    HE   ARG  43           HE       ARG  43   6.853   5.337  -2.875
  294   1HH1  ARG  43          1HH1      ARG  43   7.985   2.221  -1.811
  295   2HH1  ARG  43          2HH1      ARG  43   9.607   2.508  -2.338
  296   1HH2  ARG  43          1HH2      ARG  43   8.965   5.686  -3.550
  297   2HH2  ARG  43          2HH2      ARG  43  10.160   4.454  -3.316
  298    H    LYS  44           H        LYS  44   3.436   5.234   1.633
  299    HA   LYS  44           HA       LYS  44   4.358   7.419   3.178
  300   1HB   LYS  44          1HB       LYS  44   2.398   7.220   1.551
  301   2HB   LYS  44          2HB       LYS  44   1.486   6.510   2.883
  302   1HG   LYS  44          1HG       LYS  44   0.926   8.712   3.235
  303   2HG   LYS  44          2HG       LYS  44   2.436   8.684   4.147
  304   1HD   LYS  44          1HD       LYS  44   2.782   9.173   1.262
  305   2HD   LYS  44          2HD       LYS  44   1.881  10.436   2.102
  306   1HE   LYS  44          1HE       LYS  44   3.891  10.054   3.885
  307   2HE   LYS  44          2HE       LYS  44   4.737   9.652   2.378
  308   1HZ   LYS  44          1HZ       LYS  44   4.031  11.696   1.407
  309   2HZ   LYS  44          2HZ       LYS  44   4.701  12.078   2.922
  310   3HZ   LYS  44          3HZ       LYS  44   3.013  12.050   2.718
  311    H    ALA  45           H        ALA  45   2.764   4.429   4.172
  312    HA   ALA  45           HA       ALA  45   2.753   5.413   7.000
  313   1HB   ALA  45          1HB       ALA  45   1.058   3.590   7.289
  314   2HB   ALA  45          2HB       ALA  45   1.217   3.221   5.572
  315   3HB   ALA  45          3HB       ALA  45   0.575   4.782   6.082
  316    H    MET  46           H        MET  46   3.978   2.993   4.820
  317    HA   MET  46           HA       MET  46   5.531   1.243   5.128
  318   1HB   MET  46          1HB       MET  46   6.120   3.283   7.263
  319   2HB   MET  46          2HB       MET  46   7.070   1.799   7.176
  320   1HG   MET  46          1HG       MET  46   6.673   3.143   4.579
  321   2HG   MET  46          2HG       MET  46   7.617   4.074   5.743
  322   1HE   MET  46          1HE       MET  46  10.549   3.468   4.579
  323   2HE   MET  46          2HE       MET  46   9.025   4.073   3.935
  324   3HE   MET  46          3HE       MET  46   9.832   2.723   3.143
  325    H    LEU  47           H        LEU  47   5.313   1.804   8.612
  326    HA   LEU  47           HA       LEU  47   3.592  -0.623   8.898
  327   1HB   LEU  47          1HB       LEU  47   6.260  -0.803   9.023
  328   2HB   LEU  47          2HB       LEU  47   5.972  -0.256  10.673
  329    HG   LEU  47           HG       LEU  47   4.093  -2.341   9.866
  330   1HD1  LEU  47          1HD1      LEU  47   7.057  -2.992   9.911
  331   2HD1  LEU  47          2HD1      LEU  47   6.001  -3.095   8.503
  332   3HD1  LEU  47          3HD1      LEU  47   5.753  -4.179   9.871
  333   1HD2  LEU  47          1HD2      LEU  47   4.964  -1.342  12.192
  334   2HD2  LEU  47          2HD2      LEU  47   6.120  -2.664  12.035
  335   3HD2  LEU  47          3HD2      LEU  47   4.389  -3.004  12.057
  336    H    SER  48           H        SER  48   2.279   1.585   9.339
  337    HA   SER  48           HA       SER  48   1.180   2.925  10.948
  338   1HB   SER  48          1HB       SER  48   0.959   0.476  11.731
  339   2HB   SER  48          2HB       SER  48   2.226   0.861  12.895
  340    HG   SER  48           HG       SER  48  -0.094   2.442  12.616
  341    H    GLN  49           H        GLN  49   3.352   4.267  10.415
  342    HA   GLN  49           HA       GLN  49   4.781   4.728  13.015
  343   1HB   GLN  49          1HB       GLN  49   6.208   3.834  11.241
  344   2HB   GLN  49          2HB       GLN  49   5.651   5.084  10.129
  345   1HG   GLN  49          1HG       GLN  49   6.710   6.814  11.405
  346   2HG   GLN  49          2HG       GLN  49   7.019   5.720  12.753
  347   1HE2  GLN  49          1HE2      GLN  49   7.722   5.826   9.203
  348   2HE2  GLN  49          2HE2      GLN  49   9.316   5.265   9.359
  349    H    MET  50           H        MET  50   3.408   6.396  13.801
  350    HA   MET  50           HA       MET  50   3.846   9.050  12.746
  351   1HB   MET  50          1HB       MET  50   2.314   8.108  11.033
  352   2HB   MET  50          2HB       MET  50   1.132   7.762  12.296
  353   1HG   MET  50          1HG       MET  50   2.171  10.550  12.164
  354   2HG   MET  50          2HG       MET  50   1.090  10.046  10.865
  355   1HE   MET  50          1HE       MET  50  -1.716   9.970  11.294
  356   2HE   MET  50          2HE       MET  50  -1.999   8.767  12.550
  357   3HE   MET  50          3HE       MET  50  -0.757   8.483  11.332
  358   1H    GLY  51          1H        GLY  51 -12.245  -9.298  10.378
  359   2H    GLY  51          2H        GLY  51 -13.830  -9.621  10.900
  360   3H    GLY  51          3H        GLY  51 -12.529  -9.768  11.983
  361   1HA   GLY  51          1HA       GLY  51 -14.057  -7.651  11.982
  362   2HA   GLY  51          2HA       GLY  51 -12.325  -7.539  12.303
  363    H    THR  52           H        THR  52 -14.478  -7.706   9.441
  364    HA   THR  52           HA       THR  52 -14.372  -6.507   7.404
  365    HB   THR  52           HB       THR  52 -13.000  -4.357   9.009
  366    HG1  THR  52           HG1      THR  52 -14.602  -4.271  10.347
  367   1HG2  THR  52          1HG2      THR  52 -15.374  -4.229   7.139
  368   2HG2  THR  52          2HG2      THR  52 -13.706  -4.084   6.584
  369   3HG2  THR  52          3HG2      THR  52 -14.370  -2.892   7.700
  370    HA   PRO  53           HA       PRO  53  -9.720  -7.297   7.268
  371   1HB   PRO  53          1HB       PRO  53  -9.779  -9.641   5.855
  372   2HB   PRO  53          2HB       PRO  53  -9.806  -9.579   7.628
  373   1HG   PRO  53          1HG       PRO  53 -12.046  -9.981   5.704
  374   2HG   PRO  53          2HG       PRO  53 -11.752 -10.754   7.268
  375   1HD   PRO  53          1HD       PRO  53 -13.539  -8.722   6.894
  376   2HD   PRO  53          2HD       PRO  53 -12.714  -9.032   8.436
  377    HA   PRO  54           HA       PRO  54  -9.452  -5.824   3.130
  378   1HB   PRO  54          1HB       PRO  54  -7.279  -7.114   2.072
  379   2HB   PRO  54          2HB       PRO  54  -7.148  -5.816   3.274
  380   1HG   PRO  54          1HG       PRO  54  -7.024  -8.777   3.653
  381   2HG   PRO  54          2HG       PRO  54  -6.028  -7.508   4.382
  382   1HD   PRO  54          1HD       PRO  54  -8.073  -8.698   5.702
  383   2HD   PRO  54          2HD       PRO  54  -7.615  -7.001   5.977
  384    HA   PRO  55           HA       PRO  55 -11.379  -8.526   0.254
  385   1HB   PRO  55          1HB       PRO  55 -10.243  -7.856  -2.153
  386   2HB   PRO  55          2HB       PRO  55 -11.405  -6.820  -1.301
  387   1HG   PRO  55          1HG       PRO  55  -8.437  -6.638  -1.426
  388   2HG   PRO  55          2HG       PRO  55  -9.651  -5.350  -1.471
  389   1HD   PRO  55          1HD       PRO  55  -8.217  -5.972   0.755
  390   2HD   PRO  55          2HD       PRO  55  -9.859  -5.294   0.814
  391    HA   PRO  56           HA       PRO  56  -8.982 -12.108  -0.610
  392   1HB   PRO  56          1HB       PRO  56  -9.789 -12.919  -3.102
  393   2HB   PRO  56          2HB       PRO  56 -10.799 -13.093  -1.652
  394   1HG   PRO  56          1HG       PRO  56 -10.893 -11.006  -3.781
  395   2HG   PRO  56          2HG       PRO  56 -12.223 -11.846  -2.967
  396   1HD   PRO  56          1HD       PRO  56 -11.477  -9.335  -2.306
  397   2HD   PRO  56          2HD       PRO  56 -12.135 -10.479  -1.118
  398    H    TYR  57           H        TYR  57  -7.067 -12.823  -1.735
  399    HA   TYR  57           HA       TYR  57  -5.766 -10.667  -3.326
  400   1HB   TYR  57          1HB       TYR  57  -4.708 -11.520  -1.265
  401   2HB   TYR  57          2HB       TYR  57  -4.701 -13.148  -1.941
  402    HD1  TYR  57           HD1      TYR  57  -3.881  -9.772  -3.368
  403    HD2  TYR  57           HD2      TYR  57  -2.537 -13.764  -2.532
  404    HE1  TYR  57           HE1      TYR  57  -1.735  -9.286  -4.508
  405    HE2  TYR  57           HE2      TYR  57  -0.393 -13.279  -3.675
  406    HH   TYR  57           HH       TYR  57   0.522 -11.769  -5.292
  407    H    THR  58           H        THR  58  -4.559 -11.257  -5.259
  408    HA   THR  58           HA       THR  58  -4.906 -13.919  -6.447
  409    HB   THR  58           HB       THR  58  -6.233 -11.501  -7.710
  410    HG1  THR  58           HG1      THR  58  -7.576 -11.889  -6.109
  411   1HG2  THR  58          1HG2      THR  58  -5.774 -13.056  -9.409
  412   2HG2  THR  58          2HG2      THR  58  -7.419 -13.470  -8.924
  413   3HG2  THR  58          3HG2      THR  58  -6.060 -14.437  -8.349
  414    H    VAL  59           H        VAL  59  -3.991 -13.825  -8.797
  415    HA   VAL  59           HA       VAL  59  -1.772 -11.803  -8.901
  416    HB   VAL  59           HB       VAL  59  -1.057 -14.095  -8.330
  417   1HG1  VAL  59          1HG1      VAL  59  -3.035 -14.748 -10.326
  418   2HG1  VAL  59          2HG1      VAL  59  -2.204 -15.824  -9.203
  419   3HG1  VAL  59          3HG1      VAL  59  -1.485 -15.461 -10.772
  420   1HG2  VAL  59          1HG2      VAL  59   0.750 -14.093  -9.765
  421   2HG2  VAL  59          2HG2      VAL  59   0.110 -12.491 -10.130
  422   3HG2  VAL  59          3HG2      VAL  59  -0.253 -13.849 -11.195
  423    H    GLY  60           H        GLY  60  -4.068 -11.012 -10.131
  424   1HA   GLY  60          1HA       GLY  60  -3.500 -10.306 -12.697
  425   2HA   GLY  60          2HA       GLY  60  -4.122 -11.941 -12.919
  Start of MODEL   10
    1    H    PHE   5           H        PHE   5  -7.118  12.612   4.946
    2    HA   PHE   5           HA       PHE   5  -5.860  11.887   2.317
    3   1HB   PHE   5          1HB       PHE   5  -5.827  14.308   3.394
    4   2HB   PHE   5          2HB       PHE   5  -4.545  13.617   4.388
    5    HD1  PHE   5           HD1      PHE   5  -5.596  13.488   0.780
    6    HD2  PHE   5           HD2      PHE   5  -2.388  13.959   3.599
    7    HE1  PHE   5           HE1      PHE   5  -3.991  13.764  -1.092
    8    HE2  PHE   5           HE2      PHE   5  -0.784  14.235   1.728
    9    HZ   PHE   5           HZ       PHE   5  -1.586  14.137  -0.617
   10    H    GLU   6           H        GLU   6  -3.897  10.644   2.451
   11    HA   GLU   6           HA       GLU   6  -2.704   9.821   4.951
   12   1HB   GLU   6          1HB       GLU   6  -4.940   8.722   5.075
   13   2HB   GLU   6          2HB       GLU   6  -4.581   7.874   3.571
   14   1HG   GLU   6          1HG       GLU   6  -3.300   6.345   4.629
   15   2HG   GLU   6          2HG       GLU   6  -2.433   7.591   5.528
   16    H    ILE   7           H        ILE   7  -3.499   8.446   1.731
   17    HA   ILE   7           HA       ILE   7  -0.557   8.105   1.267
   18    HB   ILE   7           HB       ILE   7  -2.843   6.209   0.649
   19   1HG1  ILE   7          1HG1      ILE   7  -2.144   6.294   3.037
   20   2HG1  ILE   7          2HG1      ILE   7  -1.751   4.746   2.289
   21   1HG2  ILE   7          1HG2      ILE   7  -1.118   4.699  -0.197
   22   2HG2  ILE   7          2HG2      ILE   7   0.136   5.879   0.179
   23   3HG2  ILE   7          3HG2      ILE   7  -1.049   6.221  -1.082
   24   1HD1  ILE   7          1HD1      ILE   7   0.191   5.428   3.533
   25   2HD1  ILE   7          2HD1      ILE   7   0.133   7.051   2.847
   26   3HD1  ILE   7          3HD1      ILE   7   0.565   5.678   1.828
   27    HA   PRO   8           HA       PRO   8  -2.036  10.440  -2.314
   28   1HB   PRO   8          1HB       PRO   8   0.446  11.047  -3.297
   29   2HB   PRO   8          2HB       PRO   8  -0.315  11.944  -1.969
   30   1HG   PRO   8          1HG       PRO   8   1.768   9.812  -1.879
   31   2HG   PRO   8          2HG       PRO   8   1.623  11.288  -0.910
   32   1HD   PRO   8          1HD       PRO   8   0.923   8.819   0.004
   33   2HD   PRO   8          2HD       PRO   8   0.180  10.325   0.581
   34    H    ASP   9           H        ASP   9  -2.116   9.915  -4.577
   35    HA   ASP   9           HA       ASP   9  -1.269   7.143  -5.206
   36   1HB   ASP   9          1HB       ASP   9  -3.246   9.157  -6.149
   37   2HB   ASP   9          2HB       ASP   9  -2.648   8.028  -7.363
   38    H    ASP  10           H        ASP  10   0.951   8.834  -5.040
   39    HA   ASP  10           HA       ASP  10   1.667   9.272  -7.922
   40   1HB   ASP  10          1HB       ASP  10   3.105  11.086  -7.076
   41   2HB   ASP  10          2HB       ASP  10   1.442  11.325  -6.541
   42    H    VAL  11           H        VAL  11   2.704   8.039  -4.772
   43    HA   VAL  11           HA       VAL  11   5.410   7.431  -5.357
   44    HB   VAL  11           HB       VAL  11   5.115   5.860  -3.475
   45   1HG1  VAL  11          1HG1      VAL  11   3.466   7.728  -2.210
   46   2HG1  VAL  11          2HG1      VAL  11   4.247   8.636  -3.504
   47   3HG1  VAL  11          3HG1      VAL  11   5.227   7.787  -2.308
   48   1HG2  VAL  11          1HG2      VAL  11   2.931   4.938  -4.280
   49   2HG2  VAL  11          2HG2      VAL  11   2.158   6.443  -3.786
   50   3HG2  VAL  11          3HG2      VAL  11   2.901   5.395  -2.578
   51    HA   PRO  12           HA       PRO  12   4.853   4.113  -8.247
   52   1HB   PRO  12          1HB       PRO  12   7.397   3.121  -8.221
   53   2HB   PRO  12          2HB       PRO  12   6.957   4.634  -9.034
   54   1HG   PRO  12          1HG       PRO  12   8.339   4.199  -6.447
   55   2HG   PRO  12          2HG       PRO  12   8.538   5.496  -7.632
   56   1HD   PRO  12          1HD       PRO  12   7.116   5.682  -5.250
   57   2HD   PRO  12          2HD       PRO  12   6.963   6.785  -6.631
   58    H    LEU  13           H        LEU  13   5.124   3.701  -4.963
   59    HA   LEU  13           HA       LEU  13   4.799   1.855  -3.540
   60   1HB   LEU  13          1HB       LEU  13   3.683   1.155  -6.185
   61   2HB   LEU  13          2HB       LEU  13   4.073  -0.237  -5.181
   62    HG   LEU  13           HG       LEU  13   1.738   0.594  -4.849
   63   1HD1  LEU  13          1HD1      LEU  13   2.938  -0.609  -3.050
   64   2HD1  LEU  13          2HD1      LEU  13   1.825   0.588  -2.400
   65   3HD1  LEU  13          3HD1      LEU  13   3.545   0.928  -2.441
   66   1HD2  LEU  13          1HD2      LEU  13   2.804   2.934  -3.332
   67   2HD2  LEU  13          2HD2      LEU  13   1.253   2.737  -4.150
   68   3HD2  LEU  13          3HD2      LEU  13   2.710   3.069  -5.088
   69    HA   PRO  14           HA       PRO  14   8.575  -0.394  -3.927
   70   1HB   PRO  14          1HB       PRO  14   8.253  -2.165  -1.867
   71   2HB   PRO  14          2HB       PRO  14   8.620  -0.448  -1.633
   72   1HG   PRO  14          1HG       PRO  14   6.117  -1.905  -1.185
   73   2HG   PRO  14          2HG       PRO  14   6.666  -0.378  -0.501
   74   1HD   PRO  14          1HD       PRO  14   4.808  -0.781  -2.617
   75   2HD   PRO  14          2HD       PRO  14   5.410   0.761  -1.985
   76    H    ALA  15           H        ALA  15   9.353  -2.815  -4.021
   77    HA   ALA  15           HA       ALA  15   7.977  -4.129  -6.172
   78   1HB   ALA  15          1HB       ALA  15   9.881  -5.409  -6.174
   79   2HB   ALA  15          2HB       ALA  15   9.835  -5.658  -4.429
   80   3HB   ALA  15          3HB       ALA  15  10.462  -4.148  -5.088
   81    H    GLY  16           H        GLY  16   6.756  -6.083  -6.156
   82   1HA   GLY  16          1HA       GLY  16   5.162  -7.557  -5.332
   83   2HA   GLY  16          2HA       GLY  16   6.239  -7.748  -3.950
   84    H    TRP  17           H        TRP  17   4.660  -4.769  -5.004
   85    HA   TRP  17           HA       TRP  17   2.837  -4.909  -2.666
   86   1HB   TRP  17          1HB       TRP  17   5.156  -3.137  -3.133
   87   2HB   TRP  17          2HB       TRP  17   3.740  -2.409  -2.388
   88    HD1  TRP  17           HD1      TRP  17   6.794  -4.091  -1.430
   89    HE1  TRP  17           HE1      TRP  17   6.613  -5.095   0.943
   90    HE3  TRP  17           HE3      TRP  17   1.755  -3.932  -0.806
   91    HZ2  TRP  17           HZ2      TRP  17   4.571  -5.743   2.855
   92    HZ3  TRP  17           HZ3      TRP  17   0.698  -4.735   1.281
   93    HH2  TRP  17           HH2      TRP  17   2.101  -5.646   3.114
   94    H    GLU  18           H        GLU  18   1.560  -5.206  -4.839
   95    HA   GLU  18           HA       GLU  18   1.035  -2.791  -6.426
   96   1HB   GLU  18          1HB       GLU  18   0.763  -5.482  -6.780
   97   2HB   GLU  18          2HB       GLU  18  -0.894  -5.038  -6.361
   98   1HG   GLU  18          1HG       GLU  18  -1.216  -4.036  -8.358
   99   2HG   GLU  18          2HG       GLU  18   0.301  -3.145  -8.233
  100    H    MET  19           H        MET  19  -1.702  -2.841  -6.597
  101    HA   MET  19           HA       MET  19  -2.983  -2.759  -4.005
  102   1HB   MET  19          1HB       MET  19  -3.104  -0.375  -3.737
  103   2HB   MET  19          2HB       MET  19  -1.420  -0.835  -3.940
  104   1HG   MET  19          1HG       MET  19  -3.046  -0.025  -6.340
  105   2HG   MET  19          2HG       MET  19  -2.350   1.206  -5.294
  106   1HE   MET  19          1HE       MET  19  -0.226   1.912  -5.111
  107   2HE   MET  19          2HE       MET  19  -0.523   2.325  -6.798
  108   3HE   MET  19          3HE       MET  19   1.036   1.656  -6.323
  109    H    ALA  20           H        ALA  20  -5.201  -2.016  -4.116
  110    HA   ALA  20           HA       ALA  20  -6.400  -1.320  -6.678
  111   1HB   ALA  20          1HB       ALA  20  -6.466  -4.147  -5.585
  112   2HB   ALA  20          2HB       ALA  20  -5.789  -3.620  -7.125
  113   3HB   ALA  20          3HB       ALA  20  -7.533  -3.578  -6.869
  114    H    LYS  21           H        LYS  21  -8.724  -0.999  -6.436
  115    HA   LYS  21           HA       LYS  21  -9.534  -0.562  -3.616
  116   1HB   LYS  21          1HB       LYS  21 -11.329   0.752  -4.691
  117   2HB   LYS  21          2HB       LYS  21  -9.755   1.206  -5.342
  118   1HG   LYS  21          1HG       LYS  21 -10.585   0.771  -7.395
  119   2HG   LYS  21          2HG       LYS  21 -10.601  -0.935  -6.945
  120   1HD   LYS  21          1HD       LYS  21 -12.865  -0.898  -6.374
  121   2HD   LYS  21          2HD       LYS  21 -12.868   0.842  -6.088
  122   1HE   LYS  21          1HE       LYS  21 -12.425   1.110  -8.604
  123   2HE   LYS  21          2HE       LYS  21 -12.843  -0.608  -8.749
  124   1HZ   LYS  21          1HZ       LYS  21 -14.874  -0.046  -7.392
  125   2HZ   LYS  21          2HZ       LYS  21 -14.863   0.583  -8.971
  126   3HZ   LYS  21          3HZ       LYS  21 -14.510   1.590  -7.648
  127    H    THR  22           H        THR  22 -11.064  -1.847  -2.608
  128    HA   THR  22           HA       THR  22 -12.006  -4.252  -3.996
  129    HB   THR  22           HB       THR  22 -13.168  -4.428  -1.653
  130    HG1  THR  22           HG1      THR  22 -12.926  -2.501  -0.766
  131   1HG2  THR  22          1HG2      THR  22 -10.235  -4.403  -1.298
  132   2HG2  THR  22          2HG2      THR  22 -10.816  -5.327  -2.682
  133   3HG2  THR  22          3HG2      THR  22 -11.386  -5.717  -1.059
  134    H    SER  23           H        SER  23 -13.349  -3.092  -5.597
  135    HA   SER  23           HA       SER  23 -15.379  -2.166  -6.405
  136   1HB   SER  23          1HB       SER  23 -15.930  -4.188  -4.269
  137   2HB   SER  23          2HB       SER  23 -17.296  -3.302  -4.947
  138    HG   SER  23           HG       SER  23 -17.082  -4.350  -6.749
  139    H    SER  24           H        SER  24 -14.209  -0.190  -4.855
  140    HA   SER  24           HA       SER  24 -16.481   1.344  -3.954
  141   1HB   SER  24          1HB       SER  24 -15.662   1.321  -1.495
  142   2HB   SER  24          2HB       SER  24 -16.542  -0.095  -2.069
  143    HG   SER  24           HG       SER  24 -14.820  -1.065  -1.325
  144    H    GLY  25           H        GLY  25 -12.989   0.860  -3.327
  145   1HA   GLY  25          1HA       GLY  25 -11.773   2.887  -4.577
  146   2HA   GLY  25          2HA       GLY  25 -12.587   3.796  -3.308
  147    H    GLN  26           H        GLN  26 -12.177   1.194  -1.601
  148    HA   GLN  26           HA       GLN  26  -9.913   2.107  -0.128
  149   1HB   GLN  26          1HB       GLN  26 -11.169  -0.652  -0.322
  150   2HB   GLN  26          2HB       GLN  26 -10.179  -0.063   1.012
  151   1HG   GLN  26          1HG       GLN  26 -11.892   1.842   1.223
  152   2HG   GLN  26          2HG       GLN  26 -12.926   0.875   0.170
  153   1HE2  GLN  26          1HE2      GLN  26 -14.307  -0.488   1.304
  154   2HE2  GLN  26          2HE2      GLN  26 -13.998  -1.140   2.841
  155    H    ARG  27           H        ARG  27  -8.314   2.400  -1.887
  156    HA   ARG  27           HA       ARG  27  -7.328   0.276  -3.527
  157   1HB   ARG  27          1HB       ARG  27  -5.328   1.827  -3.681
  158   2HB   ARG  27          2HB       ARG  27  -6.873   2.600  -4.020
  159   1HG   ARG  27          1HG       ARG  27  -6.662   3.993  -2.259
  160   2HG   ARG  27          2HG       ARG  27  -6.247   2.661  -1.177
  161   1HD   ARG  27          1HD       ARG  27  -4.070   3.283  -1.222
  162   2HD   ARG  27          2HD       ARG  27  -4.047   3.131  -2.988
  163    HE   ARG  27           HE       ARG  27  -4.292   5.477  -3.098
  164   1HH1  ARG  27          1HH1      ARG  27  -5.461   4.276  -0.048
  165   2HH1  ARG  27          2HH1      ARG  27  -5.817   5.854   0.563
  166   1HH2  ARG  27          1HH2      ARG  27  -4.760   7.515  -2.283
  167   2HH2  ARG  27          2HH2      ARG  27  -5.424   7.676  -0.691
  168    H    TYR  28           H        TYR  28  -7.294  -1.460  -1.752
  169    HA   TYR  28           HA       TYR  28  -5.293  -1.274   0.339
  170   1HB   TYR  28          1HB       TYR  28  -5.816  -3.644   0.661
  171   2HB   TYR  28          2HB       TYR  28  -7.302  -2.734   0.412
  172    HD1  TYR  28           HD1      TYR  28  -4.958  -5.175  -1.080
  173    HD2  TYR  28           HD2      TYR  28  -8.604  -2.975  -1.621
  174    HE1  TYR  28           HE1      TYR  28  -5.613  -6.693  -2.922
  175    HE2  TYR  28           HE2      TYR  28  -9.244  -4.485  -3.469
  176    HH   TYR  28           HH       TYR  28  -8.710  -6.853  -4.178
  177    H    PHE  29           H        PHE  29  -3.140  -1.657   0.163
  178    HA   PHE  29           HA       PHE  29  -2.001  -2.137  -2.464
  179   1HB   PHE  29          1HB       PHE  29  -0.858  -1.861   0.330
  180   2HB   PHE  29          2HB       PHE  29   0.129  -1.927  -1.135
  181    HD1  PHE  29           HD1      PHE  29  -2.289   0.068   0.802
  182    HD2  PHE  29           HD2      PHE  29   0.058  -0.119  -2.787
  183    HE1  PHE  29           HE1      PHE  29  -2.740   2.468   0.380
  184    HE2  PHE  29           HE2      PHE  29  -0.388   2.279  -3.207
  185    HZ   PHE  29           HZ       PHE  29  -1.789   3.574  -1.627
  186    H    LYS  30           H        LYS  30  -1.886  -4.092  -3.321
  187    HA   LYS  30           HA       LYS  30  -2.083  -6.559  -1.823
  188   1HB   LYS  30          1HB       LYS  30  -1.522  -5.756  -4.676
  189   2HB   LYS  30          2HB       LYS  30  -1.655  -7.444  -4.185
  190   1HG   LYS  30          1HG       LYS  30  -3.848  -6.082  -3.060
  191   2HG   LYS  30          2HG       LYS  30  -3.725  -5.521  -4.717
  192   1HD   LYS  30          1HD       LYS  30  -3.268  -8.273  -4.895
  193   2HD   LYS  30          2HD       LYS  30  -4.573  -8.127  -3.717
  194   1HE   LYS  30          1HE       LYS  30  -5.883  -8.043  -5.611
  195   2HE   LYS  30          2HE       LYS  30  -5.399  -6.337  -5.616
  196   1HZ   LYS  30          1HZ       LYS  30  -3.425  -6.980  -6.908
  197   2HZ   LYS  30          2HZ       LYS  30  -4.863  -7.343  -7.737
  198   3HZ   LYS  30          3HZ       LYS  30  -3.986  -8.579  -6.970
  199    H    ASN  31           H        ASN  31  -0.428  -7.817  -1.142
  200    HA   ASN  31           HA       ASN  31   2.356  -6.896  -1.720
  201   1HB   ASN  31          1HB       ASN  31   1.274  -7.083   0.638
  202   2HB   ASN  31          2HB       ASN  31   1.466  -8.819   0.422
  203   1HD2  ASN  31          1HD2      ASN  31   3.037  -8.528   2.332
  204   2HD2  ASN  31          2HD2      ASN  31   4.636  -8.090   1.970
  205    H    HIS  32           H        HIS  32   3.154  -8.103  -3.469
  206    HA   HIS  32           HA       HIS  32   2.317 -10.926  -3.751
  207   1HB   HIS  32          1HB       HIS  32   4.305  -9.225  -5.293
  208   2HB   HIS  32          2HB       HIS  32   3.661 -10.779  -5.810
  209    HD1  HIS  32           HD1      HIS  32   1.076 -10.870  -6.375
  210    HD2  HIS  32           HD2      HIS  32   2.564  -7.032  -5.720
  211    HE1  HIS  32           HE1      HIS  32  -0.702  -9.260  -7.192
  212    H    ILE  33           H        ILE  33   4.412  -9.373  -1.734
  213    HA   ILE  33           HA       ILE  33   6.809 -10.988  -1.938
  214    HB   ILE  33           HB       ILE  33   5.596  -9.436   0.384
  215   1HG1  ILE  33          1HG1      ILE  33   5.752  -7.950  -1.537
  216   2HG1  ILE  33          2HG1      ILE  33   7.090  -7.582  -0.443
  217   1HG2  ILE  33          1HG2      ILE  33   7.790  -9.370   1.295
  218   2HG2  ILE  33          2HG2      ILE  33   8.516  -9.935  -0.210
  219   3HG2  ILE  33          3HG2      ILE  33   7.561 -11.041   0.779
  220   1HD1  ILE  33          1HD1      ILE  33   8.499  -9.209  -1.812
  221   2HD1  ILE  33          2HD1      ILE  33   8.060  -7.707  -2.627
  222   3HD1  ILE  33          3HD1      ILE  33   7.192  -9.198  -2.997
  223    H    ASP  34           H        ASP  34   3.972 -10.934   0.200
  224    HA   ASP  34           HA       ASP  34   4.535 -13.790   0.857
  225   1HB   ASP  34          1HB       ASP  34   4.596 -11.668   2.552
  226   2HB   ASP  34          2HB       ASP  34   2.895 -12.115   2.685
  227    H    GLN  35           H        GLN  35   2.700 -12.156  -1.158
  228    HA   GLN  35           HA       GLN  35   0.596 -12.494  -2.149
  229   1HB   GLN  35          1HB       GLN  35   1.533 -14.961  -0.992
  230   2HB   GLN  35          2HB       GLN  35  -0.224 -14.886  -0.857
  231   1HG   GLN  35          1HG       GLN  35  -0.515 -15.085  -3.100
  232   2HG   GLN  35          2HG       GLN  35   0.797 -13.961  -3.455
  233   1HE2  GLN  35          1HE2      GLN  35   0.990 -17.009  -1.566
  234   2HE2  GLN  35          2HE2      GLN  35   2.090 -17.769  -2.611
  235    H    THR  36           H        THR  36  -0.188 -10.616  -0.807
  236    HA   THR  36           HA       THR  36  -2.573 -11.381   0.702
  237    HB   THR  36           HB       THR  36  -1.042 -11.737   2.485
  238    HG1  THR  36           HG1      THR  36  -2.091 -10.497   3.790
  239   1HG2  THR  36          1HG2      THR  36   0.757 -10.234   3.072
  240   2HG2  THR  36          2HG2      THR  36   0.210  -9.047   1.890
  241   3HG2  THR  36          3HG2      THR  36   0.889 -10.581   1.348
  242    H    THR  37           H        THR  37  -3.443  -9.268   1.834
  243    HA   THR  37           HA       THR  37  -2.944  -6.904   0.047
  244    HB   THR  37           HB       THR  37  -5.477  -6.636   0.110
  245    HG1  THR  37           HG1      THR  37  -6.478  -8.768   0.620
  246   1HG2  THR  37          1HG2      THR  37  -4.102  -7.796  -1.726
  247   2HG2  THR  37          2HG2      THR  37  -5.827  -8.155  -1.672
  248   3HG2  THR  37          3HG2      THR  37  -4.668  -9.307  -1.021
  249    H    THR  38           H        THR  38  -2.700  -5.010   1.224
  250    HA   THR  38           HA       THR  38  -3.709  -5.003   4.050
  251    HB   THR  38           HB       THR  38  -1.234  -5.394   3.780
  252    HG1  THR  38           HG1      THR  38  -2.183  -3.028   4.998
  253   1HG2  THR  38          1HG2      THR  38  -1.146  -3.840   1.722
  254   2HG2  THR  38          2HG2      THR  38   0.187  -3.733   2.870
  255   3HG2  THR  38          3HG2      THR  38  -1.089  -2.515   2.884
  256    H    TRP  39           H        TRP  39  -4.520  -2.996   4.790
  257    HA   TRP  39           HA       TRP  39  -5.593  -1.196   2.821
  258   1HB   TRP  39          1HB       TRP  39  -5.267  -1.068   5.834
  259   2HB   TRP  39          2HB       TRP  39  -6.245   0.066   4.903
  260    HD1  TRP  39           HD1      TRP  39  -6.808  -2.741   6.955
  261    HE1  TRP  39           HE1      TRP  39  -8.877  -4.108   6.256
  262    HE3  TRP  39           HE3      TRP  39  -7.491  -0.955   2.218
  263    HZ2  TRP  39           HZ2      TRP  39 -10.592  -4.409   3.991
  264    HZ3  TRP  39           HZ3      TRP  39  -9.347  -1.805   0.813
  265    HH2  TRP  39           HH2      TRP  39 -10.897  -3.529   1.693
  266    H    GLN  40           H        GLN  40  -3.232  -0.561   5.446
  267    HA   GLN  40           HA       GLN  40  -2.404   2.004   4.660
  268   1HB   GLN  40          1HB       GLN  40  -0.323   1.385   5.911
  269   2HB   GLN  40          2HB       GLN  40  -1.794   0.912   6.760
  270   1HG   GLN  40          1HG       GLN  40  -1.330  -1.302   6.561
  271   2HG   GLN  40          2HG       GLN  40  -0.797  -1.129   4.889
  272   1HE2  GLN  40          1HE2      GLN  40   1.380   0.504   4.983
  273   2HE2  GLN  40          2HE2      GLN  40   2.579  -0.110   6.016
  274    H    ASP  41           H        ASP  41  -0.248   2.579   3.641
  275    HA   ASP  41           HA       ASP  41   0.170   0.928   1.190
  276   1HB   ASP  41          1HB       ASP  41  -0.489   3.318   1.013
  277   2HB   ASP  41          2HB       ASP  41   0.965   3.770   1.900
  278    HA   PRO  42           HA       PRO  42   4.104  -0.276   2.881
  279   1HB   PRO  42          1HB       PRO  42   5.224  -1.274   0.600
  280   2HB   PRO  42          2HB       PRO  42   3.975  -2.141   1.513
  281   1HG   PRO  42          1HG       PRO  42   3.732  -0.514  -0.969
  282   2HG   PRO  42          2HG       PRO  42   2.929  -2.025  -0.537
  283   1HD   PRO  42          1HD       PRO  42   1.735   0.427  -0.383
  284   2HD   PRO  42          2HD       PRO  42   1.277  -0.955   0.635
  285    H    ARG  43           H        ARG  43   6.354   0.445   2.734
  286    HA   ARG  43           HA       ARG  43   7.996   2.108   2.354
  287   1HB   ARG  43          1HB       ARG  43   7.965   0.891   0.209
  288   2HB   ARG  43          2HB       ARG  43   6.657   1.923  -0.365
  289   1HG   ARG  43          1HG       ARG  43   8.920   3.471   0.638
  290   2HG   ARG  43          2HG       ARG  43   9.379   2.404  -0.690
  291   1HD   ARG  43          1HD       ARG  43   8.034   3.510  -2.216
  292   2HD   ARG  43          2HD       ARG  43   6.841   3.967  -0.986
  293    HE   ARG  43           HE       ARG  43   9.207   5.278  -0.254
  294   1HH1  ARG  43          1HH1      ARG  43   7.099   5.197  -3.024
  295   2HH1  ARG  43          2HH1      ARG  43   7.452   6.827  -3.477
  296   1HH2  ARG  43          1HH2      ARG  43   9.649   7.392  -0.864
  297   2HH2  ARG  43          2HH2      ARG  43   8.884   8.064  -2.266
  298    H    LYS  44           H        LYS  44   5.098   2.911   3.071
  299    HA   LYS  44           HA       LYS  44   5.455   5.809   2.469
  300   1HB   LYS  44          1HB       LYS  44   3.597   4.022   1.237
  301   2HB   LYS  44          2HB       LYS  44   2.681   5.114   2.275
  302   1HG   LYS  44          1HG       LYS  44   4.802   6.118   0.369
  303   2HG   LYS  44          2HG       LYS  44   3.122   5.916  -0.126
  304   1HD   LYS  44          1HD       LYS  44   2.597   7.885   0.829
  305   2HD   LYS  44          2HD       LYS  44   3.153   7.281   2.390
  306   1HE   LYS  44          1HE       LYS  44   5.140   8.406   2.241
  307   2HE   LYS  44          2HE       LYS  44   5.319   8.044   0.514
  308   1HZ   LYS  44          1HZ       LYS  44   4.799  10.436   1.083
  309   2HZ   LYS  44          2HZ       LYS  44   3.259   9.906   1.566
  310   3HZ   LYS  44          3HZ       LYS  44   3.761   9.710  -0.045
  311    H    ALA  45           H        ALA  45   2.781   3.905   3.873
  312    HA   ALA  45           HA       ALA  45   2.525   5.685   6.146
  313   1HB   ALA  45          1HB       ALA  45   1.280   3.257   5.013
  314   2HB   ALA  45          2HB       ALA  45   0.520   4.672   5.742
  315   3HB   ALA  45          3HB       ALA  45   1.157   3.387   6.768
  316    H    MET  46           H        MET  46   5.039   5.278   6.571
  317    HA   MET  46           HA       MET  46   5.847   2.816   7.838
  318   1HB   MET  46          1HB       MET  46   7.796   4.192   8.492
  319   2HB   MET  46          2HB       MET  46   7.360   4.487   6.809
  320   1HG   MET  46          1HG       MET  46   6.288   6.554   7.351
  321   2HG   MET  46          2HG       MET  46   6.326   6.200   9.079
  322   1HE   MET  46          1HE       MET  46   9.912   6.986   6.355
  323   2HE   MET  46          2HE       MET  46   8.352   6.268   5.959
  324   3HE   MET  46          3HE       MET  46   9.558   5.317   6.822
  325    H    LEU  47           H        LEU  47   7.032   3.793  10.240
  326    HA   LEU  47           HA       LEU  47   4.889   3.463  12.117
  327   1HB   LEU  47          1HB       LEU  47   7.222   2.876  12.564
  328   2HB   LEU  47          2HB       LEU  47   7.708   4.561  12.374
  329    HG   LEU  47           HG       LEU  47   5.594   4.520  14.273
  330   1HD1  LEU  47          1HD1      LEU  47   7.681   2.885  15.526
  331   2HD1  LEU  47          2HD1      LEU  47   6.790   2.022  14.273
  332   3HD1  LEU  47          3HD1      LEU  47   5.927   2.739  15.632
  333   1HD2  LEU  47          1HD2      LEU  47   7.170   6.193  14.566
  334   2HD2  LEU  47          2HD2      LEU  47   8.525   5.121  14.209
  335   3HD2  LEU  47          3HD2      LEU  47   7.726   5.040  15.778
  336    H    SER  48           H        SER  48   3.400   5.198  11.268
  337    HA   SER  48           HA       SER  48   4.225   7.986  11.898
  338   1HB   SER  48          1HB       SER  48   1.676   6.878  10.679
  339   2HB   SER  48          2HB       SER  48   2.228   8.551  10.626
  340    HG   SER  48           HG       SER  48   2.677   6.908   8.798
  341    H    GLN  49           H        GLN  49   1.887   5.505  12.894
  342    HA   GLN  49           HA       GLN  49   0.633   7.300  14.873
  343   1HB   GLN  49          1HB       GLN  49  -0.748   5.278  15.286
  344   2HB   GLN  49          2HB       GLN  49  -0.656   5.652  13.564
  345   1HG   GLN  49          1HG       GLN  49   1.571   3.985  14.226
  346   2HG   GLN  49          2HG       GLN  49   0.117   3.239  14.888
  347   1HE2  GLN  49          1HE2      GLN  49  -1.846   3.792  13.054
  348   2HE2  GLN  49          2HE2      GLN  49  -1.436   3.197  11.519
  349    H    MET  50           H        MET  50   0.625   6.730  17.187
  350    HA   MET  50           HA       MET  50   2.802   4.913  18.096
  351   1HB   MET  50          1HB       MET  50   3.410   7.463  17.697
  352   2HB   MET  50          2HB       MET  50   2.601   7.677  19.249
  353   1HG   MET  50          1HG       MET  50   4.116   5.648  19.984
  354   2HG   MET  50          2HG       MET  50   5.106   6.149  18.612
  355   1HE   MET  50          1HE       MET  50   6.974   6.355  20.413
  356   2HE   MET  50          2HE       MET  50   7.433   8.030  20.712
  357   3HE   MET  50          3HE       MET  50   7.087   7.500  19.068
  358   1H    GLY  51          1H        GLY  51 -15.209  -3.796  12.669
  359   2H    GLY  51          2H        GLY  51 -13.982  -4.445  13.650
  360   3H    GLY  51          3H        GLY  51 -14.397  -5.205  12.189
  361   1HA   GLY  51          1HA       GLY  51 -13.439  -2.418  12.188
  362   2HA   GLY  51          2HA       GLY  51 -12.291  -3.756  12.262
  363    H    THR  52           H        THR  52 -11.471  -3.457  10.154
  364    HA   THR  52           HA       THR  52 -13.356  -4.259   7.973
  365    HB   THR  52           HB       THR  52 -11.247  -2.125   7.639
  366    HG1  THR  52           HG1      THR  52 -12.411  -1.014   8.990
  367   1HG2  THR  52          1HG2      THR  52 -12.219  -1.775   5.607
  368   2HG2  THR  52          2HG2      THR  52 -13.846  -2.061   6.224
  369   3HG2  THR  52          3HG2      THR  52 -12.801  -3.425   5.829
  370    HA   PRO  53           HA       PRO  53  -9.603  -6.847   7.764
  371   1HB   PRO  53          1HB       PRO  53 -10.848  -8.985   6.590
  372   2HB   PRO  53          2HB       PRO  53 -10.854  -8.704   8.342
  373   1HG   PRO  53          1HG       PRO  53 -12.967  -8.139   6.317
  374   2HG   PRO  53          2HG       PRO  53 -13.124  -8.755   7.968
  375   1HD   PRO  53          1HD       PRO  53 -13.607  -6.159   7.266
  376   2HD   PRO  53          2HD       PRO  53 -13.077  -6.656   8.887
  377    HA   PRO  54           HA       PRO  54  -8.755  -5.781   3.557
  378   1HB   PRO  54          1HB       PRO  54  -6.626  -7.440   3.089
  379   2HB   PRO  54          2HB       PRO  54  -6.510  -5.962   4.063
  380   1HG   PRO  54          1HG       PRO  54  -6.790  -8.803   4.944
  381   2HG   PRO  54          2HG       PRO  54  -5.769  -7.517   5.606
  382   1HD   PRO  54          1HD       PRO  54  -8.112  -8.266   6.748
  383   2HD   PRO  54          2HD       PRO  54  -7.497  -6.600   6.825
  384    HA   PRO  55           HA       PRO  55 -10.589  -8.783   0.923
  385   1HB   PRO  55          1HB       PRO  55  -9.099  -8.650  -1.375
  386   2HB   PRO  55          2HB       PRO  55 -10.235  -7.380  -0.878
  387   1HG   PRO  55          1HG       PRO  55  -7.275  -7.481  -0.600
  388   2HG   PRO  55          2HG       PRO  55  -8.319  -6.124  -1.035
  389   1HD   PRO  55          1HD       PRO  55  -7.258  -6.459   1.447
  390   2HD   PRO  55          2HD       PRO  55  -8.810  -5.641   1.156
  391    HA   PRO  56           HA       PRO  56  -8.317 -12.563   0.978
  392   1HB   PRO  56          1HB       PRO  56  -9.297 -13.935  -1.166
  393   2HB   PRO  56          2HB       PRO  56 -10.254 -13.606   0.289
  394   1HG   PRO  56          1HG       PRO  56 -10.399 -12.364  -2.379
  395   2HG   PRO  56          2HG       PRO  56 -11.656 -12.561  -1.152
  396   1HD   PRO  56          1HD       PRO  56 -10.208 -10.214  -1.717
  397   2HD   PRO  56          2HD       PRO  56 -11.281 -10.495  -0.333
  398    H    TYR  57           H        TYR  57  -7.340 -10.302  -1.109
  399    HA   TYR  57           HA       TYR  57  -5.521 -10.099  -2.596
  400   1HB   TYR  57          1HB       TYR  57  -4.454 -11.180  -0.616
  401   2HB   TYR  57          2HB       TYR  57  -4.817 -12.758  -1.309
  402    HD1  TYR  57           HD1      TYR  57  -3.337 -13.758  -2.828
  403    HD2  TYR  57           HD2      TYR  57  -3.066  -9.539  -2.083
  404    HE1  TYR  57           HE1      TYR  57  -1.275 -13.644  -4.194
  405    HE2  TYR  57           HE2      TYR  57  -1.006  -9.423  -3.447
  406    HH   TYR  57           HH       TYR  57   0.122 -12.195  -5.296
  407    H    THR  58           H        THR  58  -4.449 -11.215  -4.506
  408    HA   THR  58           HA       THR  58  -5.843 -13.566  -5.612
  409    HB   THR  58           HB       THR  58  -5.918 -11.095  -7.299
  410    HG1  THR  58           HG1      THR  58  -7.833 -10.454  -6.299
  411   1HG2  THR  58          1HG2      THR  58  -8.344 -12.457  -7.376
  412   2HG2  THR  58          2HG2      THR  58  -7.146 -13.734  -7.165
  413   3HG2  THR  58          3HG2      THR  58  -7.022 -12.624  -8.530
  414    H    VAL  59           H        VAL  59  -5.037 -12.770  -8.361
  415    HA   VAL  59           HA       VAL  59  -2.194 -12.197  -8.389
  416    HB   VAL  59           HB       VAL  59  -2.216 -14.425  -7.319
  417   1HG1  VAL  59          1HG1      VAL  59  -4.275 -14.880  -9.263
  418   2HG1  VAL  59          2HG1      VAL  59  -3.764 -15.934  -7.944
  419   3HG1  VAL  59          3HG1      VAL  59  -2.988 -16.056  -9.524
  420   1HG2  VAL  59          1HG2      VAL  59  -0.476 -15.280  -8.589
  421   2HG2  VAL  59          2HG2      VAL  59  -0.556 -13.646  -9.247
  422   3HG2  VAL  59          3HG2      VAL  59  -1.307 -14.984 -10.116
  423    H    GLY  60           H        GLY  60  -4.497 -11.316  -9.877
  424   1HA   GLY  60          1HA       GLY  60  -3.685 -11.048 -12.453
  425   2HA   GLY  60          2HA       GLY  60  -4.392 -12.664 -12.491
  Start of MODEL   11
    1    H    PHE   5           H        PHE   5  -4.884  12.918   3.857
    2    HA   PHE   5           HA       PHE   5  -2.366  11.966   5.188
    3   1HB   PHE   5          1HB       PHE   5  -4.709  10.645   5.139
    4   2HB   PHE   5          2HB       PHE   5  -4.078  10.130   3.574
    5    HD1  PHE   5           HD1      PHE   5  -3.183   7.981   3.762
    6    HD2  PHE   5           HD2      PHE   5  -2.428  10.852   6.867
    7    HE1  PHE   5           HE1      PHE   5  -1.687   6.361   4.895
    8    HE2  PHE   5           HE2      PHE   5  -0.931   9.232   8.000
    9    HZ   PHE   5           HZ       PHE   5  -0.561   6.987   7.015
   10    H    GLU   6           H        GLU   6  -0.606  11.821   3.826
   11    HA   GLU   6           HA       GLU   6  -1.105  12.154   0.885
   12   1HB   GLU   6          1HB       GLU   6   1.083  13.339   0.910
   13   2HB   GLU   6          2HB       GLU   6  -0.082  14.099   1.997
   14   1HG   GLU   6          1HG       GLU   6   1.124  13.577   3.847
   15   2HG   GLU   6          2HG       GLU   6   1.504  11.960   3.253
   16    H    ILE   7           H        ILE   7  -1.213   9.612   1.284
   17    HA   ILE   7           HA       ILE   7   1.070   8.081   1.904
   18    HB   ILE   7           HB       ILE   7  -1.433   7.777   0.281
   19   1HG1  ILE   7          1HG1      ILE   7  -1.416   7.553   2.729
   20   2HG1  ILE   7          2HG1      ILE   7  -1.862   6.036   1.950
   21   1HG2  ILE   7          1HG2      ILE   7   0.613   5.540   0.447
   22   2HG2  ILE   7          2HG2      ILE   7   0.391   6.531  -0.995
   23   3HG2  ILE   7          3HG2      ILE   7  -0.928   5.521  -0.409
   24   1HD1  ILE   7          1HD1      ILE   7   0.705   6.783   3.313
   25   2HD1  ILE   7          2HD1      ILE   7   0.713   5.543   2.061
   26   3HD1  ILE   7          3HD1      ILE   7  -0.272   5.329   3.506
   27    HA   PRO   8           HA       PRO   8   2.508   8.194  -2.633
   28   1HB   PRO   8          1HB       PRO   8   1.061   9.634  -4.464
   29   2HB   PRO   8          2HB       PRO   8   0.736   7.931  -4.099
   30   1HG   PRO   8          1HG       PRO   8  -0.661  10.385  -3.150
   31   2HG   PRO   8          2HG       PRO   8  -1.330   8.811  -3.607
   32   1HD   PRO   8          1HD       PRO   8  -0.975   9.610  -1.021
   33   2HD   PRO   8          2HD       PRO   8  -0.968   7.909  -1.538
   34    H    ASP   9           H        ASP   9   2.811  10.394  -4.420
   35    HA   ASP   9           HA       ASP   9   3.849  12.509  -4.573
   36   1HB   ASP   9          1HB       ASP   9   1.665  12.684  -2.777
   37   2HB   ASP   9          2HB       ASP   9   2.990  13.575  -2.025
   38    H    ASP  10           H        ASP  10   5.223  10.266  -3.257
   39    HA   ASP  10           HA       ASP  10   7.429  11.749  -2.066
   40   1HB   ASP  10          1HB       ASP  10   5.311  10.472  -0.430
   41   2HB   ASP  10          2HB       ASP  10   6.963  10.112   0.072
   42    H    VAL  11           H        VAL  11   6.490   8.482  -1.080
   43    HA   VAL  11           HA       VAL  11   8.817   7.426  -2.598
   44    HB   VAL  11           HB       VAL  11   8.478   5.501  -1.023
   45   1HG1  VAL  11          1HG1      VAL  11  10.044   7.244  -0.405
   46   2HG1  VAL  11          2HG1      VAL  11   9.130   6.787   1.034
   47   3HG1  VAL  11          3HG1      VAL  11   8.729   8.271   0.168
   48   1HG2  VAL  11          1HG2      VAL  11   6.776   6.913   0.834
   49   2HG2  VAL  11          2HG2      VAL  11   6.600   5.285   0.181
   50   3HG2  VAL  11          3HG2      VAL  11   5.945   6.662  -0.701
   51    HA   PRO  12           HA       PRO  12   5.901   5.586  -5.394
   52   1HB   PRO  12          1HB       PRO  12   7.581   3.801  -6.611
   53   2HB   PRO  12          2HB       PRO  12   7.600   5.539  -6.964
   54   1HG   PRO  12          1HG       PRO  12   9.405   3.932  -5.223
   55   2HG   PRO  12          2HG       PRO  12   9.793   5.267  -6.316
   56   1HD   PRO  12          1HD       PRO  12   9.582   5.541  -3.606
   57   2HD   PRO  12          2HD       PRO  12   9.267   6.861  -4.753
   58    H    LEU  13           H        LEU  13   5.591   3.040  -6.115
   59    HA   LEU  13           HA       LEU  13   4.948   1.657  -3.599
   60   1HB   LEU  13          1HB       LEU  13   3.520   1.914  -5.726
   61   2HB   LEU  13          2HB       LEU  13   4.590   0.724  -6.459
   62    HG   LEU  13           HG       LEU  13   4.004  -0.907  -4.717
   63   1HD1  LEU  13          1HD1      LEU  13   3.570   0.664  -2.859
   64   2HD1  LEU  13          2HD1      LEU  13   2.194  -0.393  -3.118
   65   3HD1  LEU  13          3HD1      LEU  13   2.146   1.269  -3.701
   66   1HD2  LEU  13          1HD2      LEU  13   2.016   0.372  -6.494
   67   2HD2  LEU  13          2HD2      LEU  13   1.329  -0.640  -5.224
   68   3HD2  LEU  13          3HD2      LEU  13   2.485  -1.323  -6.368
   69    HA   PRO  14           HA       PRO  14   8.623  -0.798  -3.908
   70   1HB   PRO  14          1HB       PRO  14   8.077  -2.586  -1.918
   71   2HB   PRO  14          2HB       PRO  14   8.584  -0.916  -1.619
   72   1HG   PRO  14          1HG       PRO  14   5.946  -2.162  -1.310
   73   2HG   PRO  14          2HG       PRO  14   6.610  -0.721  -0.540
   74   1HD   PRO  14          1HD       PRO  14   4.787  -0.838  -2.715
   75   2HD   PRO  14          2HD       PRO  14   5.540   0.609  -2.019
   76    H    ALA  15           H        ALA  15   9.274  -3.130  -4.261
   77    HA   ALA  15           HA       ALA  15   7.678  -4.346  -6.332
   78   1HB   ALA  15          1HB       ALA  15  10.175  -4.907  -4.788
   79   2HB   ALA  15          2HB       ALA  15   9.942  -4.781  -6.532
   80   3HB   ALA  15          3HB       ALA  15   9.455  -6.247  -5.682
   81    H    GLY  16           H        GLY  16   6.570  -6.417  -6.230
   82   1HA   GLY  16          1HA       GLY  16   5.118  -7.948  -5.235
   83   2HA   GLY  16          2HA       GLY  16   6.272  -8.005  -3.912
   84    H    TRP  17           H        TRP  17   4.787  -5.010  -4.869
   85    HA   TRP  17           HA       TRP  17   2.892  -5.161  -2.573
   86   1HB   TRP  17          1HB       TRP  17   5.295  -3.455  -2.985
   87   2HB   TRP  17          2HB       TRP  17   3.878  -2.668  -2.292
   88    HD1  TRP  17           HD1      TRP  17   6.836  -4.418  -1.231
   89    HE1  TRP  17           HE1      TRP  17   6.555  -5.410   1.141
   90    HE3  TRP  17           HE3      TRP  17   1.783  -4.118  -0.762
   91    HZ2  TRP  17           HZ2      TRP  17   4.435  -5.998   2.988
   92    HZ3  TRP  17           HZ3      TRP  17   0.643  -4.890   1.293
   93    HH2  TRP  17           HH2      TRP  17   1.963  -5.835   3.171
   94    H    GLU  18           H        GLU  18   1.652  -5.394  -4.780
   95    HA   GLU  18           HA       GLU  18   1.261  -2.957  -6.354
   96   1HB   GLU  18          1HB       GLU  18   0.859  -5.634  -6.712
   97   2HB   GLU  18          2HB       GLU  18  -0.781  -5.100  -6.332
   98   1HG   GLU  18          1HG       GLU  18  -1.006  -4.084  -8.333
   99   2HG   GLU  18          2HG       GLU  18   0.557  -3.279  -8.177
  100    H    MET  19           H        MET  19  -1.422  -2.800  -6.595
  101    HA   MET  19           HA       MET  19  -2.838  -2.703  -4.079
  102   1HB   MET  19          1HB       MET  19  -2.831  -0.281  -3.803
  103   2HB   MET  19          2HB       MET  19  -1.183  -0.897  -3.777
  104   1HG   MET  19          1HG       MET  19  -0.727  -0.112  -5.962
  105   2HG   MET  19          2HG       MET  19  -2.438   0.084  -6.340
  106   1HE   MET  19          1HE       MET  19   0.724   1.394  -5.040
  107   2HE   MET  19          2HE       MET  19   0.431   3.130  -4.978
  108   3HE   MET  19          3HE       MET  19   0.213   2.261  -6.495
  109    H    ALA  20           H        ALA  20  -5.008  -2.056  -4.360
  110    HA   ALA  20           HA       ALA  20  -5.902  -1.142  -7.016
  111   1HB   ALA  20          1HB       ALA  20  -7.006  -3.739  -6.033
  112   2HB   ALA  20          2HB       ALA  20  -5.385  -3.752  -6.727
  113   3HB   ALA  20          3HB       ALA  20  -6.752  -3.190  -7.689
  114    H    LYS  21           H        LYS  21  -8.395  -1.035  -6.986
  115    HA   LYS  21           HA       LYS  21  -9.238  -0.034  -4.322
  116   1HB   LYS  21          1HB       LYS  21  -9.967   0.343  -7.190
  117   2HB   LYS  21          2HB       LYS  21 -11.256   0.576  -6.010
  118   1HG   LYS  21          1HG       LYS  21  -9.695   2.114  -4.747
  119   2HG   LYS  21          2HG       LYS  21  -8.582   2.000  -6.110
  120   1HD   LYS  21          1HD       LYS  21 -10.746   2.644  -7.503
  121   2HD   LYS  21          2HD       LYS  21 -11.270   3.316  -5.959
  122   1HE   LYS  21          1HE       LYS  21 -10.123   5.117  -7.020
  123   2HE   LYS  21          2HE       LYS  21  -8.917   4.446  -5.906
  124   1HZ   LYS  21          1HZ       LYS  21  -9.209   3.950  -8.816
  125   2HZ   LYS  21          2HZ       LYS  21  -8.313   2.911  -7.814
  126   3HZ   LYS  21          3HZ       LYS  21  -7.850   4.536  -7.988
  127    H    THR  22           H        THR  22 -10.399  -1.372  -3.035
  128    HA   THR  22           HA       THR  22 -11.379  -3.945  -3.791
  129    HB   THR  22           HB       THR  22 -12.581  -2.407  -1.533
  130    HG1  THR  22           HG1      THR  22 -10.548  -2.729  -0.414
  131   1HG2  THR  22          1HG2      THR  22 -11.095  -4.907  -1.087
  132   2HG2  THR  22          2HG2      THR  22 -12.444  -5.054  -2.214
  133   3HG2  THR  22          3HG2      THR  22 -12.722  -4.460  -0.577
  134    H    SER  23           H        SER  23 -14.020  -3.716  -2.546
  135    HA   SER  23           HA       SER  23 -15.785  -3.682  -4.647
  136   1HB   SER  23          1HB       SER  23 -17.474  -2.989  -2.893
  137   2HB   SER  23          2HB       SER  23 -16.404  -4.302  -2.400
  138    HG   SER  23           HG       SER  23 -16.325  -2.900  -0.747
  139    H    SER  24           H        SER  24 -15.122  -0.745  -2.658
  140    HA   SER  24           HA       SER  24 -16.382   0.896  -4.807
  141   1HB   SER  24          1HB       SER  24 -15.588   1.360  -1.920
  142   2HB   SER  24          2HB       SER  24 -16.195   2.649  -2.959
  143    HG   SER  24           HG       SER  24 -17.810   1.533  -1.679
  144    H    GLY  25           H        GLY  25 -13.783   1.776  -2.564
  145   1HA   GLY  25          1HA       GLY  25 -11.788   1.915  -4.706
  146   2HA   GLY  25          2HA       GLY  25 -12.322   3.490  -4.127
  147    H    GLN  26           H        GLN  26 -12.248   0.799  -1.910
  148    HA   GLN  26           HA       GLN  26 -10.548   2.157  -0.047
  149   1HB   GLN  26          1HB       GLN  26 -11.469  -0.693  -0.459
  150   2HB   GLN  26          2HB       GLN  26 -10.440  -0.245   0.902
  151   1HG   GLN  26          1HG       GLN  26 -13.133   0.990   0.244
  152   2HG   GLN  26          2HG       GLN  26 -12.822  -0.169   1.534
  153   1HE2  GLN  26          1HE2      GLN  26 -12.727   3.190   0.705
  154   2HE2  GLN  26          2HE2      GLN  26 -11.997   3.743   2.134
  155    H    ARG  27           H        ARG  27  -8.728   2.792  -1.377
  156    HA   ARG  27           HA       ARG  27  -7.096   1.197  -2.979
  157   1HB   ARG  27          1HB       ARG  27  -7.062   3.740  -1.793
  158   2HB   ARG  27          2HB       ARG  27  -5.549   2.984  -1.295
  159   1HG   ARG  27          1HG       ARG  27  -5.462   2.243  -3.833
  160   2HG   ARG  27          2HG       ARG  27  -6.531   3.633  -4.052
  161   1HD   ARG  27          1HD       ARG  27  -4.368   4.380  -2.298
  162   2HD   ARG  27          2HD       ARG  27  -3.700   3.663  -3.773
  163    HE   ARG  27           HE       ARG  27  -4.635   5.453  -5.020
  164   1HH1  ARG  27          1HH1      ARG  27  -5.953   5.350  -1.797
  165   2HH1  ARG  27          2HH1      ARG  27  -6.779   6.857  -1.972
  166   1HH2  ARG  27          1HH2      ARG  27  -5.718   7.405  -5.217
  167   2HH2  ARG  27          2HH2      ARG  27  -6.649   8.013  -3.890
  168    H    TYR  28           H        TYR  28  -6.722  -0.909  -2.209
  169    HA   TYR  28           HA       TYR  28  -5.199  -1.107   0.361
  170   1HB   TYR  28          1HB       TYR  28  -6.019  -3.387   0.457
  171   2HB   TYR  28          2HB       TYR  28  -7.385  -2.324   0.138
  172    HD1  TYR  28           HD1      TYR  28  -5.225  -4.962  -1.209
  173    HD2  TYR  28           HD2      TYR  28  -8.403  -2.224  -2.114
  174    HE1  TYR  28           HE1      TYR  28  -5.820  -6.302  -3.203
  175    HE2  TYR  28           HE2      TYR  28  -8.984  -3.553  -4.115
  176    HH   TYR  28           HH       TYR  28  -8.702  -5.925  -4.893
  177    H    PHE  29           H        PHE  29  -3.103  -1.818   0.244
  178    HA   PHE  29           HA       PHE  29  -1.964  -2.180  -2.440
  179   1HB   PHE  29          1HB       PHE  29  -0.809  -2.013   0.357
  180   2HB   PHE  29          2HB       PHE  29   0.168  -2.089  -1.112
  181    HD1  PHE  29           HD1      PHE  29  -2.376  -0.089   0.717
  182    HD2  PHE  29           HD2      PHE  29   0.400  -0.165  -2.553
  183    HE1  PHE  29           HE1      PHE  29  -2.721   2.325   0.371
  184    HE2  PHE  29           HE2      PHE  29   0.065   2.256  -2.895
  185    HZ   PHE  29           HZ       PHE  29  -1.499   3.508  -1.433
  186    H    LYS  30           H        LYS  30  -1.820  -4.110  -3.333
  187    HA   LYS  30           HA       LYS  30  -2.191  -6.592  -1.863
  188   1HB   LYS  30          1HB       LYS  30  -1.564  -5.790  -4.703
  189   2HB   LYS  30          2HB       LYS  30  -1.820  -7.468  -4.228
  190   1HG   LYS  30          1HG       LYS  30  -3.932  -5.959  -3.115
  191   2HG   LYS  30          2HG       LYS  30  -3.744  -5.399  -4.766
  192   1HD   LYS  30          1HD       LYS  30  -3.479  -8.172  -4.961
  193   2HD   LYS  30          2HD       LYS  30  -4.786  -7.944  -3.797
  194   1HE   LYS  30          1HE       LYS  30  -5.361  -6.063  -5.768
  195   2HE   LYS  30          2HE       LYS  30  -4.783  -7.466  -6.687
  196   1HZ   LYS  30          1HZ       LYS  30  -7.047  -7.893  -6.274
  197   2HZ   LYS  30          2HZ       LYS  30  -6.951  -7.359  -4.664
  198   3HZ   LYS  30          3HZ       LYS  30  -6.222  -8.824  -5.121
  199    H    ASN  31           H        ASN  31  -0.595  -7.997  -1.262
  200    HA   ASN  31           HA       ASN  31   2.236  -7.165  -1.782
  201   1HB   ASN  31          1HB       ASN  31   1.053  -7.339   0.562
  202   2HB   ASN  31          2HB       ASN  31   1.320  -9.071   0.358
  203   1HD2  ASN  31          1HD2      ASN  31   2.840  -8.700   2.300
  204   2HD2  ASN  31          2HD2      ASN  31   4.426  -8.193   1.968
  205    H    HIS  32           H        HIS  32   3.188  -8.438  -3.361
  206    HA   HIS  32           HA       HIS  32   2.181 -11.217  -3.730
  207   1HB   HIS  32          1HB       HIS  32   4.191  -9.580  -5.308
  208   2HB   HIS  32          2HB       HIS  32   3.447 -11.089  -5.824
  209    HD1  HIS  32           HD1      HIS  32   0.910 -11.026  -6.460
  210    HD2  HIS  32           HD2      HIS  32   2.498  -7.291  -5.506
  211    HE1  HIS  32           HE1      HIS  32  -0.819  -9.308  -7.158
  212    H    ILE  33           H        ILE  33   4.957  -9.415  -2.585
  213    HA   ILE  33           HA       ILE  33   6.870 -11.564  -2.498
  214    HB   ILE  33           HB       ILE  33   7.845 -10.096  -0.623
  215   1HG1  ILE  33          1HG1      ILE  33   5.764  -8.073  -1.454
  216   2HG1  ILE  33          2HG1      ILE  33   5.452  -9.180  -0.118
  217   1HG2  ILE  33          1HG2      ILE  33   7.521  -9.569  -3.448
  218   2HG2  ILE  33          2HG2      ILE  33   8.929  -9.309  -2.418
  219   3HG2  ILE  33          3HG2      ILE  33   7.689  -8.062  -2.547
  220   1HD1  ILE  33          1HD1      ILE  33   7.528  -7.023  -0.348
  221   2HD1  ILE  33          2HD1      ILE  33   7.829  -8.408   0.701
  222   3HD1  ILE  33          3HD1      ILE  33   6.430  -7.372   0.988
  223    H    ASP  34           H        ASP  34   4.157 -10.622  -0.505
  224    HA   ASP  34           HA       ASP  34   4.688 -12.952   1.311
  225   1HB   ASP  34          1HB       ASP  34   4.711 -10.346   2.004
  226   2HB   ASP  34          2HB       ASP  34   2.982 -10.657   2.157
  227    H    GLN  35           H        GLN  35   2.633 -11.682  -1.082
  228    HA   GLN  35           HA       GLN  35   0.530 -12.361  -1.886
  229   1HB   GLN  35          1HB       GLN  35   1.853 -14.583  -0.640
  230   2HB   GLN  35          2HB       GLN  35   0.124 -14.707  -0.317
  231   1HG   GLN  35          1HG       GLN  35  -0.132 -14.141  -2.858
  232   2HG   GLN  35          2HG       GLN  35   1.552 -14.651  -2.966
  233   1HE2  GLN  35          1HE2      GLN  35  -0.914 -16.035  -4.029
  234   2HE2  GLN  35          2HE2      GLN  35  -0.893 -17.581  -3.329
  235    H    THR  36           H        THR  36  -0.349 -10.465  -0.615
  236    HA   THR  36           HA       THR  36  -2.620 -11.254   0.979
  237    HB   THR  36           HB       THR  36  -1.406  -9.790   2.969
  238    HG1  THR  36           HG1      THR  36   0.671 -10.230   3.038
  239   1HG2  THR  36          1HG2      THR  36  -0.799 -12.621   3.230
  240   2HG2  THR  36          2HG2      THR  36  -2.421 -12.361   2.591
  241   3HG2  THR  36          3HG2      THR  36  -1.953 -11.636   4.130
  242    H    THR  37           H        THR  37  -4.102  -9.602   0.872
  243    HA   THR  37           HA       THR  37  -3.247  -7.005  -0.281
  244    HB   THR  37           HB       THR  37  -5.661  -6.729  -0.633
  245    HG1  THR  37           HG1      THR  37  -7.091  -8.198   0.254
  246   1HG2  THR  37          1HG2      THR  37  -4.189  -8.496  -1.942
  247   2HG2  THR  37          2HG2      THR  37  -5.929  -8.403  -2.212
  248   3HG2  THR  37          3HG2      THR  37  -5.267  -9.650  -1.157
  249    H    THR  38           H        THR  38  -3.090  -5.153   0.998
  250    HA   THR  38           HA       THR  38  -4.302  -5.287   3.741
  251    HB   THR  38           HB       THR  38  -1.830  -5.719   3.648
  252    HG1  THR  38           HG1      THR  38  -2.619  -4.835   5.509
  253   1HG2  THR  38          1HG2      THR  38  -0.395  -3.675   3.207
  254   2HG2  THR  38          2HG2      THR  38  -1.825  -2.908   2.517
  255   3HG2  THR  38          3HG2      THR  38  -1.162  -4.363   1.779
  256    H    TRP  39           H        TRP  39  -4.820  -3.200   4.674
  257    HA   TRP  39           HA       TRP  39  -5.753  -1.239   2.715
  258   1HB   TRP  39          1HB       TRP  39  -5.780  -1.219   5.752
  259   2HB   TRP  39          2HB       TRP  39  -6.791  -0.237   4.694
  260    HD1  TRP  39           HD1      TRP  39  -6.263  -3.890   5.777
  261    HE1  TRP  39           HE1      TRP  39  -8.439  -5.189   5.335
  262    HE3  TRP  39           HE3      TRP  39  -8.971  -0.291   3.362
  263    HZ2  TRP  39           HZ2      TRP  39 -10.988  -4.766   4.123
  264    HZ3  TRP  39           HZ3      TRP  39 -11.271  -0.775   2.577
  265    HH2  TRP  39           HH2      TRP  39 -12.280  -3.009   2.953
  266    H    GLN  40           H        GLN  40  -3.409  -1.367   5.396
  267    HA   GLN  40           HA       GLN  40  -2.487   1.286   5.406
  268   1HB   GLN  40          1HB       GLN  40  -1.133  -1.391   5.814
  269   2HB   GLN  40          2HB       GLN  40  -0.310   0.136   6.136
  270   1HG   GLN  40          1HG       GLN  40  -2.946   0.148   7.329
  271   2HG   GLN  40          2HG       GLN  40  -2.036  -1.261   7.874
  272   1HE2  GLN  40          1HE2      GLN  40  -2.668   1.798   8.840
  273   2HE2  GLN  40          2HE2      GLN  40  -1.197   2.199   9.585
  274    H    ASP  41           H        ASP  41  -0.272   1.991   4.489
  275    HA   ASP  41           HA       ASP  41  -0.107   1.114   1.632
  276   1HB   ASP  41          1HB       ASP  41   0.692   3.704   2.990
  277   2HB   ASP  41          2HB       ASP  41   0.719   3.401   1.253
  278    HA   PRO  42           HA       PRO  42   3.951  -0.335   2.787
  279   1HB   PRO  42          1HB       PRO  42   4.853  -0.916   0.276
  280   2HB   PRO  42          2HB       PRO  42   3.727  -1.959   1.160
  281   1HG   PRO  42          1HG       PRO  42   3.189   0.020  -1.002
  282   2HG   PRO  42          2HG       PRO  42   2.463  -1.569  -0.724
  283   1HD   PRO  42          1HD       PRO  42   1.252   0.793  -0.070
  284   2HD   PRO  42          2HD       PRO  42   0.931  -0.741   0.764
  285    H    ARG  43           H        ARG  43   3.191   2.349   0.751
  286    HA   ARG  43           HA       ARG  43   5.912   3.233   0.216
  287   1HB   ARG  43          1HB       ARG  43   3.125   4.379   0.037
  288   2HB   ARG  43          2HB       ARG  43   4.536   5.370  -0.326
  289   1HG   ARG  43          1HG       ARG  43   4.763   4.411  -2.351
  290   2HG   ARG  43          2HG       ARG  43   4.744   2.797  -1.639
  291   1HD   ARG  43          1HD       ARG  43   2.493   2.512  -2.039
  292   2HD   ARG  43          2HD       ARG  43   2.126   4.225  -1.768
  293    HE   ARG  43           HE       ARG  43   2.792   3.035  -4.319
  294   1HH1  ARG  43          1HH1      ARG  43   3.247   5.873  -2.354
  295   2HH1  ARG  43          2HH1      ARG  43   3.495   6.910  -3.716
  296   1HH2  ARG  43          1HH2      ARG  43   3.117   4.402  -6.070
  297   2HH2  ARG  43          2HH2      ARG  43   3.422   6.086  -5.804
  298    H    LYS  44           H        LYS  44   3.460   5.170   1.898
  299    HA   LYS  44           HA       LYS  44   5.493   6.333   3.652
  300   1HB   LYS  44          1HB       LYS  44   3.306   7.299   2.514
  301   2HB   LYS  44          2HB       LYS  44   2.532   6.687   3.975
  302   1HG   LYS  44          1HG       LYS  44   3.119   8.784   4.734
  303   2HG   LYS  44          2HG       LYS  44   4.609   7.926   5.125
  304   1HD   LYS  44          1HD       LYS  44   5.156   8.588   2.571
  305   2HD   LYS  44          2HD       LYS  44   4.074   9.920   2.980
  306   1HE   LYS  44          1HE       LYS  44   5.590   9.991   5.186
  307   2HE   LYS  44          2HE       LYS  44   6.777   9.270   4.083
  308   1HZ   LYS  44          1HZ       LYS  44   5.119  11.597   3.301
  309   2HZ   LYS  44          2HZ       LYS  44   6.551  11.037   2.580
  310   3HZ   LYS  44          3HZ       LYS  44   6.602  11.801   4.096
  311    H    ALA  45           H        ALA  45   2.740   4.101   4.019
  312    HA   ALA  45           HA       ALA  45   3.115   3.881   6.924
  313   1HB   ALA  45          1HB       ALA  45   1.494   1.802   5.844
  314   2HB   ALA  45          2HB       ALA  45   1.165   3.259   4.906
  315   3HB   ALA  45          3HB       ALA  45   0.957   3.273   6.657
  316    H    MET  46           H        MET  46   5.487   3.204   6.580
  317    HA   MET  46           HA       MET  46   5.663   0.280   6.778
  318   1HB   MET  46          1HB       MET  46   5.640   0.608   4.361
  319   2HB   MET  46          2HB       MET  46   6.897   1.837   4.483
  320   1HG   MET  46          1HG       MET  46   8.551   0.288   4.665
  321   2HG   MET  46          2HG       MET  46   7.602  -0.727   5.750
  322   1HE   MET  46          1HE       MET  46   7.258  -3.054   5.065
  323   2HE   MET  46          2HE       MET  46   6.097  -3.381   3.781
  324   3HE   MET  46          3HE       MET  46   5.693  -2.229   5.052
  325    H    LEU  47           H        LEU  47   7.717  -0.368   7.662
  326    HA   LEU  47           HA       LEU  47   9.565  -0.047   9.106
  327   1HB   LEU  47          1HB       LEU  47  10.096   0.778   6.621
  328   2HB   LEU  47          2HB       LEU  47  10.281   2.329   7.439
  329    HG   LEU  47           HG       LEU  47  11.653   0.676   9.132
  330   1HD1  LEU  47          1HD1      LEU  47  11.220  -1.079   7.197
  331   2HD1  LEU  47          2HD1      LEU  47  12.786  -1.012   8.005
  332   3HD1  LEU  47          3HD1      LEU  47  12.573  -0.246   6.432
  333   1HD2  LEU  47          1HD2      LEU  47  13.674   1.476   7.574
  334   2HD2  LEU  47          2HD2      LEU  47  12.763   2.619   8.561
  335   3HD2  LEU  47          3HD2      LEU  47  12.396   2.450   6.845
  336    H    SER  48           H        SER  48   7.025   1.601   9.601
  337    HA   SER  48           HA       SER  48   8.054   3.199  11.786
  338   1HB   SER  48          1HB       SER  48   8.462   4.385   9.419
  339   2HB   SER  48          2HB       SER  48   6.790   4.890   9.669
  340    HG   SER  48           HG       SER  48   8.186   6.389  10.594
  341    H    GLN  49           H        GLN  49   5.349   2.998   9.444
  342    HA   GLN  49           HA       GLN  49   3.014   2.931   9.816
  343   1HB   GLN  49          1HB       GLN  49   4.051   0.890  11.028
  344   2HB   GLN  49          2HB       GLN  49   3.787   1.806  12.512
  345   1HG   GLN  49          1HG       GLN  49   1.463   1.746  12.292
  346   2HG   GLN  49          2HG       GLN  49   1.534   1.496  10.547
  347   1HE2  GLN  49          1HE2      GLN  49   1.368  -0.116  13.617
  348   2HE2  GLN  49          2HE2      GLN  49   1.492  -1.703  13.029
  349    H    MET  50           H        MET  50   1.302   3.573  11.627
  350    HA   MET  50           HA       MET  50   2.303   5.799  13.335
  351   1HB   MET  50          1HB       MET  50   0.820   5.975  10.810
  352   2HB   MET  50          2HB       MET  50   0.026   6.836  12.129
  353   1HG   MET  50          1HG       MET  50   2.317   7.867  12.635
  354   2HG   MET  50          2HG       MET  50   2.833   7.228  11.074
  355   1HE   MET  50          1HE       MET  50   3.163   9.799  11.957
  356   2HE   MET  50          2HE       MET  50   2.061  11.108  11.537
  357   3HE   MET  50          3HE       MET  50   3.085  10.393  10.293
  358   1H    GLY  51          1H        GLY  51 -16.299  -3.495  12.110
  359   2H    GLY  51          2H        GLY  51 -16.224  -5.132  11.655
  360   3H    GLY  51          3H        GLY  51 -17.374  -4.101  10.946
  361   1HA   GLY  51          1HA       GLY  51 -15.765  -2.928   9.731
  362   2HA   GLY  51          2HA       GLY  51 -14.461  -3.648  10.678
  363    H    THR  52           H        THR  52 -14.658  -3.792   7.813
  364    HA   THR  52           HA       THR  52 -15.250  -6.704   7.402
  365    HB   THR  52           HB       THR  52 -15.241  -5.800   4.932
  366    HG1  THR  52           HG1      THR  52 -15.880  -3.433   6.331
  367   1HG2  THR  52          1HG2      THR  52 -17.348  -5.292   7.031
  368   2HG2  THR  52          2HG2      THR  52 -17.280  -6.591   5.839
  369   3HG2  THR  52          3HG2      THR  52 -17.638  -4.942   5.327
  370    HA   PRO  53           HA       PRO  53 -10.907  -7.216   6.756
  371   1HB   PRO  53          1HB       PRO  53 -10.948  -9.545   5.321
  372   2HB   PRO  53          2HB       PRO  53 -11.242  -9.481   7.069
  373   1HG   PRO  53          1HG       PRO  53 -13.186  -9.691   4.819
  374   2HG   PRO  53          2HG       PRO  53 -13.205 -10.483   6.402
  375   1HD   PRO  53          1HD       PRO  53 -14.729  -8.301   5.776
  376   2HD   PRO  53          2HD       PRO  53 -14.190  -8.684   7.424
  377    HA   PRO  54           HA       PRO  54  -9.874  -5.757   2.733
  378   1HB   PRO  54          1HB       PRO  54  -7.681  -7.242   2.010
  379   2HB   PRO  54          2HB       PRO  54  -7.625  -5.955   3.230
  380   1HG   PRO  54          1HG       PRO  54  -7.835  -8.915   3.592
  381   2HG   PRO  54          2HG       PRO  54  -6.843  -7.743   4.475
  382   1HD   PRO  54          1HD       PRO  54  -9.157  -8.721   5.471
  383   2HD   PRO  54          2HD       PRO  54  -8.602  -7.065   5.807
  384    HA   PRO  55           HA       PRO  55 -11.542  -8.265  -0.465
  385   1HB   PRO  55          1HB       PRO  55  -9.910  -7.814  -2.629
  386   2HB   PRO  55          2HB       PRO  55 -11.069  -6.617  -2.016
  387   1HG   PRO  55          1HG       PRO  55  -8.131  -6.809  -1.569
  388   2HG   PRO  55          2HG       PRO  55  -9.135  -5.384  -1.872
  389   1HD   PRO  55          1HD       PRO  55  -8.255  -6.062   0.598
  390   2HD   PRO  55          2HD       PRO  55  -9.799  -5.226   0.326
  391    HA   PRO  56           HA       PRO  56  -9.449 -12.129  -0.636
  392   1HB   PRO  56          1HB       PRO  56 -10.354 -13.191  -2.992
  393   2HB   PRO  56          2HB       PRO  56 -11.366 -13.058  -1.540
  394   1HG   PRO  56          1HG       PRO  56 -11.279 -11.311  -3.952
  395   2HG   PRO  56          2HG       PRO  56 -12.673 -11.865  -3.009
  396   1HD   PRO  56          1HD       PRO  56 -11.610  -9.376  -2.762
  397   2HD   PRO  56          2HD       PRO  56 -12.429 -10.221  -1.431
  398    H    TYR  57           H        TYR  57  -7.245 -11.938  -0.950
  399    HA   TYR  57           HA       TYR  57  -5.881 -10.620  -3.016
  400   1HB   TYR  57          1HB       TYR  57  -4.986 -11.555  -0.858
  401   2HB   TYR  57          2HB       TYR  57  -5.042 -13.160  -1.585
  402    HD1  TYR  57           HD1      TYR  57  -3.204 -10.060  -1.322
  403    HD2  TYR  57           HD2      TYR  57  -3.718 -13.591  -3.710
  404    HE1  TYR  57           HE1      TYR  57  -1.021  -9.636  -2.415
  405    HE2  TYR  57           HE2      TYR  57  -1.533 -13.169  -4.802
  406    HH   TYR  57           HH       TYR  57   0.465 -11.992  -4.512
  407    H    THR  58           H        THR  58  -4.807 -11.448  -4.933
  408    HA   THR  58           HA       THR  58  -5.548 -14.117  -5.950
  409    HB   THR  58           HB       THR  58  -7.522 -12.739  -6.431
  410    HG1  THR  58           HG1      THR  58  -7.380 -13.951  -8.144
  411   1HG2  THR  58          1HG2      THR  58  -5.452 -10.872  -7.588
  412   2HG2  THR  58          2HG2      THR  58  -6.683 -10.522  -6.375
  413   3HG2  THR  58          3HG2      THR  58  -7.150 -10.782  -8.056
  414    H    VAL  59           H        VAL  59  -5.043 -13.224  -8.730
  415    HA   VAL  59           HA       VAL  59  -2.425 -11.945  -8.823
  416    HB   VAL  59           HB       VAL  59  -1.898 -14.139  -7.804
  417   1HG1  VAL  59          1HG1      VAL  59  -2.913 -16.031  -8.489
  418   2HG1  VAL  59          2HG1      VAL  59  -2.390 -15.765 -10.153
  419   3HG1  VAL  59          3HG1      VAL  59  -3.892 -15.044  -9.573
  420   1HG2  VAL  59          1HG2      VAL  59  -0.886 -14.556 -10.553
  421   2HG2  VAL  59          2HG2      VAL  59   0.005 -14.367  -9.043
  422   3HG2  VAL  59          3HG2      VAL  59  -0.606 -12.946  -9.891
  423    H    GLY  60           H        GLY  60  -5.102 -11.942 -10.202
  424   1HA   GLY  60          1HA       GLY  60  -4.478 -12.942 -12.907
  425   2HA   GLY  60          2HA       GLY  60  -5.995 -12.197 -12.405
  Start of MODEL   12
    1    H    PHE   5           H        PHE   5  -4.327   8.145   6.789
    2    HA   PHE   5           HA       PHE   5  -6.100  10.542   6.571
    3   1HB   PHE   5          1HB       PHE   5  -4.197  11.752   5.538
    4   2HB   PHE   5          2HB       PHE   5  -3.813  11.248   7.185
    5    HD1  PHE   5           HD1      PHE   5  -2.908  10.997   3.698
    6    HD2  PHE   5           HD2      PHE   5  -2.492   9.095   7.527
    7    HE1  PHE   5           HE1      PHE   5  -0.954   9.724   2.854
    8    HE2  PHE   5           HE2      PHE   5  -0.539   7.821   6.682
    9    HZ   PHE   5           HZ       PHE   5   0.230   8.136   4.346
   10    H    GLU   6           H        GLU   6  -5.226  11.245   3.963
   11    HA   GLU   6           HA       GLU   6  -6.374   8.984   2.407
   12   1HB   GLU   6          1HB       GLU   6  -6.133  11.946   2.198
   13   2HB   GLU   6          2HB       GLU   6  -6.165  11.051   0.678
   14   1HG   GLU   6          1HG       GLU   6  -8.257   9.961   1.326
   15   2HG   GLU   6          2HG       GLU   6  -8.213  10.763   2.896
   16    H    ILE   7           H        ILE   7  -4.395   7.670   2.388
   17    HA   ILE   7           HA       ILE   7  -1.818   8.491   1.606
   18    HB   ILE   7           HB       ILE   7  -3.396   5.943   1.129
   19   1HG1  ILE   7          1HG1      ILE   7  -1.383   6.813   3.228
   20   2HG1  ILE   7          2HG1      ILE   7  -3.107   6.537   3.478
   21   1HG2  ILE   7          1HG2      ILE   7  -1.343   6.280  -0.396
   22   2HG2  ILE   7          2HG2      ILE   7  -1.366   4.819   0.588
   23   3HG2  ILE   7          3HG2      ILE   7  -0.381   6.194   1.080
   24   1HD1  ILE   7          1HD1      ILE   7  -0.893   4.587   3.244
   25   2HD1  ILE   7          2HD1      ILE   7  -2.367   4.155   2.375
   26   3HD1  ILE   7          3HD1      ILE   7  -2.422   4.456   4.113
   27    HA   PRO   8           HA       PRO   8  -2.337   9.661  -2.619
   28   1HB   PRO   8          1HB       PRO   8   0.227   9.277  -3.504
   29   2HB   PRO   8          2HB       PRO   8  -0.251  10.649  -2.487
   30   1HG   PRO   8          1HG       PRO   8   1.088   8.092  -1.726
   31   2HG   PRO   8          2HG       PRO   8   1.400   9.738  -1.154
   32   1HD   PRO   8          1HD       PRO   8  -0.021   7.923   0.281
   33   2HD   PRO   8          2HD       PRO   8  -0.303   9.674   0.379
   34    H    ASP   9           H        ASP   9  -2.046   8.696  -4.855
   35    HA   ASP   9           HA       ASP   9  -1.841   5.704  -4.774
   36   1HB   ASP   9          1HB       ASP   9  -4.184   6.824  -4.838
   37   2HB   ASP   9          2HB       ASP   9  -3.778   7.249  -6.500
   38    H    ASP  10           H        ASP  10  -0.069   8.081  -5.725
   39    HA   ASP  10           HA       ASP  10   0.167   7.322  -8.609
   40   1HB   ASP  10          1HB       ASP  10  -0.153   9.733  -7.696
   41   2HB   ASP  10          2HB       ASP  10   1.533   9.611  -7.191
   42    H    VAL  11           H        VAL  11   1.749   7.108  -5.516
   43    HA   VAL  11           HA       VAL  11   4.467   6.842  -6.288
   44    HB   VAL  11           HB       VAL  11   4.580   5.598  -4.117
   45   1HG1  VAL  11          1HG1      VAL  11   2.862   8.087  -4.233
   46   2HG1  VAL  11          2HG1      VAL  11   4.611   8.012  -4.029
   47   3HG1  VAL  11          3HG1      VAL  11   3.549   7.445  -2.742
   48   1HG2  VAL  11          1HG2      VAL  11   2.779   4.513  -3.316
   49   2HG2  VAL  11          2HG2      VAL  11   1.913   4.960  -4.787
   50   3HG2  VAL  11          3HG2      VAL  11   1.822   5.995  -3.361
   51    HA   PRO  12           HA       PRO  12   4.359   2.946  -8.389
   52   1HB   PRO  12          1HB       PRO  12   7.013   2.309  -8.243
   53   2HB   PRO  12          2HB       PRO  12   6.375   3.546  -9.341
   54   1HG   PRO  12          1HG       PRO  12   7.774   3.854  -6.735
   55   2HG   PRO  12          2HG       PRO  12   7.869   4.853  -8.191
   56   1HD   PRO  12          1HD       PRO  12   6.411   5.496  -5.944
   57   2HD   PRO  12          2HD       PRO  12   6.085   6.127  -7.570
   58    H    LEU  13           H        LEU  13   4.864   3.301  -5.085
   59    HA   LEU  13           HA       LEU  13   4.841   1.777  -3.290
   60   1HB   LEU  13          1HB       LEU  13   3.253   0.792  -5.424
   61   2HB   LEU  13          2HB       LEU  13   4.146  -0.590  -4.786
   62    HG   LEU  13           HG       LEU  13   3.440   0.518  -2.457
   63   1HD1  LEU  13          1HD1      LEU  13   1.685   1.946  -2.519
   64   2HD1  LEU  13          2HD1      LEU  13   0.893   1.054  -3.815
   65   3HD1  LEU  13          3HD1      LEU  13   2.168   2.210  -4.195
   66   1HD2  LEU  13          1HD2      LEU  13   2.826  -1.751  -3.634
   67   2HD2  LEU  13          2HD2      LEU  13   1.279  -0.961  -3.921
   68   3HD2  LEU  13          3HD2      LEU  13   1.864  -1.189  -2.273
   69    HA   PRO  14           HA       PRO  14   8.577  -0.553  -3.531
   70   1HB   PRO  14          1HB       PRO  14   8.209  -2.451  -1.600
   71   2HB   PRO  14          2HB       PRO  14   8.493  -0.738  -1.248
   72   1HG   PRO  14          1HG       PRO  14   6.018  -2.309  -1.063
   73   2HG   PRO  14          2HG       PRO  14   6.480  -0.834  -0.218
   74   1HD   PRO  14          1HD       PRO  14   4.738  -1.082  -2.437
   75   2HD   PRO  14          2HD       PRO  14   5.322   0.417  -1.693
   76    H    ALA  15           H        ALA  15   9.479  -2.905  -3.737
   77    HA   ALA  15           HA       ALA  15   8.170  -4.197  -5.980
   78   1HB   ALA  15          1HB       ALA  15  10.453  -5.057  -4.170
   79   2HB   ALA  15          2HB       ALA  15  10.617  -4.069  -5.622
   80   3HB   ALA  15          3HB       ALA  15  10.088  -5.746  -5.752
   81    H    GLY  16           H        GLY  16   7.112  -6.268  -5.988
   82   1HA   GLY  16          1HA       GLY  16   5.868  -8.029  -5.104
   83   2HA   GLY  16          2HA       GLY  16   6.855  -7.904  -3.655
   84    H    TRP  17           H        TRP  17   5.235  -5.095  -4.860
   85    HA   TRP  17           HA       TRP  17   3.063  -5.397  -2.851
   86   1HB   TRP  17          1HB       TRP  17   5.281  -3.377  -3.011
   87   2HB   TRP  17          2HB       TRP  17   3.721  -2.879  -2.375
   88    HD1  TRP  17           HD1      TRP  17   6.863  -4.530  -1.333
   89    HE1  TRP  17           HE1      TRP  17   6.586  -5.527   1.035
   90    HE3  TRP  17           HE3      TRP  17   1.813  -4.230  -0.850
   91    HZ2  TRP  17           HZ2      TRP  17   4.471  -6.115   2.891
   92    HZ3  TRP  17           HZ3      TRP  17   0.675  -5.000   1.205
   93    HH2  TRP  17           HH2      TRP  17   1.998  -5.946   3.080
   94    H    GLU  18           H        GLU  18   1.250  -5.117  -4.054
   95    HA   GLU  18           HA       GLU  18   1.227  -3.004  -6.192
   96   1HB   GLU  18          1HB       GLU  18   0.908  -5.705  -6.490
   97   2HB   GLU  18          2HB       GLU  18  -0.761  -5.196  -6.237
   98   1HG   GLU  18          1HG       GLU  18  -0.867  -4.121  -8.233
   99   2HG   GLU  18          2HG       GLU  18   0.765  -3.471  -8.076
  100    H    MET  19           H        MET  19  -1.496  -2.958  -6.540
  101    HA   MET  19           HA       MET  19  -2.916  -2.776  -4.026
  102   1HB   MET  19          1HB       MET  19  -2.921  -0.414  -3.752
  103   2HB   MET  19          2HB       MET  19  -1.249  -0.909  -3.955
  104   1HG   MET  19          1HG       MET  19  -2.911   0.029  -6.301
  105   2HG   MET  19          2HG       MET  19  -2.034   1.163  -5.282
  106   1HE   MET  19          1HE       MET  19   1.334   1.103  -5.839
  107   2HE   MET  19          2HE       MET  19  -0.193   1.837  -5.356
  108   3HE   MET  19          3HE       MET  19   0.349   1.964  -7.028
  109    H    ALA  20           H        ALA  20  -5.086  -2.156  -4.265
  110    HA   ALA  20           HA       ALA  20  -6.139  -1.401  -6.893
  111   1HB   ALA  20          1HB       ALA  20  -6.124  -4.198  -5.776
  112   2HB   ALA  20          2HB       ALA  20  -5.732  -3.663  -7.409
  113   3HB   ALA  20          3HB       ALA  20  -7.411  -3.692  -6.870
  114    H    LYS  21           H        LYS  21  -8.278  -0.636  -6.653
  115    HA   LYS  21           HA       LYS  21  -9.201  -0.190  -3.919
  116   1HB   LYS  21          1HB       LYS  21 -11.012   1.028  -5.134
  117   2HB   LYS  21          2HB       LYS  21  -9.407   1.488  -5.701
  118   1HG   LYS  21          1HG       LYS  21  -9.651   0.362  -7.720
  119   2HG   LYS  21          2HG       LYS  21 -10.821  -0.781  -7.059
  120   1HD   LYS  21          1HD       LYS  21 -12.486   1.067  -6.899
  121   2HD   LYS  21          2HD       LYS  21 -11.319   2.152  -7.653
  122   1HE   LYS  21          1HE       LYS  21 -11.382   0.954  -9.717
  123   2HE   LYS  21          2HE       LYS  21 -12.187  -0.439  -8.968
  124   1HZ   LYS  21          1HZ       LYS  21 -13.300   2.312  -9.219
  125   2HZ   LYS  21          2HZ       LYS  21 -14.064   1.018  -8.426
  126   3HZ   LYS  21          3HZ       LYS  21 -13.803   0.956 -10.105
  127    H    THR  22           H        THR  22 -11.345  -0.862  -3.157
  128    HA   THR  22           HA       THR  22 -12.016  -3.610  -4.055
  129    HB   THR  22           HB       THR  22 -13.173  -3.715  -1.923
  130    HG1  THR  22           HG1      THR  22 -13.942  -1.978  -1.061
  131   1HG2  THR  22          1HG2      THR  22 -10.602  -2.146  -1.598
  132   2HG2  THR  22          2HG2      THR  22 -10.698  -3.882  -1.887
  133   3HG2  THR  22          3HG2      THR  22 -11.339  -3.201  -0.392
  134    H    SER  23           H        SER  23 -14.722  -3.476  -3.082
  135    HA   SER  23           HA       SER  23 -16.198  -2.940  -5.403
  136   1HB   SER  23          1HB       SER  23 -16.633  -3.506  -2.585
  137   2HB   SER  23          2HB       SER  23 -17.901  -2.462  -3.227
  138    HG   SER  23           HG       SER  23 -17.081  -5.007  -4.132
  139    H    SER  24           H        SER  24 -14.988  -0.632  -3.058
  140    HA   SER  24           HA       SER  24 -16.648   1.497  -4.372
  141   1HB   SER  24          1HB       SER  24 -15.713   0.974  -1.569
  142   2HB   SER  24          2HB       SER  24 -16.001   2.640  -2.075
  143    HG   SER  24           HG       SER  24 -17.862   0.531  -2.401
  144    H    GLY  25           H        GLY  25 -13.834   1.852  -2.251
  145   1HA   GLY  25          1HA       GLY  25 -12.047   2.535  -4.472
  146   2HA   GLY  25          2HA       GLY  25 -12.554   3.924  -3.514
  147    H    GLN  26           H        GLN  26 -12.231   0.839  -1.932
  148    HA   GLN  26           HA       GLN  26 -10.211   1.917  -0.129
  149   1HB   GLN  26          1HB       GLN  26 -11.510  -0.792  -0.542
  150   2HB   GLN  26          2HB       GLN  26 -10.376  -0.459   0.766
  151   1HG   GLN  26          1HG       GLN  26 -11.829   1.092   1.790
  152   2HG   GLN  26          2HG       GLN  26 -12.786   1.298   0.323
  153   1HE2  GLN  26          1HE2      GLN  26 -14.358   0.718   2.421
  154   2HE2  GLN  26          2HE2      GLN  26 -14.822  -0.914   2.456
  155    H    ARG  27           H        ARG  27  -8.569   2.359  -1.874
  156    HA   ARG  27           HA       ARG  27  -7.375   0.367  -3.510
  157   1HB   ARG  27          1HB       ARG  27  -5.433   1.973  -3.456
  158   2HB   ARG  27          2HB       ARG  27  -6.976   2.754  -3.785
  159   1HG   ARG  27          1HG       ARG  27  -6.890   3.955  -1.869
  160   2HG   ARG  27          2HG       ARG  27  -6.402   2.548  -0.922
  161   1HD   ARG  27          1HD       ARG  27  -4.248   3.246  -0.923
  162   2HD   ARG  27          2HD       ARG  27  -4.252   3.357  -2.693
  163    HE   ARG  27           HE       ARG  27  -4.692   5.570  -0.846
  164   1HH1  ARG  27          1HH1      ARG  27  -5.471   4.272  -3.980
  165   2HH1  ARG  27          2HH1      ARG  27  -5.845   5.821  -4.650
  166   1HH2  ARG  27          1HH2      ARG  27  -5.179   7.569  -1.739
  167   2HH2  ARG  27          2HH2      ARG  27  -5.679   7.676  -3.394
  168    H    TYR  28           H        TYR  28  -7.252  -1.540  -2.060
  169    HA   TYR  28           HA       TYR  28  -5.449  -1.396   0.252
  170   1HB   TYR  28          1HB       TYR  28  -5.968  -3.800   0.417
  171   2HB   TYR  28          2HB       TYR  28  -7.436  -2.851   0.216
  172    HD1  TYR  28           HD1      TYR  28  -5.049  -5.129  -1.504
  173    HD2  TYR  28           HD2      TYR  28  -8.786  -3.033  -1.750
  174    HE1  TYR  28           HE1      TYR  28  -5.713  -6.514  -3.443
  175    HE2  TYR  28           HE2      TYR  28  -9.437  -4.409  -3.695
  176    HH   TYR  28           HH       TYR  28  -8.460  -7.080  -4.464
  177    H    PHE  29           H        PHE  29  -3.296  -1.735   0.162
  178    HA   PHE  29           HA       PHE  29  -2.017  -2.188  -2.409
  179   1HB   PHE  29          1HB       PHE  29  -1.029  -1.931   0.448
  180   2HB   PHE  29          2HB       PHE  29   0.036  -1.986  -0.960
  181    HD1  PHE  29           HD1      PHE  29  -2.380   0.022   0.932
  182    HD2  PHE  29           HD2      PHE  29  -0.039  -0.185  -2.658
  183    HE1  PHE  29           HE1      PHE  29  -2.784   2.432   0.525
  184    HE2  PHE  29           HE2      PHE  29  -0.445   2.225  -3.066
  185    HZ   PHE  29           HZ       PHE  29  -1.816   3.534  -1.474
  186    H    LYS  30           H        LYS  30  -1.935  -4.159  -3.249
  187    HA   LYS  30           HA       LYS  30  -2.189  -6.622  -1.767
  188   1HB   LYS  30          1HB       LYS  30  -1.394  -5.818  -4.563
  189   2HB   LYS  30          2HB       LYS  30  -1.586  -7.503  -4.093
  190   1HG   LYS  30          1HG       LYS  30  -3.861  -6.099  -3.178
  191   2HG   LYS  30          2HG       LYS  30  -3.579  -5.558  -4.827
  192   1HD   LYS  30          1HD       LYS  30  -3.142  -8.300  -4.969
  193   2HD   LYS  30          2HD       LYS  30  -4.506  -8.166  -3.858
  194   1HE   LYS  30          1HE       LYS  30  -5.751  -8.036  -5.782
  195   2HE   LYS  30          2HE       LYS  30  -5.195  -6.352  -5.821
  196   1HZ   LYS  30          1HZ       LYS  30  -3.325  -6.969  -7.133
  197   2HZ   LYS  30          2HZ       LYS  30  -4.683  -7.669  -7.876
  198   3HZ   LYS  30          3HZ       LYS  30  -3.638  -8.624  -6.937
  199    H    ASN  31           H        ASN  31  -0.456  -8.288  -1.752
  200    HA   ASN  31           HA       ASN  31   2.307  -7.137  -1.827
  201   1HB   ASN  31          1HB       ASN  31   1.117  -7.333   0.464
  202   2HB   ASN  31          2HB       ASN  31   1.294  -9.076   0.260
  203   1HD2  ASN  31          1HD2      ASN  31   2.771  -8.775   2.257
  204   2HD2  ASN  31          2HD2      ASN  31   4.392  -8.362   1.968
  205    H    HIS  32           H        HIS  32   3.403  -8.350  -3.376
  206    HA   HIS  32           HA       HIS  32   2.502 -11.141  -3.844
  207   1HB   HIS  32          1HB       HIS  32   4.490  -9.332  -5.255
  208   2HB   HIS  32          2HB       HIS  32   3.942 -10.898  -5.850
  209    HD1  HIS  32           HD1      HIS  32   1.266 -11.087  -6.263
  210    HD2  HIS  32           HD2      HIS  32   2.751  -7.211  -5.857
  211    HE1  HIS  32           HE1      HIS  32  -0.563  -9.524  -7.063
  212    H    ILE  33           H        ILE  33   5.129  -9.361  -2.364
  213    HA   ILE  33           HA       ILE  33   7.064 -11.526  -2.308
  214    HB   ILE  33           HB       ILE  33   7.931 -10.152  -0.288
  215   1HG1  ILE  33          1HG1      ILE  33   6.016  -8.032  -1.272
  216   2HG1  ILE  33          2HG1      ILE  33   5.563  -9.131   0.032
  217   1HG2  ILE  33          1HG2      ILE  33   9.212  -9.444  -1.979
  218   2HG2  ILE  33          2HG2      ILE  33   8.094  -8.092  -2.152
  219   3HG2  ILE  33          3HG2      ILE  33   7.875  -9.547  -3.124
  220   1HD1  ILE  33          1HD1      ILE  33   8.001  -8.422   0.919
  221   2HD1  ILE  33          2HD1      ILE  33   6.552  -7.496   1.310
  222   3HD1  ILE  33          3HD1      ILE  33   7.610  -6.968   0.001
  223    H    ASP  34           H        ASP  34   4.302 -10.595  -0.361
  224    HA   ASP  34           HA       ASP  34   4.731 -13.006   1.372
  225   1HB   ASP  34          1HB       ASP  34   4.729 -10.411   2.144
  226   2HB   ASP  34          2HB       ASP  34   3.003 -10.750   2.255
  227    H    GLN  35           H        GLN  35   2.825 -11.711  -1.091
  228    HA   GLN  35           HA       GLN  35   0.743 -12.325  -1.988
  229   1HB   GLN  35          1HB       GLN  35   1.768 -14.621  -0.408
  230   2HB   GLN  35          2HB       GLN  35   0.063 -14.689  -0.848
  231   1HG   GLN  35          1HG       GLN  35   0.601 -15.238  -2.963
  232   2HG   GLN  35          2HG       GLN  35   1.580 -13.779  -3.115
  233   1HE2  GLN  35          1HE2      GLN  35   1.694 -17.233  -2.329
  234   2HE2  GLN  35          2HE2      GLN  35   3.386 -17.365  -2.359
  235    H    THR  36           H        THR  36  -0.267 -10.474  -0.791
  236    HA   THR  36           HA       THR  36  -2.573 -11.303   0.728
  237    HB   THR  36           HB       THR  36  -1.410  -9.846   2.782
  238    HG1  THR  36           HG1      THR  36   0.643 -10.410   2.956
  239   1HG2  THR  36          1HG2      THR  36  -2.280 -11.647   3.794
  240   2HG2  THR  36          2HG2      THR  36  -0.884 -12.590   3.270
  241   3HG2  THR  36          3HG2      THR  36  -2.328 -12.514   2.259
  242    H    THR  37           H        THR  37  -3.953  -9.489   1.284
  243    HA   THR  37           HA       THR  37  -3.204  -6.951  -0.124
  244    HB   THR  37           HB       THR  37  -5.630  -6.654  -0.320
  245    HG1  THR  37           HG1      THR  37  -6.176  -7.495   1.717
  246   1HG2  THR  37          1HG2      THR  37  -4.932  -9.553  -0.846
  247   2HG2  THR  37          2HG2      THR  37  -4.502  -8.212  -1.907
  248   3HG2  THR  37          3HG2      THR  37  -6.198  -8.614  -1.637
  249    H    THR  38           H        THR  38  -2.973  -5.081   1.119
  250    HA   THR  38           HA       THR  38  -4.034  -5.166   3.926
  251    HB   THR  38           HB       THR  38  -1.555  -5.597   3.699
  252    HG1  THR  38           HG1      THR  38  -2.422  -4.665   5.576
  253   1HG2  THR  38          1HG2      THR  38  -0.990  -4.215   1.813
  254   2HG2  THR  38          2HG2      THR  38  -0.160  -3.541   3.212
  255   3HG2  THR  38          3HG2      THR  38  -1.625  -2.773   2.601
  256    H    TRP  39           H        TRP  39  -4.750  -3.142   4.753
  257    HA   TRP  39           HA       TRP  39  -5.770  -1.258   2.821
  258   1HB   TRP  39          1HB       TRP  39  -5.488  -1.146   5.841
  259   2HB   TRP  39          2HB       TRP  39  -6.530  -0.100   4.879
  260    HD1  TRP  39           HD1      TRP  39  -6.180  -3.705   6.082
  261    HE1  TRP  39           HE1      TRP  39  -8.433  -4.912   5.750
  262    HE3  TRP  39           HE3      TRP  39  -8.724  -0.125   3.475
  263    HZ2  TRP  39           HZ2      TRP  39 -10.976  -4.424   4.541
  264    HZ3  TRP  39           HZ3      TRP  39 -11.059  -0.524   2.745
  265    HH2  TRP  39           HH2      TRP  39 -12.185  -2.670   3.274
  266    H    GLN  40           H        GLN  40  -3.502  -0.735   5.547
  267    HA   GLN  40           HA       GLN  40  -2.595   1.827   4.881
  268   1HB   GLN  40          1HB       GLN  40  -1.526  -0.570   6.301
  269   2HB   GLN  40          2HB       GLN  40  -0.392   0.738   5.961
  270   1HG   GLN  40          1HG       GLN  40  -1.376   2.144   7.457
  271   2HG   GLN  40          2HG       GLN  40  -3.003   1.621   7.018
  272   1HE2  GLN  40          1HE2      GLN  40  -3.787  -0.439   8.015
  273   2HE2  GLN  40          2HE2      GLN  40  -3.111  -0.975   9.478
  274    H    ASP  41           H        ASP  41  -0.388   2.399   3.968
  275    HA   ASP  41           HA       ASP  41   0.029   0.939   1.412
  276   1HB   ASP  41          1HB       ASP  41  -0.364   3.377   1.434
  277   2HB   ASP  41          2HB       ASP  41   1.037   3.595   2.482
  278    HA   PRO  42           HA       PRO  42   3.725  -0.885   3.051
  279   1HB   PRO  42          1HB       PRO  42   4.909  -1.604   0.693
  280   2HB   PRO  42          2HB       PRO  42   3.539  -2.484   1.397
  281   1HG   PRO  42          1HG       PRO  42   3.583  -0.475  -0.802
  282   2HG   PRO  42          2HG       PRO  42   2.628  -1.956  -0.650
  283   1HD   PRO  42          1HD       PRO  42   1.639   0.543  -0.164
  284   2HD   PRO  42          2HD       PRO  42   1.012  -0.928   0.607
  285    H    ARG  43           H        ARG  43   3.682   1.827   0.887
  286    HA   ARG  43           HA       ARG  43   6.564   2.393   1.496
  287   1HB   ARG  43          1HB       ARG  43   5.235   2.195  -0.907
  288   2HB   ARG  43          2HB       ARG  43   5.184   3.932  -0.607
  289   1HG   ARG  43          1HG       ARG  43   7.372   4.138  -1.107
  290   2HG   ARG  43          2HG       ARG  43   7.799   2.877   0.049
  291   1HD   ARG  43          1HD       ARG  43   7.317   1.140  -1.620
  292   2HD   ARG  43          2HD       ARG  43   6.796   2.378  -2.780
  293    HE   ARG  43           HE       ARG  43   9.559   1.770  -2.049
  294   1HH1  ARG  43          1HH1      ARG  43   7.351   4.233  -3.134
  295   2HH1  ARG  43          2HH1      ARG  43   8.595   5.175  -3.878
  296   1HH2  ARG  43          1HH2      ARG  43  11.156   3.011  -3.024
  297   2HH2  ARG  43          2HH2      ARG  43  10.734   4.491  -3.817
  298    H    LYS  44           H        LYS  44   4.017   3.011   3.109
  299    HA   LYS  44           HA       LYS  44   4.687   5.857   3.614
  300   1HB   LYS  44          1HB       LYS  44   2.708   5.261   1.857
  301   2HB   LYS  44          2HB       LYS  44   1.791   5.233   3.364
  302   1HG   LYS  44          1HG       LYS  44   1.644   7.487   2.955
  303   2HG   LYS  44          2HG       LYS  44   3.215   7.493   3.758
  304   1HD   LYS  44          1HD       LYS  44   4.381   7.492   1.658
  305   2HD   LYS  44          2HD       LYS  44   2.897   7.164   0.764
  306   1HE   LYS  44          1HE       LYS  44   3.210   9.503   0.486
  307   2HE   LYS  44          2HE       LYS  44   2.051   9.406   1.826
  308   1HZ   LYS  44          1HZ       LYS  44   3.743   9.696   3.397
  309   2HZ   LYS  44          2HZ       LYS  44   4.133  10.819   2.184
  310   3HZ   LYS  44          3HZ       LYS  44   4.976   9.347   2.286
  311    H    ALA  45           H        ALA  45   2.214   3.393   4.456
  312    HA   ALA  45           HA       ALA  45   2.197   4.247   7.259
  313   1HB   ALA  45          1HB       ALA  45   0.114   3.537   6.508
  314   2HB   ALA  45          2HB       ALA  45   0.704   2.052   7.253
  315   3HB   ALA  45          3HB       ALA  45   0.804   2.262   5.505
  316    H    MET  46           H        MET  46   2.383   0.900   6.177
  317    HA   MET  46           HA       MET  46   3.738  -0.885   6.909
  318   1HB   MET  46          1HB       MET  46   5.377   0.364   5.624
  319   2HB   MET  46          2HB       MET  46   5.654   1.467   6.970
  320   1HG   MET  46          1HG       MET  46   6.884  -0.082   8.166
  321   2HG   MET  46          2HG       MET  46   6.031  -1.457   7.464
  322   1HE   MET  46          1HE       MET  46   9.080  -0.495   8.054
  323   2HE   MET  46          2HE       MET  46  10.068  -1.071   6.713
  324   3HE   MET  46          3HE       MET  46   8.960  -2.177   7.519
  325    H    LEU  47           H        LEU  47   5.526   1.425   8.903
  326    HA   LEU  47           HA       LEU  47   4.470   0.020  11.320
  327   1HB   LEU  47          1HB       LEU  47   6.611   0.738  12.317
  328   2HB   LEU  47          2HB       LEU  47   6.890  -0.127  10.806
  329    HG   LEU  47           HG       LEU  47   6.521   2.591  10.108
  330   1HD1  LEU  47          1HD1      LEU  47   7.156   3.694  11.986
  331   2HD1  LEU  47          2HD1      LEU  47   8.782   3.139  11.590
  332   3HD1  LEU  47          3HD1      LEU  47   7.795   2.230  12.733
  333   1HD2  LEU  47          1HD2      LEU  47   8.382   2.138   8.886
  334   2HD2  LEU  47          2HD2      LEU  47   8.201   0.495   9.501
  335   3HD2  LEU  47          3HD2      LEU  47   9.294   1.622  10.304
  336    H    SER  48           H        SER  48   4.614   3.086   9.716
  337    HA   SER  48           HA       SER  48   3.820   5.225  10.338
  338   1HB   SER  48          1HB       SER  48   2.020   3.200  11.033
  339   2HB   SER  48          2HB       SER  48   2.106   4.212  12.475
  340    HG   SER  48           HG       SER  48   1.801   5.299   9.889
  341    H    GLN  49           H        GLN  49   5.677   6.128  11.349
  342    HA   GLN  49           HA       GLN  49   5.482   6.667  14.182
  343   1HB   GLN  49          1HB       GLN  49   6.260   4.209  13.934
  344   2HB   GLN  49          2HB       GLN  49   7.792   4.890  13.388
  345   1HG   GLN  49          1HG       GLN  49   8.389   5.237  15.529
  346   2HG   GLN  49          2HG       GLN  49   7.007   6.314  15.731
  347   1HE2  GLN  49          1HE2      GLN  49   8.170   3.021  16.271
  348   2HE2  GLN  49          2HE2      GLN  49   6.850   2.514  17.209
  349    H    MET  50           H        MET  50   6.689   8.506  14.609
  350    HA   MET  50           HA       MET  50   9.194   9.141  13.317
  351   1HB   MET  50          1HB       MET  50   7.110   9.383  11.630
  352   2HB   MET  50          2HB       MET  50   7.026  10.971  12.392
  353   1HG   MET  50          1HG       MET  50   8.465  11.128  10.439
  354   2HG   MET  50          2HG       MET  50   9.465  11.277  11.884
  355   1HE   MET  50          1HE       MET  50  10.661   9.780   8.616
  356   2HE   MET  50          2HE       MET  50  11.933   9.802   9.834
  357   3HE   MET  50          3HE       MET  50  10.774  11.126   9.757
  358   1H    GLY  51          1H        GLY  51 -12.725  -4.358  13.086
  359   2H    GLY  51          2H        GLY  51 -13.595  -2.936  13.416
  360   3H    GLY  51          3H        GLY  51 -11.915  -2.984  13.662
  361   1HA   GLY  51          1HA       GLY  51 -12.970  -1.908  11.514
  362   2HA   GLY  51          2HA       GLY  51 -11.420  -2.750  11.477
  363    H    THR  52           H        THR  52 -12.460  -2.846   9.108
  364    HA   THR  52           HA       THR  52 -14.153  -5.304   8.887
  365    HB   THR  52           HB       THR  52 -14.961  -3.192   7.872
  366    HG1  THR  52           HG1      THR  52 -15.587  -4.191   6.098
  367   1HG2  THR  52          1HG2      THR  52 -12.309  -3.356   6.432
  368   2HG2  THR  52          2HG2      THR  52 -12.934  -2.025   7.407
  369   3HG2  THR  52          3HG2      THR  52 -13.651  -2.379   5.835
  370    HA   PRO  53           HA       PRO  53 -10.632  -7.465   7.334
  371   1HB   PRO  53          1HB       PRO  53 -11.897  -9.435   5.913
  372   2HB   PRO  53          2HB       PRO  53 -11.815  -9.420   7.685
  373   1HG   PRO  53          1HG       PRO  53 -14.044  -8.619   5.876
  374   2HG   PRO  53          2HG       PRO  53 -14.101  -9.472   7.424
  375   1HD   PRO  53          1HD       PRO  53 -14.666  -6.813   7.131
  376   2HD   PRO  53          2HD       PRO  53 -14.053  -7.530   8.636
  377    HA   PRO  54           HA       PRO  54 -10.148  -5.669   3.299
  378   1HB   PRO  54          1HB       PRO  54  -7.802  -6.890   2.592
  379   2HB   PRO  54          2HB       PRO  54  -7.884  -5.545   3.745
  380   1HG   PRO  54          1HG       PRO  54  -7.656  -8.476   4.252
  381   2HG   PRO  54          2HG       PRO  54  -6.855  -7.127   5.070
  382   1HD   PRO  54          1HD       PRO  54  -9.011  -8.431   6.101
  383   2HD   PRO  54          2HD       PRO  54  -8.656  -6.723   6.436
  384    HA   PRO  55           HA       PRO  55 -11.529  -8.609   0.333
  385   1HB   PRO  55          1HB       PRO  55 -10.105  -8.015  -1.934
  386   2HB   PRO  55          2HB       PRO  55 -11.410  -6.985  -1.310
  387   1HG   PRO  55          1HG       PRO  55  -8.463  -6.674  -1.048
  388   2HG   PRO  55          2HG       PRO  55  -9.710  -5.450  -1.322
  389   1HD   PRO  55          1HD       PRO  55  -8.556  -5.901   1.102
  390   2HD   PRO  55          2HD       PRO  55 -10.208  -5.277   0.908
  391    HA   PRO  56           HA       PRO  56  -8.801 -12.061   0.211
  392   1HB   PRO  56          1HB       PRO  56  -9.643 -13.404  -2.019
  393   2HB   PRO  56          2HB       PRO  56 -10.579 -13.352  -0.512
  394   1HG   PRO  56          1HG       PRO  56 -10.939 -11.787  -3.018
  395   2HG   PRO  56          2HG       PRO  56 -12.155 -12.489  -1.940
  396   1HD   PRO  56          1HD       PRO  56 -11.489  -9.845  -1.936
  397   2HD   PRO  56          2HD       PRO  56 -12.112 -10.703  -0.512
  398    H    TYR  57           H        TYR  57  -6.737 -12.455  -0.581
  399    HA   TYR  57           HA       TYR  57  -5.445 -10.679  -2.358
  400   1HB   TYR  57          1HB       TYR  57  -4.488 -12.287  -0.641
  401   2HB   TYR  57          2HB       TYR  57  -4.724 -13.571  -1.823
  402    HD1  TYR  57           HD1      TYR  57  -3.613 -10.021  -2.229
  403    HD2  TYR  57           HD2      TYR  57  -2.614 -14.173  -2.647
  404    HE1  TYR  57           HE1      TYR  57  -1.483  -9.391  -3.322
  405    HE2  TYR  57           HE2      TYR  57  -0.481 -13.544  -3.741
  406    HH   TYR  57           HH       TYR  57   0.573 -10.194  -3.926
  407    H    THR  58           H        THR  58  -4.937 -10.814  -4.577
  408    HA   THR  58           HA       THR  58  -6.581 -12.768  -6.144
  409    HB   THR  58           HB       THR  58  -5.434 -10.035  -6.782
  410    HG1  THR  58           HG1      THR  58  -7.182  -9.539  -5.724
  411   1HG2  THR  58          1HG2      THR  58  -6.579 -12.159  -8.467
  412   2HG2  THR  58          2HG2      THR  58  -5.596 -10.767  -8.922
  413   3HG2  THR  58          3HG2      THR  58  -7.334 -10.581  -8.684
  414    H    VAL  59           H        VAL  59  -3.414 -12.287  -5.168
  415    HA   VAL  59           HA       VAL  59  -1.290 -12.821  -6.064
  416    HB   VAL  59           HB       VAL  59  -1.254 -15.165  -6.711
  417   1HG1  VAL  59          1HG1      VAL  59  -2.887 -16.086  -4.940
  418   2HG1  VAL  59          2HG1      VAL  59  -3.315 -14.403  -4.642
  419   3HG1  VAL  59          3HG1      VAL  59  -1.657 -14.948  -4.393
  420   1HG2  VAL  59          1HG2      VAL  59  -4.263 -15.048  -6.992
  421   2HG2  VAL  59          2HG2      VAL  59  -3.191 -16.388  -7.396
  422   3HG2  VAL  59          3HG2      VAL  59  -3.169 -14.917  -8.369
  423    H    GLY  60           H        GLY  60  -2.708 -11.018  -7.829
  424   1HA   GLY  60          1HA       GLY  60  -1.639 -10.287  -9.956
  425   2HA   GLY  60          2HA       GLY  60  -1.636 -11.980 -10.451
  Start of MODEL   13
    1    H    PHE   5           H        PHE   5  -8.292  11.472   6.231
    2    HA   PHE   5           HA       PHE   5  -6.790  12.290   3.798
    3   1HB   PHE   5          1HB       PHE   5  -6.074  13.652   5.810
    4   2HB   PHE   5          2HB       PHE   5  -5.548  12.146   6.561
    5    HD1  PHE   5           HD1      PHE   5  -5.045  14.358   3.609
    6    HD2  PHE   5           HD2      PHE   5  -3.492  11.113   5.955
    7    HE1  PHE   5           HE1      PHE   5  -2.905  14.480   2.360
    8    HE2  PHE   5           HE2      PHE   5  -1.352  11.235   4.707
    9    HZ   PHE   5           HZ       PHE   5  -1.058  12.919   2.909
   10    H    GLU   6           H        GLU   6  -5.562  10.566   2.948
   11    HA   GLU   6           HA       GLU   6  -5.600   8.005   4.502
   12   1HB   GLU   6          1HB       GLU   6  -7.203   8.563   2.405
   13   2HB   GLU   6          2HB       GLU   6  -5.783   8.000   1.524
   14   1HG   GLU   6          1HG       GLU   6  -7.045   6.033   1.892
   15   2HG   GLU   6          2HG       GLU   6  -5.807   5.991   3.149
   16    H    ILE   7           H        ILE   7  -4.252   6.830   2.014
   17    HA   ILE   7           HA       ILE   7  -1.506   7.366   2.837
   18    HB   ILE   7           HB       ILE   7  -2.687   5.798   0.519
   19   1HG1  ILE   7          1HG1      ILE   7  -3.538   5.052   2.711
   20   2HG1  ILE   7          2HG1      ILE   7  -2.435   3.855   2.034
   21   1HG2  ILE   7          1HG2      ILE   7  -0.032   5.335   1.879
   22   2HG2  ILE   7          2HG2      ILE   7  -0.182   6.443   0.514
   23   3HG2  ILE   7          3HG2      ILE   7  -0.583   4.737   0.314
   24   1HD1  ILE   7          1HD1      ILE   7  -1.879   4.179   4.379
   25   2HD1  ILE   7          2HD1      ILE   7  -1.786   5.926   4.153
   26   3HD1  ILE   7          3HD1      ILE   7  -0.590   4.874   3.397
   27    HA   PRO   8           HA       PRO   8  -0.791  10.640  -0.052
   28   1HB   PRO   8          1HB       PRO   8   1.942  10.533  -0.155
   29   2HB   PRO   8          2HB       PRO   8   1.051  11.210   1.221
   30   1HG   PRO   8          1HG       PRO   8   2.330   8.536   0.910
   31   2HG   PRO   8          2HG       PRO   8   2.256   9.591   2.329
   32   1HD   PRO   8          1HD       PRO   8   0.660   7.403   1.989
   33   2HD   PRO   8          2HD       PRO   8   0.204   8.816   2.963
   34    H    ASP   9           H        ASP   9   0.234  10.956  -2.247
   35    HA   ASP   9           HA       ASP   9   0.317   8.362  -3.741
   36   1HB   ASP   9          1HB       ASP   9  -1.353  10.405  -4.076
   37   2HB   ASP   9          2HB       ASP   9  -0.010  11.054  -5.018
   38    H    ASP  10           H        ASP  10   2.584   9.893  -2.301
   39    HA   ASP  10           HA       ASP  10   4.322  10.650  -4.584
   40   1HB   ASP  10          1HB       ASP  10   4.652  10.689  -1.567
   41   2HB   ASP  10          2HB       ASP  10   5.831  11.335  -2.708
   42    H    VAL  11           H        VAL  11   4.916   8.699  -1.635
   43    HA   VAL  11           HA       VAL  11   7.040   7.174  -2.777
   44    HB   VAL  11           HB       VAL  11   6.609   5.766  -0.744
   45   1HG1  VAL  11          1HG1      VAL  11   6.766   7.769   0.883
   46   2HG1  VAL  11          2HG1      VAL  11   6.676   8.775  -0.562
   47   3HG1  VAL  11          3HG1      VAL  11   8.008   7.636  -0.363
   48   1HG2  VAL  11          1HG2      VAL  11   4.688   7.311   0.593
   49   2HG2  VAL  11          2HG2      VAL  11   4.484   5.665  -0.006
   50   3HG2  VAL  11          3HG2      VAL  11   4.014   7.034  -1.013
   51    HA   PRO  12           HA       PRO  12   4.333   4.519  -5.207
   52   1HB   PRO  12          1HB       PRO  12   6.323   3.003  -6.324
   53   2HB   PRO  12          2HB       PRO  12   5.894   4.620  -6.915
   54   1HG   PRO  12          1HG       PRO  12   8.137   3.777  -5.140
   55   2HG   PRO  12          2HG       PRO  12   8.124   4.966  -6.451
   56   1HD   PRO  12          1HD       PRO  12   8.016   5.642  -3.815
   57   2HD   PRO  12          2HD       PRO  12   7.295   6.629  -5.103
   58    H    LEU  13           H        LEU  13   4.981   1.800  -5.583
   59    HA   LEU  13           HA       LEU  13   4.729   0.808  -2.795
   60   1HB   LEU  13          1HB       LEU  13   3.914  -0.030  -5.529
   61   2HB   LEU  13          2HB       LEU  13   4.225  -1.321  -4.368
   62    HG   LEU  13           HG       LEU  13   1.853  -0.602  -4.313
   63   1HD1  LEU  13          1HD1      LEU  13   1.930  -1.161  -2.140
   64   2HD1  LEU  13          2HD1      LEU  13   2.463   0.471  -1.735
   65   3HD1  LEU  13          3HD1      LEU  13   3.649  -0.777  -2.110
   66   1HD2  LEU  13          1HD2      LEU  13   1.187   1.590  -3.949
   67   2HD2  LEU  13          2HD2      LEU  13   2.668   1.862  -4.867
   68   3HD2  LEU  13          3HD2      LEU  13   2.679   2.011  -3.110
   69    HA   PRO  14           HA       PRO  14   8.802  -0.906  -3.190
   70   1HB   PRO  14          1HB       PRO  14   8.873  -2.191  -0.781
   71   2HB   PRO  14          2HB       PRO  14   8.997  -0.431  -0.945
   72   1HG   PRO  14          1HG       PRO  14   6.797  -2.055   0.087
   73   2HG   PRO  14          2HG       PRO  14   7.112  -0.329   0.290
   74   1HD   PRO  14          1HD       PRO  14   5.279  -1.626  -1.518
   75   2HD   PRO  14          2HD       PRO  14   5.499   0.109  -1.232
   76    H    ALA  15           H        ALA  15   9.646  -2.817  -4.030
   77    HA   ALA  15           HA       ALA  15   9.682  -5.043  -4.799
   78   1HB   ALA  15          1HB       ALA  15   9.030  -6.664  -3.102
   79   2HB   ALA  15          2HB       ALA  15   8.041  -5.449  -2.293
   80   3HB   ALA  15          3HB       ALA  15   9.794  -5.284  -2.313
   81    H    GLY  16           H        GLY  16   7.400  -6.946  -4.130
   82   1HA   GLY  16          1HA       GLY  16   5.766  -6.214  -6.455
   83   2HA   GLY  16          2HA       GLY  16   5.695  -7.738  -5.577
   84    H    TRP  17           H        TRP  17   5.499  -4.617  -3.934
   85    HA   TRP  17           HA       TRP  17   2.948  -5.378  -2.721
   86   1HB   TRP  17          1HB       TRP  17   4.933  -3.182  -2.602
   87   2HB   TRP  17          2HB       TRP  17   3.294  -2.742  -2.152
   88    HD1  TRP  17           HD1      TRP  17   6.337  -4.200  -0.731
   89    HE1  TRP  17           HE1      TRP  17   5.853  -5.284   1.555
   90    HE3  TRP  17           HE3      TRP  17   1.254  -4.333  -0.897
   91    HZ2  TRP  17           HZ2      TRP  17   3.592  -6.096   3.113
   92    HZ3  TRP  17           HZ3      TRP  17  -0.049  -5.257   0.997
   93    HH2  TRP  17           HH2      TRP  17   1.112  -6.142   2.999
   94    H    GLU  18           H        GLU  18   1.576  -5.583  -4.682
   95    HA   GLU  18           HA       GLU  18   1.141  -3.268  -6.422
   96   1HB   GLU  18          1HB       GLU  18   0.675  -5.991  -6.516
   97   2HB   GLU  18          2HB       GLU  18  -0.944  -5.333  -6.267
   98   1HG   GLU  18          1HG       GLU  18  -1.028  -4.454  -8.343
   99   2HG   GLU  18          2HG       GLU  18   0.615  -3.820  -8.232
  100    H    MET  19           H        MET  19  -1.528  -3.032  -6.617
  101    HA   MET  19           HA       MET  19  -2.894  -2.782  -4.088
  102   1HB   MET  19          1HB       MET  19  -2.711  -0.426  -3.764
  103   2HB   MET  19          2HB       MET  19  -1.081  -1.036  -3.997
  104   1HG   MET  19          1HG       MET  19  -2.705   0.074  -6.295
  105   2HG   MET  19          2HG       MET  19  -1.720   1.110  -5.271
  106   1HE   MET  19          1HE       MET  19   0.410   1.807  -7.300
  107   2HE   MET  19          2HE       MET  19   1.567   1.017  -6.232
  108   3HE   MET  19          3HE       MET  19   0.116   1.753  -5.557
  109    H    ALA  20           H        ALA  20  -5.045  -2.244  -4.352
  110    HA   ALA  20           HA       ALA  20  -6.002  -1.310  -6.990
  111   1HB   ALA  20          1HB       ALA  20  -6.367  -4.059  -5.785
  112   2HB   ALA  20          2HB       ALA  20  -5.745  -3.648  -7.383
  113   3HB   ALA  20          3HB       ALA  20  -7.459  -3.438  -7.023
  114    H    LYS  21           H        LYS  21  -8.448  -1.023  -6.883
  115    HA   LYS  21           HA       LYS  21  -9.212  -0.177  -4.123
  116   1HB   LYS  21          1HB       LYS  21 -10.864   1.213  -5.385
  117   2HB   LYS  21          2HB       LYS  21  -9.203   1.520  -5.887
  118   1HG   LYS  21          1HG       LYS  21  -9.690   0.903  -7.997
  119   2HG   LYS  21          2HG       LYS  21 -10.279  -0.660  -7.433
  120   1HD   LYS  21          1HD       LYS  21 -12.487   0.218  -7.057
  121   2HD   LYS  21          2HD       LYS  21 -11.934   1.874  -7.307
  122   1HE   LYS  21          1HE       LYS  21 -11.321   1.233  -9.675
  123   2HE   LYS  21          2HE       LYS  21 -12.110  -0.331  -9.390
  124   1HZ   LYS  21          1HZ       LYS  21 -13.719   1.201 -10.288
  125   2HZ   LYS  21          2HZ       LYS  21 -13.339   2.366  -9.111
  126   3HZ   LYS  21          3HZ       LYS  21 -14.100   0.916  -8.661
  127    H    THR  22           H        THR  22  -9.961  -2.246  -3.342
  128    HA   THR  22           HA       THR  22 -11.814  -3.915  -4.776
  129    HB   THR  22           HB       THR  22 -10.387  -4.630  -2.881
  130    HG1  THR  22           HG1      THR  22 -12.365  -5.719  -3.336
  131   1HG2  THR  22          1HG2      THR  22 -11.112  -3.975  -0.572
  132   2HG2  THR  22          2HG2      THR  22 -12.210  -2.802  -1.298
  133   3HG2  THR  22          3HG2      THR  22 -10.469  -2.629  -1.511
  134    H    SER  23           H        SER  23 -14.125  -4.197  -4.210
  135    HA   SER  23           HA       SER  23 -16.301  -3.338  -3.921
  136   1HB   SER  23          1HB       SER  23 -14.727  -1.911  -1.758
  137   2HB   SER  23          2HB       SER  23 -16.488  -1.922  -1.842
  138    HG   SER  23           HG       SER  23 -16.205  -3.674  -0.696
  139    H    SER  24           H        SER  24 -14.856  -0.294  -2.836
  140    HA   SER  24           HA       SER  24 -15.809   0.964  -5.388
  141   1HB   SER  24          1HB       SER  24 -17.267   1.532  -3.564
  142   2HB   SER  24          2HB       SER  24 -15.902   1.854  -2.495
  143    HG   SER  24           HG       SER  24 -17.123   3.625  -3.829
  144    H    GLY  25           H        GLY  25 -14.018   2.394  -2.678
  145   1HA   GLY  25          1HA       GLY  25 -11.675   2.738  -4.502
  146   2HA   GLY  25          2HA       GLY  25 -12.289   4.095  -3.562
  147    H    GLN  26           H        GLN  26 -12.248   0.849  -2.240
  148    HA   GLN  26           HA       GLN  26 -10.731   1.673   0.077
  149   1HB   GLN  26          1HB       GLN  26 -11.643  -0.950  -1.119
  150   2HB   GLN  26          2HB       GLN  26 -10.730  -0.894   0.388
  151   1HG   GLN  26          1HG       GLN  26 -12.438   0.588   1.372
  152   2HG   GLN  26          2HG       GLN  26 -13.347   0.550  -0.139
  153   1HE2  GLN  26          1HE2      GLN  26 -14.985  -0.374   1.634
  154   2HE2  GLN  26          2HE2      GLN  26 -14.995  -2.063   1.794
  155    H    ARG  27           H        ARG  27  -8.919   2.609  -1.375
  156    HA   ARG  27           HA       ARG  27  -7.155   1.145  -2.962
  157   1HB   ARG  27          1HB       ARG  27  -7.297   3.648  -1.727
  158   2HB   ARG  27          2HB       ARG  27  -5.786   2.956  -1.140
  159   1HG   ARG  27          1HG       ARG  27  -5.583   2.270  -3.731
  160   2HG   ARG  27          2HG       ARG  27  -6.576   3.720  -3.908
  161   1HD   ARG  27          1HD       ARG  27  -4.500   4.281  -2.005
  162   2HD   ARG  27          2HD       ARG  27  -3.760   3.582  -3.457
  163    HE   ARG  27           HE       ARG  27  -4.507   5.466  -4.690
  164   1HH1  ARG  27          1HH1      ARG  27  -6.100   5.284  -1.599
  165   2HH1  ARG  27          2HH1      ARG  27  -6.854   6.831  -1.774
  166   1HH2  ARG  27          1HH2      ARG  27  -5.497   7.469  -4.892
  167   2HH2  ARG  27          2HH2      ARG  27  -6.517   8.060  -3.622
  168    H    TYR  28           H        TYR  28  -6.826  -1.003  -2.153
  169    HA   TYR  28           HA       TYR  28  -5.264  -1.157   0.395
  170   1HB   TYR  28          1HB       TYR  28  -6.118  -3.393   0.604
  171   2HB   TYR  28          2HB       TYR  28  -7.483  -2.374   0.162
  172    HD1  TYR  28           HD1      TYR  28  -5.310  -5.120  -0.862
  173    HD2  TYR  28           HD2      TYR  28  -8.351  -2.396  -2.184
  174    HE1  TYR  28           HE1      TYR  28  -5.804  -6.600  -2.787
  175    HE2  TYR  28           HE2      TYR  28  -8.834  -3.866  -4.116
  176    HH   TYR  28           HH       TYR  28  -7.730  -5.590  -5.430
  177    H    PHE  29           H        PHE  29  -3.145  -1.767   0.221
  178    HA   PHE  29           HA       PHE  29  -2.064  -2.231  -2.468
  179   1HB   PHE  29          1HB       PHE  29  -0.805  -2.043   0.287
  180   2HB   PHE  29          2HB       PHE  29   0.091  -2.057  -1.236
  181    HD1  PHE  29           HD1      PHE  29   0.077  -0.142  -2.728
  182    HD2  PHE  29           HD2      PHE  29  -2.285  -0.153   0.860
  183    HE1  PHE  29           HE1      PHE  29  -0.355   2.282  -3.001
  184    HE2  PHE  29           HE2      PHE  29  -2.712   2.269   0.589
  185    HZ   PHE  29           HZ       PHE  29  -1.748   3.488  -1.343
  186    H    LYS  30           H        LYS  30  -1.914  -4.208  -3.302
  187    HA   LYS  30           HA       LYS  30  -2.276  -6.623  -1.733
  188   1HB   LYS  30          1HB       LYS  30  -1.599  -5.974  -4.596
  189   2HB   LYS  30          2HB       LYS  30  -1.907  -7.615  -4.035
  190   1HG   LYS  30          1HG       LYS  30  -3.992  -6.004  -3.040
  191   2HG   LYS  30          2HG       LYS  30  -3.765  -5.519  -4.710
  192   1HD   LYS  30          1HD       LYS  30  -3.583  -8.269  -4.867
  193   2HD   LYS  30          2HD       LYS  30  -4.813  -8.045  -3.625
  194   1HE   LYS  30          1HE       LYS  30  -6.275  -7.732  -5.347
  195   2HE   LYS  30          2HE       LYS  30  -5.483  -6.163  -5.589
  196   1HZ   LYS  30          1HZ       LYS  30  -3.735  -7.461  -6.853
  197   2HZ   LYS  30          2HZ       LYS  30  -5.243  -7.309  -7.621
  198   3HZ   LYS  30          3HZ       LYS  30  -4.819  -8.765  -6.853
  199    H    ASN  31           H        ASN  31  -0.705  -7.979  -1.027
  200    HA   ASN  31           HA       ASN  31   2.131  -7.136  -1.373
  201   1HB   ASN  31          1HB       ASN  31   0.844  -7.643   0.852
  202   2HB   ASN  31          2HB       ASN  31   1.092  -9.331   0.413
  203   1HD2  ASN  31          1HD2      ASN  31   2.398  -8.714   2.680
  204   2HD2  ASN  31          2HD2      ASN  31   4.054  -8.447   2.420
  205    H    HIS  32           H        HIS  32   2.830  -8.058  -3.343
  206    HA   HIS  32           HA       HIS  32   2.123 -10.895  -3.880
  207   1HB   HIS  32          1HB       HIS  32   3.693  -8.818  -5.454
  208   2HB   HIS  32          2HB       HIS  32   3.193 -10.396  -6.066
  209    HD1  HIS  32           HD1      HIS  32   1.086 -10.249  -7.400
  210    HD2  HIS  32           HD2      HIS  32   1.149  -7.437  -4.328
  211    HE1  HIS  32           HE1      HIS  32  -1.123  -9.005  -7.517
  212    H    ILE  33           H        ILE  33   4.155  -9.666  -1.804
  213    HA   ILE  33           HA       ILE  33   6.575 -11.241  -2.575
  214    HB   ILE  33           HB       ILE  33   6.343  -9.668  -0.030
  215   1HG1  ILE  33          1HG1      ILE  33   6.867  -8.262  -2.668
  216   2HG1  ILE  33          2HG1      ILE  33   5.322  -8.169  -1.812
  217   1HG2  ILE  33          1HG2      ILE  33   8.408 -10.824  -0.522
  218   2HG2  ILE  33          2HG2      ILE  33   8.695  -9.090  -0.664
  219   3HG2  ILE  33          3HG2      ILE  33   8.499 -10.073  -2.115
  220   1HD1  ILE  33          1HD1      ILE  33   6.691  -6.268  -1.178
  221   2HD1  ILE  33          2HD1      ILE  33   8.023  -7.334  -0.735
  222   3HD1  ILE  33          3HD1      ILE  33   6.528  -7.352   0.202
  223    H    ASP  34           H        ASP  34   4.433 -10.572   0.164
  224    HA   ASP  34           HA       ASP  34   4.907 -13.298   1.237
  225   1HB   ASP  34          1HB       ASP  34   4.604 -10.676   2.307
  226   2HB   ASP  34          2HB       ASP  34   3.218 -11.620   2.852
  227    H    GLN  35           H        GLN  35   2.867 -11.848  -0.920
  228    HA   GLN  35           HA       GLN  35   0.746 -12.352  -1.769
  229   1HB   GLN  35          1HB       GLN  35   1.126 -14.805  -0.015
  230   2HB   GLN  35          2HB       GLN  35   0.050 -14.672  -1.404
  231   1HG   GLN  35          1HG       GLN  35   1.980 -14.294  -2.881
  232   2HG   GLN  35          2HG       GLN  35   3.069 -14.378  -1.497
  233   1HE2  GLN  35          1HE2      GLN  35   0.516 -16.363  -3.107
  234   2HE2  GLN  35          2HE2      GLN  35   1.268 -17.851  -2.789
  235    H    THR  36           H        THR  36  -0.158 -10.538  -0.460
  236    HA   THR  36           HA       THR  36  -2.392 -11.377   1.184
  237    HB   THR  36           HB       THR  36  -1.174  -9.894   3.145
  238    HG1  THR  36           HG1      THR  36   0.818  -9.807   2.284
  239   1HG2  THR  36          1HG2      THR  36  -0.464 -12.745   3.252
  240   2HG2  THR  36          2HG2      THR  36  -2.153 -12.441   2.844
  241   3HG2  THR  36          3HG2      THR  36  -1.476 -11.793   4.338
  242    H    THR  37           H        THR  37  -3.912  -9.750   1.110
  243    HA   THR  37           HA       THR  37  -3.133  -7.154  -0.095
  244    HB   THR  37           HB       THR  37  -5.564  -6.940  -0.406
  245    HG1  THR  37           HG1      THR  37  -5.827  -9.397   0.954
  246   1HG2  THR  37          1HG2      THR  37  -4.032  -8.675  -1.713
  247   2HG2  THR  37          2HG2      THR  37  -5.770  -8.594  -1.999
  248   3HG2  THR  37          3HG2      THR  37  -5.108  -9.842  -0.943
  249    H    THR  38           H        THR  38  -3.008  -5.269   1.107
  250    HA   THR  38           HA       THR  38  -4.218  -5.290   3.851
  251    HB   THR  38           HB       THR  38  -1.712  -5.698   3.737
  252    HG1  THR  38           HG1      THR  38  -2.697  -4.799   5.571
  253   1HG2  THR  38          1HG2      THR  38  -1.585  -2.775   2.958
  254   2HG2  THR  38          2HG2      THR  38  -1.383  -4.086   1.800
  255   3HG2  THR  38          3HG2      THR  38  -0.240  -3.902   3.128
  256    H    TRP  39           H        TRP  39  -4.933  -3.214   4.604
  257    HA   TRP  39           HA       TRP  39  -5.916  -1.425   2.564
  258   1HB   TRP  39          1HB       TRP  39  -5.726  -1.186   5.584
  259   2HB   TRP  39          2HB       TRP  39  -6.746  -0.189   4.548
  260    HD1  TRP  39           HD1      TRP  39  -6.406  -3.732   5.923
  261    HE1  TRP  39           HE1      TRP  39  -8.635  -4.974   5.571
  262    HE3  TRP  39           HE3      TRP  39  -8.889  -0.302   3.065
  263    HZ2  TRP  39           HZ2      TRP  39 -11.137  -4.570   4.253
  264    HZ3  TRP  39           HZ3      TRP  39 -11.192  -0.760   2.276
  265    HH2  TRP  39           HH2      TRP  39 -12.316  -2.892   2.866
  266    H    GLN  40           H        GLN  40  -3.897  -0.579   5.390
  267    HA   GLN  40           HA       GLN  40  -2.945   1.890   4.477
  268   1HB   GLN  40          1HB       GLN  40  -1.879  -0.276   6.276
  269   2HB   GLN  40          2HB       GLN  40  -0.935   1.187   6.001
  270   1HG   GLN  40          1HG       GLN  40  -3.594   2.030   6.493
  271   2HG   GLN  40          2HG       GLN  40  -3.221   0.816   7.716
  272   1HE2  GLN  40          1HE2      GLN  40  -2.021   3.888   6.311
  273   2HE2  GLN  40          2HE2      GLN  40  -1.124   4.347   7.678
  274    H    ASP  41           H        ASP  41  -0.637   2.378   3.796
  275    HA   ASP  41           HA       ASP  41   0.073   0.722   1.453
  276   1HB   ASP  41          1HB       ASP  41  -0.118   3.234   1.466
  277   2HB   ASP  41          2HB       ASP  41   1.268   3.287   2.555
  278    HA   PRO  42           HA       PRO  42   3.308  -1.386   3.608
  279   1HB   PRO  42          1HB       PRO  42   4.894  -2.056   1.475
  280   2HB   PRO  42          2HB       PRO  42   3.374  -2.887   1.858
  281   1HG   PRO  42          1HG       PRO  42   3.914  -0.745  -0.152
  282   2HG   PRO  42          2HG       PRO  42   2.921  -2.202  -0.302
  283   1HD   PRO  42          1HD       PRO  42   1.863   0.251   0.145
  284   2HD   PRO  42          2HD       PRO  42   1.120  -1.237   0.765
  285    H    ARG  43           H        ARG  43   3.724   1.557   1.925
  286    HA   ARG  43           HA       ARG  43   6.617   1.769   2.571
  287   1HB   ARG  43          1HB       ARG  43   4.661   3.613   1.158
  288   2HB   ARG  43          2HB       ARG  43   6.406   3.852   1.244
  289   1HG   ARG  43          1HG       ARG  43   5.886   1.180   0.340
  290   2HG   ARG  43          2HG       ARG  43   4.950   2.302  -0.647
  291   1HD   ARG  43          1HD       ARG  43   7.173   2.027  -1.648
  292   2HD   ARG  43          2HD       ARG  43   7.062   3.660  -0.964
  293    HE   ARG  43           HE       ARG  43   7.997   2.171   1.156
  294   1HH1  ARG  43          1HH1      ARG  43   8.991   2.516  -2.163
  295   2HH1  ARG  43          2HH1      ARG  43  10.655   2.200  -1.811
  296   1HH2  ARG  43          1HH2      ARG  43  10.163   1.764   1.586
  297   2HH2  ARG  43          2HH2      ARG  43  11.316   1.777   0.293
  298    H    LYS  44           H        LYS  44   3.885   4.061   2.893
  299    HA   LYS  44           HA       LYS  44   5.043   5.508   5.074
  300   1HB   LYS  44          1HB       LYS  44   3.287   6.319   3.518
  301   2HB   LYS  44          2HB       LYS  44   2.149   5.166   4.219
  302   1HG   LYS  44          1HG       LYS  44   1.709   7.210   5.348
  303   2HG   LYS  44          2HG       LYS  44   2.688   6.276   6.479
  304   1HD   LYS  44          1HD       LYS  44   3.642   8.469   6.448
  305   2HD   LYS  44          2HD       LYS  44   4.721   7.462   5.483
  306   1HE   LYS  44          1HE       LYS  44   3.957   8.385   3.446
  307   2HE   LYS  44          2HE       LYS  44   2.460   8.990   4.180
  308   1HZ   LYS  44          1HZ       LYS  44   5.218   9.902   4.837
  309   2HZ   LYS  44          2HZ       LYS  44   3.792  10.469   5.567
  310   3HZ   LYS  44          3HZ       LYS  44   4.086  10.775   3.923
  311    H    ALA  45           H        ALA  45   2.425   3.054   5.052
  312    HA   ALA  45           HA       ALA  45   2.804   2.740   8.005
  313   1HB   ALA  45          1HB       ALA  45   0.505   1.435   7.402
  314   2HB   ALA  45          2HB       ALA  45   0.554   2.587   6.068
  315   3HB   ALA  45          3HB       ALA  45   0.562   3.166   7.733
  316    H    MET  46           H        MET  46   4.816   1.427   7.113
  317    HA   MET  46           HA       MET  46   4.381  -1.132   5.859
  318   1HB   MET  46          1HB       MET  46   6.721  -1.495   6.563
  319   2HB   MET  46          2HB       MET  46   6.515   0.131   5.911
  320   1HG   MET  46          1HG       MET  46   6.454   1.093   8.112
  321   2HG   MET  46          2HG       MET  46   6.339  -0.496   8.869
  322   1HE   MET  46          1HE       MET  46   9.624   0.879  10.046
  323   2HE   MET  46          2HE       MET  46   7.916   1.307   9.975
  324   3HE   MET  46          3HE       MET  46   9.070   2.144   8.940
  325    H    LEU  47           H        LEU  47   4.202  -0.007   9.178
  326    HA   LEU  47           HA       LEU  47   4.428  -2.574  10.474
  327   1HB   LEU  47          1HB       LEU  47   3.796   0.217  11.089
  328   2HB   LEU  47          2HB       LEU  47   2.876  -0.915  12.079
  329    HG   LEU  47           HG       LEU  47   5.887  -0.950  11.713
  330   1HD1  LEU  47          1HD1      LEU  47   5.935  -0.239  14.077
  331   2HD1  LEU  47          2HD1      LEU  47   4.173  -0.163  14.090
  332   3HD1  LEU  47          3HD1      LEU  47   5.096   0.950  13.080
  333   1HD2  LEU  47          1HD2      LEU  47   5.416  -3.161  12.196
  334   2HD2  LEU  47          2HD2      LEU  47   3.910  -2.766  13.026
  335   3HD2  LEU  47          3HD2      LEU  47   5.456  -2.513  13.836
  336    H    SER  48           H        SER  48   1.903  -1.117   8.634
  337    HA   SER  48           HA       SER  48  -0.331  -1.777   8.228
  338   1HB   SER  48          1HB       SER  48   1.170  -3.836   7.789
  339   2HB   SER  48          2HB       SER  48   0.591  -4.429   9.345
  340    HG   SER  48           HG       SER  48  -0.719  -5.167   7.644
  341    H    GLN  49           H        GLN  49   0.161  -0.567  10.805
  342    HA   GLN  49           HA       GLN  49  -0.878  -0.323  12.915
  343   1HB   GLN  49          1HB       GLN  49  -2.761  -0.376  11.166
  344   2HB   GLN  49          2HB       GLN  49  -3.023  -2.049  11.658
  345   1HG   GLN  49          1HG       GLN  49  -3.714  -1.444  13.810
  346   2HG   GLN  49          2HG       GLN  49  -2.886   0.111  13.744
  347   1HE2  GLN  49          1HE2      GLN  49  -5.757  -1.645  12.558
  348   2HE2  GLN  49          2HE2      GLN  49  -6.632  -0.256  12.127
  349    H    MET  50           H        MET  50   0.945  -1.969  13.547
  350    HA   MET  50           HA       MET  50   1.579  -3.871  14.801
  351   1HB   MET  50          1HB       MET  50  -0.472  -2.650  15.994
  352   2HB   MET  50          2HB       MET  50  -1.290  -4.162  15.605
  353   1HG   MET  50          1HG       MET  50   0.077  -5.418  16.994
  354   2HG   MET  50          2HG       MET  50   1.433  -4.299  16.843
  355   1HE   MET  50          1HE       MET  50  -0.577  -5.866  18.993
  356   2HE   MET  50          2HE       MET  50  -0.736  -4.854  20.426
  357   3HE   MET  50          3HE       MET  50   0.867  -5.281  19.832
  358   1H    GLY  51          1H        GLY  51 -14.119  -1.970  12.547
  359   2H    GLY  51          2H        GLY  51 -14.900  -3.357  11.955
  360   3H    GLY  51          3H        GLY  51 -15.357  -1.818  11.399
  361   1HA   GLY  51          1HA       GLY  51 -13.569  -1.594  10.032
  362   2HA   GLY  51          2HA       GLY  51 -12.571  -2.646  11.038
  363    H    THR  52           H        THR  52 -13.580  -2.635   8.067
  364    HA   THR  52           HA       THR  52 -14.802  -5.348   7.980
  365    HB   THR  52           HB       THR  52 -15.769  -3.479   6.680
  366    HG1  THR  52           HG1      THR  52 -15.563  -4.537   4.587
  367   1HG2  THR  52          1HG2      THR  52 -13.017  -2.928   6.176
  368   2HG2  THR  52          2HG2      THR  52 -14.423  -1.980   5.688
  369   3HG2  THR  52          3HG2      THR  52 -13.797  -3.240   4.625
  370    HA   PRO  53           HA       PRO  53 -10.944  -7.201   6.912
  371   1HB   PRO  53          1HB       PRO  53 -11.821  -9.344   5.454
  372   2HB   PRO  53          2HB       PRO  53 -11.961  -9.254   7.219
  373   1HG   PRO  53          1HG       PRO  53 -14.017  -8.756   5.119
  374   2HG   PRO  53          2HG       PRO  53 -14.180  -9.557   6.687
  375   1HD   PRO  53          1HD       PRO  53 -14.969  -6.985   6.208
  376   2HD   PRO  53          2HD       PRO  53 -14.469  -7.578   7.806
  377    HA   PRO  54           HA       PRO  54  -9.964  -5.675   2.886
  378   1HB   PRO  54          1HB       PRO  54  -7.734  -7.167   2.320
  379   2HB   PRO  54          2HB       PRO  54  -7.731  -5.817   3.471
  380   1HG   PRO  54          1HG       PRO  54  -7.898  -8.753   3.985
  381   2HG   PRO  54          2HG       PRO  54  -6.975  -7.513   4.846
  382   1HD   PRO  54          1HD       PRO  54  -9.320  -8.511   5.774
  383   2HD   PRO  54          2HD       PRO  54  -8.792  -6.843   6.089
  384    HA   PRO  55           HA       PRO  55 -11.501  -8.415  -0.189
  385   1HB   PRO  55          1HB       PRO  55  -9.851  -8.031  -2.346
  386   2HB   PRO  55          2HB       PRO  55 -11.044  -6.829  -1.812
  387   1HG   PRO  55          1HG       PRO  55  -8.109  -6.930  -1.314
  388   2HG   PRO  55          2HG       PRO  55  -9.137  -5.545  -1.709
  389   1HD   PRO  55          1HD       PRO  55  -8.282  -6.081   0.810
  390   2HD   PRO  55          2HD       PRO  55  -9.834  -5.284   0.471
  391    HA   PRO  56           HA       PRO  56  -9.228 -12.192  -0.065
  392   1HB   PRO  56          1HB       PRO  56 -10.193 -13.490  -2.278
  393   2HB   PRO  56          2HB       PRO  56 -11.143 -13.278  -0.792
  394   1HG   PRO  56          1HG       PRO  56 -11.252 -11.745  -3.344
  395   2HG   PRO  56          2HG       PRO  56 -12.571 -12.271  -2.285
  396   1HD   PRO  56          1HD       PRO  56 -11.608  -9.727  -2.311
  397   2HD   PRO  56          2HD       PRO  56 -12.334 -10.482  -0.875
  398    H    TYR  57           H        TYR  57  -7.054 -12.075  -0.539
  399    HA   TYR  57           HA       TYR  57  -5.821 -10.771  -2.684
  400   1HB   TYR  57          1HB       TYR  57  -4.796 -11.728  -0.588
  401   2HB   TYR  57          2HB       TYR  57  -4.868 -13.319  -1.345
  402    HD1  TYR  57           HD1      TYR  57  -3.043 -10.233  -1.086
  403    HD2  TYR  57           HD2      TYR  57  -3.719 -13.633  -3.615
  404    HE1  TYR  57           HE1      TYR  57  -0.953  -9.727  -2.314
  405    HE2  TYR  57           HE2      TYR  57  -1.625 -13.133  -4.846
  406    HH   TYR  57           HH       TYR  57   0.307 -10.246  -4.094
  407    H    THR  58           H        THR  58  -4.950 -11.512  -4.692
  408    HA   THR  58           HA       THR  58  -5.640 -14.197  -5.694
  409    HB   THR  58           HB       THR  58  -7.725 -12.935  -5.962
  410    HG1  THR  58           HG1      THR  58  -7.921 -13.186  -8.181
  411   1HG2  THR  58          1HG2      THR  58  -5.856 -10.901  -7.147
  412   2HG2  THR  58          2HG2      THR  58  -7.118 -10.674  -5.936
  413   3HG2  THR  58          3HG2      THR  58  -7.553 -10.933  -7.626
  414    H    VAL  59           H        VAL  59  -5.450 -13.174  -8.495
  415    HA   VAL  59           HA       VAL  59  -2.857 -11.823  -8.716
  416    HB   VAL  59           HB       VAL  59  -2.232 -14.103  -8.013
  417   1HG1  VAL  59          1HG1      VAL  59  -3.065 -15.466 -10.445
  418   2HG1  VAL  59          2HG1      VAL  59  -4.452 -14.835  -9.557
  419   3HG1  VAL  59          3HG1      VAL  59  -3.322 -15.931  -8.763
  420   1HG2  VAL  59          1HG2      VAL  59  -1.671 -13.994 -10.966
  421   2HG2  VAL  59          2HG2      VAL  59  -0.588 -14.442  -9.648
  422   3HG2  VAL  59          3HG2      VAL  59  -1.018 -12.750  -9.900
  423    H    GLY  60           H        GLY  60  -2.577 -11.028 -10.823
  424   1HA   GLY  60          1HA       GLY  60  -3.088 -10.580 -13.073
  425   2HA   GLY  60          2HA       GLY  60  -3.889 -12.151 -13.135
  Start of MODEL   14
    1    H    PHE   5           H        PHE   5  -3.462  12.682   7.611
    2    HA   PHE   5           HA       PHE   5  -2.418  13.019   5.020
    3   1HB   PHE   5          1HB       PHE   5  -1.734  11.796   7.491
    4   2HB   PHE   5          2HB       PHE   5  -1.453  10.589   6.236
    5    HD1  PHE   5           HD1      PHE   5  -1.039  14.311   6.564
    6    HD2  PHE   5           HD2      PHE   5   0.713  10.567   5.399
    7    HE1  PHE   5           HE1      PHE   5   1.036  15.492   5.890
    8    HE2  PHE   5           HE2      PHE   5   2.787  11.747   4.724
    9    HZ   PHE   5           HZ       PHE   5   2.949  14.209   4.970
   10    H    GLU   6           H        GLU   6  -3.778   9.983   6.373
   11    HA   GLU   6           HA       GLU   6  -4.725   8.119   5.267
   12   1HB   GLU   6          1HB       GLU   6  -6.180  10.224   4.724
   13   2HB   GLU   6          2HB       GLU   6  -5.474  10.089   3.113
   14   1HG   GLU   6          1HG       GLU   6  -7.217   8.668   2.738
   15   2HG   GLU   6          2HG       GLU   6  -6.189   7.498   3.567
   16    H    ILE   7           H        ILE   7  -2.063   8.102   4.816
   17    HA   ILE   7           HA       ILE   7  -0.406   7.338   3.319
   18    HB   ILE   7           HB       ILE   7  -2.858   6.635   1.674
   19   1HG1  ILE   7          1HG1      ILE   7  -3.063   5.824   4.000
   20   2HG1  ILE   7          2HG1      ILE   7  -2.789   4.480   2.891
   21   1HG2  ILE   7          1HG2      ILE   7  -1.480   5.387   0.372
   22   2HG2  ILE   7          2HG2      ILE   7  -0.539   4.828   1.753
   23   3HG2  ILE   7          3HG2      ILE   7  -0.192   6.396   1.028
   24   1HD1  ILE   7          1HD1      ILE   7  -1.129   5.423   5.096
   25   2HD1  ILE   7          2HD1      ILE   7  -0.219   5.316   3.590
   26   3HD1  ILE   7          3HD1      ILE   7  -1.056   3.896   4.217
   27    HA   PRO   8           HA       PRO   8  -0.443  11.109   0.793
   28   1HB   PRO   8          1HB       PRO   8   2.283  11.291   0.578
   29   2HB   PRO   8          2HB       PRO   8   1.379  11.882   1.986
   30   1HG   PRO   8          1HG       PRO   8   2.896   9.336   1.630
   31   2HG   PRO   8          2HG       PRO   8   2.806  10.407   3.039
   32   1HD   PRO   8          1HD       PRO   8   1.404   8.090   2.852
   33   2HD   PRO   8          2HD       PRO   8   0.832   9.499   3.772
   34    H    ASP   9           H        ASP   9   1.333  11.452  -1.264
   35    HA   ASP   9           HA       ASP   9   1.389   8.887  -2.794
   36   1HB   ASP   9          1HB       ASP   9  -0.644  10.675  -3.029
   37   2HB   ASP   9          2HB       ASP   9   0.478  11.323  -4.225
   38    H    ASP  10           H        ASP  10   3.765   9.299  -2.236
   39    HA   ASP  10           HA       ASP  10   4.975  11.374  -4.028
   40   1HB   ASP  10          1HB       ASP  10   6.944  11.069  -2.484
   41   2HB   ASP  10          2HB       ASP  10   5.490  11.639  -1.665
   42    H    VAL  11           H        VAL  11   5.306   7.980  -2.949
   43    HA   VAL  11           HA       VAL  11   7.015   7.440  -5.334
   44    HB   VAL  11           HB       VAL  11   7.651   5.452  -3.970
   45   1HG1  VAL  11          1HG1      VAL  11   8.290   7.207  -1.894
   46   2HG1  VAL  11          2HG1      VAL  11   8.120   8.241  -3.313
   47   3HG1  VAL  11          3HG1      VAL  11   9.261   6.897  -3.333
   48   1HG2  VAL  11          1HG2      VAL  11   5.271   6.061  -2.611
   49   2HG2  VAL  11          2HG2      VAL  11   6.569   6.394  -1.464
   50   3HG2  VAL  11          3HG2      VAL  11   6.431   4.797  -2.200
   51    HA   PRO  12           HA       PRO  12   3.750   5.021  -7.030
   52   1HB   PRO  12          1HB       PRO  12   5.138   3.075  -8.360
   53   2HB   PRO  12          2HB       PRO  12   5.035   4.752  -8.926
   54   1HG   PRO  12          1HG       PRO  12   7.235   3.373  -7.463
   55   2HG   PRO  12          2HG       PRO  12   7.323   4.558  -8.774
   56   1HD   PRO  12          1HD       PRO  12   7.733   5.170  -6.140
   57   2HD   PRO  12          2HD       PRO  12   7.144   6.337  -7.342
   58    H    LEU  13           H        LEU  13   5.822   2.210  -6.771
   59    HA   LEU  13           HA       LEU  13   4.562   1.307  -4.244
   60   1HB   LEU  13          1HB       LEU  13   3.979   0.325  -7.018
   61   2HB   LEU  13          2HB       LEU  13   4.015  -0.861  -5.716
   62    HG   LEU  13           HG       LEU  13   2.346   1.670  -5.676
   63   1HD1  LEU  13          1HD1      LEU  13   0.819   0.574  -6.901
   64   2HD1  LEU  13          2HD1      LEU  13   0.799  -0.732  -5.717
   65   3HD1  LEU  13          3HD1      LEU  13   1.932  -0.783  -7.067
   66   1HD2  LEU  13          1HD2      LEU  13   1.729   1.092  -3.566
   67   2HD2  LEU  13          2HD2      LEU  13   3.203   0.129  -3.567
   68   3HD2  LEU  13          3HD2      LEU  13   1.662  -0.623  -3.963
   69    HA   PRO  14           HA       PRO  14   8.563  -0.598  -4.171
   70   1HB   PRO  14          1HB       PRO  14   8.247  -2.190  -1.971
   71   2HB   PRO  14          2HB       PRO  14   8.489  -0.437  -1.880
   72   1HG   PRO  14          1HG       PRO  14   6.033  -2.029  -1.510
   73   2HG   PRO  14          2HG       PRO  14   6.489  -0.477  -0.804
   74   1HD   PRO  14          1HD       PRO  14   4.716  -0.878  -2.928
   75   2HD   PRO  14          2HD       PRO  14   5.423   0.669  -2.440
   76    H    ALA  15           H        ALA  15   9.484  -2.958  -3.995
   77    HA   ALA  15           HA       ALA  15   8.394  -4.547  -6.089
   78   1HB   ALA  15          1HB       ALA  15  10.311  -5.083  -3.809
   79   2HB   ALA  15          2HB       ALA  15  10.709  -4.675  -5.478
   80   3HB   ALA  15          3HB       ALA  15  10.016  -6.251  -5.096
   81    H    GLY  16           H        GLY  16   7.023  -6.339  -6.074
   82   1HA   GLY  16          1HA       GLY  16   5.325  -7.729  -5.313
   83   2HA   GLY  16          2HA       GLY  16   6.330  -7.951  -3.883
   84    H    TRP  17           H        TRP  17   4.851  -4.936  -5.044
   85    HA   TRP  17           HA       TRP  17   2.965  -5.027  -2.746
   86   1HB   TRP  17          1HB       TRP  17   5.327  -3.256  -3.170
   87   2HB   TRP  17          2HB       TRP  17   3.889  -2.544  -2.437
   88    HD1  TRP  17           HD1      TRP  17   6.930  -4.184  -1.430
   89    HE1  TRP  17           HE1      TRP  17   6.708  -5.246   0.913
   90    HE3  TRP  17           HE3      TRP  17   1.873  -4.143  -0.942
   91    HZ2  TRP  17           HZ2      TRP  17   4.628  -5.980   2.753
   92    HZ3  TRP  17           HZ3      TRP  17   0.780  -5.018   1.097
   93    HH2  TRP  17           HH2      TRP  17   2.153  -5.943   2.948
   94    H    GLU  18           H        GLU  18   1.573  -5.276  -4.769
   95    HA   GLU  18           HA       GLU  18   1.183  -2.860  -6.426
   96   1HB   GLU  18          1HB       GLU  18   0.845  -5.552  -6.782
   97   2HB   GLU  18          2HB       GLU  18  -0.805  -5.054  -6.392
   98   1HG   GLU  18          1HG       GLU  18  -1.065  -4.043  -8.390
   99   2HG   GLU  18          2HG       GLU  18   0.482  -3.207  -8.248
  100    H    MET  19           H        MET  19  -1.523  -2.778  -6.622
  101    HA   MET  19           HA       MET  19  -2.868  -2.738  -4.062
  102   1HB   MET  19          1HB       MET  19  -2.939  -0.337  -3.754
  103   2HB   MET  19          2HB       MET  19  -1.263  -0.865  -3.844
  104   1HG   MET  19          1HG       MET  19  -0.978   0.004  -6.018
  105   2HG   MET  19          2HG       MET  19  -2.713   0.069  -6.317
  106   1HE   MET  19          1HE       MET  19  -0.094   3.380  -5.133
  107   2HE   MET  19          2HE       MET  19  -0.121   2.219  -6.457
  108   3HE   MET  19          3HE       MET  19   0.397   1.704  -4.854
  109    H    ALA  20           H        ALA  20  -5.065  -2.249  -4.267
  110    HA   ALA  20           HA       ALA  20  -6.095  -1.410  -6.913
  111   1HB   ALA  20          1HB       ALA  20  -6.106  -3.618  -7.484
  112   2HB   ALA  20          2HB       ALA  20  -7.519  -3.712  -6.433
  113   3HB   ALA  20          3HB       ALA  20  -5.926  -4.140  -5.810
  114    H    LYS  21           H        LYS  21  -8.602  -1.366  -6.760
  115    HA   LYS  21           HA       LYS  21  -9.324  -0.266  -4.092
  116   1HB   LYS  21          1HB       LYS  21 -11.150   0.783  -5.353
  117   2HB   LYS  21          2HB       LYS  21  -9.616   1.067  -6.172
  118   1HG   LYS  21          1HG       LYS  21 -10.078  -0.670  -7.785
  119   2HG   LYS  21          2HG       LYS  21 -11.498  -1.199  -6.885
  120   1HD   LYS  21          1HD       LYS  21 -12.800   0.450  -7.745
  121   2HD   LYS  21          2HD       LYS  21 -11.526   1.659  -7.589
  122   1HE   LYS  21          1HE       LYS  21 -11.494  -0.489  -9.733
  123   2HE   LYS  21          2HE       LYS  21 -12.171   1.130  -9.990
  124   1HZ   LYS  21          1HZ       LYS  21  -9.987   1.954  -9.010
  125   2HZ   LYS  21          2HZ       LYS  21  -9.924   1.325 -10.587
  126   3HZ   LYS  21          3HZ       LYS  21  -9.392   0.387  -9.274
  127    H    THR  22           H        THR  22 -11.004  -1.133  -2.863
  128    HA   THR  22           HA       THR  22 -12.079  -3.765  -3.791
  129    HB   THR  22           HB       THR  22 -12.310  -2.707  -0.995
  130    HG1  THR  22           HG1      THR  22 -10.240  -2.459  -0.943
  131   1HG2  THR  22          1HG2      THR  22 -13.279  -4.843  -1.332
  132   2HG2  THR  22          2HG2      THR  22 -11.717  -5.167  -0.583
  133   3HG2  THR  22          3HG2      THR  22 -11.925  -5.388  -2.321
  134    H    SER  23           H        SER  23 -14.231  -3.814  -4.345
  135    HA   SER  23           HA       SER  23 -16.510  -3.222  -4.481
  136   1HB   SER  23          1HB       SER  23 -15.597  -2.781  -1.807
  137   2HB   SER  23          2HB       SER  23 -16.713  -1.481  -2.220
  138    HG   SER  23           HG       SER  23 -18.237  -3.021  -2.806
  139    H    SER  24           H        SER  24 -15.318  -0.233  -2.907
  140    HA   SER  24           HA       SER  24 -16.303   1.270  -5.299
  141   1HB   SER  24          1HB       SER  24 -16.159   1.713  -2.348
  142   2HB   SER  24          2HB       SER  24 -16.071   3.132  -3.392
  143    HG   SER  24           HG       SER  24 -18.224   2.584  -2.832
  144    H    GLY  25           H        GLY  25 -14.016   2.295  -2.778
  145   1HA   GLY  25          1HA       GLY  25 -11.877   2.493  -4.840
  146   2HA   GLY  25          2HA       GLY  25 -12.324   3.943  -3.951
  147    H    GLN  26           H        GLN  26 -12.572   1.063  -2.096
  148    HA   GLN  26           HA       GLN  26 -10.736   1.858  -0.104
  149   1HB   GLN  26          1HB       GLN  26 -11.493  -0.951  -0.979
  150   2HB   GLN  26          2HB       GLN  26 -10.939  -0.475   0.625
  151   1HG   GLN  26          1HG       GLN  26 -13.111   1.233  -0.038
  152   2HG   GLN  26          2HG       GLN  26 -13.610  -0.412  -0.434
  153   1HE2  GLN  26          1HE2      GLN  26 -11.450   0.797   2.191
  154   2HE2  GLN  26          2HE2      GLN  26 -12.358   0.118   3.453
  155    H    ARG  27           H        ARG  27  -8.728   2.543  -1.019
  156    HA   ARG  27           HA       ARG  27  -7.237   0.950  -2.916
  157   1HB   ARG  27          1HB       ARG  27  -7.173   3.521  -1.777
  158   2HB   ARG  27          2HB       ARG  27  -5.646   2.772  -1.320
  159   1HG   ARG  27          1HG       ARG  27  -5.550   2.012  -3.812
  160   2HG   ARG  27          2HG       ARG  27  -6.746   3.286  -4.075
  161   1HD   ARG  27          1HD       ARG  27  -4.553   4.231  -2.401
  162   2HD   ARG  27          2HD       ARG  27  -3.969   3.638  -3.967
  163    HE   ARG  27           HE       ARG  27  -5.681   5.966  -3.553
  164   1HH1  ARG  27          1HH1      ARG  27  -4.840   3.379  -5.727
  165   2HH1  ARG  27          2HH1      ARG  27  -5.371   4.239  -7.131
  166   1HH2  ARG  27          1HH2      ARG  27  -6.363   7.061  -5.390
  167   2HH2  ARG  27          2HH2      ARG  27  -6.227   6.307  -6.945
  168    H    TYR  28           H        TYR  28  -6.697  -1.114  -2.183
  169    HA   TYR  28           HA       TYR  28  -5.174  -1.249   0.394
  170   1HB   TYR  28          1HB       TYR  28  -5.905  -3.570   0.497
  171   2HB   TYR  28          2HB       TYR  28  -7.309  -2.543   0.233
  172    HD1  TYR  28           HD1      TYR  28  -8.407  -2.447  -1.966
  173    HD2  TYR  28           HD2      TYR  28  -5.116  -5.098  -1.224
  174    HE1  TYR  28           HE1      TYR  28  -9.023  -3.763  -3.969
  175    HE2  TYR  28           HE2      TYR  28  -5.734  -6.417  -3.228
  176    HH   TYR  28           HH       TYR  28  -7.183  -5.628  -5.573
  177    H    PHE  29           H        PHE  29  -3.047  -1.802   0.218
  178    HA   PHE  29           HA       PHE  29  -1.937  -2.195  -2.460
  179   1HB   PHE  29          1HB       PHE  29  -0.761  -2.020   0.329
  180   2HB   PHE  29          2HB       PHE  29   0.203  -2.073  -1.150
  181    HD1  PHE  29           HD1      PHE  29  -2.285  -0.111   0.769
  182    HD2  PHE  29           HD2      PHE  29   0.319  -0.171  -2.642
  183    HE1  PHE  29           HE1      PHE  29  -2.671   2.309   0.436
  184    HE2  PHE  29           HE2      PHE  29  -0.061   2.251  -2.974
  185    HZ   PHE  29           HZ       PHE  29  -1.559   3.494  -1.437
  186    H    LYS  30           H        LYS  30  -1.800  -4.126  -3.351
  187    HA   LYS  30           HA       LYS  30  -2.088  -6.616  -1.884
  188   1HB   LYS  30          1HB       LYS  30  -1.489  -5.791  -4.727
  189   2HB   LYS  30          2HB       LYS  30  -1.695  -7.478  -4.253
  190   1HG   LYS  30          1HG       LYS  30  -3.849  -6.032  -3.133
  191   2HG   LYS  30          2HG       LYS  30  -3.682  -5.464  -4.786
  192   1HD   LYS  30          1HD       LYS  30  -3.337  -8.249  -4.942
  193   2HD   LYS  30          2HD       LYS  30  -4.684  -8.017  -3.828
  194   1HE   LYS  30          1HE       LYS  30  -5.891  -7.890  -5.791
  195   2HE   LYS  30          2HE       LYS  30  -5.333  -6.206  -5.766
  196   1HZ   LYS  30          1HZ       LYS  30  -3.683  -8.395  -6.895
  197   2HZ   LYS  30          2HZ       LYS  30  -3.519  -6.721  -7.137
  198   3HZ   LYS  30          3HZ       LYS  30  -4.814  -7.562  -7.846
  199    H    ASN  31           H        ASN  31  -0.445  -8.034  -1.370
  200    HA   ASN  31           HA       ASN  31   2.356  -7.071  -1.838
  201   1HB   ASN  31          1HB       ASN  31   1.226  -7.316   0.498
  202   2HB   ASN  31          2HB       ASN  31   1.442  -9.047   0.248
  203   1HD2  ASN  31          1HD2      ASN  31   2.978  -8.787   2.187
  204   2HD2  ASN  31          2HD2      ASN  31   4.576  -8.314   1.868
  205    H    HIS  32           H        HIS  32   3.329  -8.259  -3.473
  206    HA   HIS  32           HA       HIS  32   2.463 -11.082  -3.858
  207   1HB   HIS  32          1HB       HIS  32   4.352  -9.326  -5.457
  208   2HB   HIS  32          2HB       HIS  32   3.684 -10.870  -5.973
  209    HD1  HIS  32           HD1      HIS  32   1.109 -10.945  -6.504
  210    HD2  HIS  32           HD2      HIS  32   2.569  -7.127  -5.679
  211    HE1  HIS  32           HE1      HIS  32  -0.708  -9.317  -7.188
  212    H    ILE  33           H        ILE  33   4.460  -9.662  -1.773
  213    HA   ILE  33           HA       ILE  33   6.839 -11.402  -2.151
  214    HB   ILE  33           HB       ILE  33   6.275  -9.690   0.269
  215   1HG1  ILE  33          1HG1      ILE  33   7.342  -8.550  -2.332
  216   2HG1  ILE  33          2HG1      ILE  33   5.713  -8.257  -1.712
  217   1HG2  ILE  33          1HG2      ILE  33   8.812 -10.115  -1.324
  218   2HG2  ILE  33          2HG2      ILE  33   8.316 -11.147   0.019
  219   3HG2  ILE  33          3HG2      ILE  33   8.667  -9.441   0.299
  220   1HD1  ILE  33          1HD1      ILE  33   6.588  -7.253   0.301
  221   2HD1  ILE  33          2HD1      ILE  33   7.345  -6.464  -1.084
  222   3HD1  ILE  33          3HD1      ILE  33   8.239  -7.671  -0.157
  223    H    ASP  34           H        ASP  34   4.488 -10.591   0.377
  224    HA   ASP  34           HA       ASP  34   4.792 -13.271   1.585
  225   1HB   ASP  34          1HB       ASP  34   3.311 -10.756   2.418
  226   2HB   ASP  34          2HB       ASP  34   3.481 -12.202   3.413
  227    H    GLN  35           H        GLN  35   2.909 -11.792  -0.781
  228    HA   GLN  35           HA       GLN  35   0.934 -12.427  -1.878
  229   1HB   GLN  35          1HB       GLN  35   2.115 -14.728  -0.751
  230   2HB   GLN  35          2HB       GLN  35   0.399 -14.841  -0.363
  231   1HG   GLN  35          1HG       GLN  35  -0.198 -14.552  -2.706
  232   2HG   GLN  35          2HG       GLN  35   1.490 -14.274  -3.135
  233   1HE2  GLN  35          1HE2      GLN  35   1.880 -16.148  -4.412
  234   2HE2  GLN  35          2HE2      GLN  35   1.735 -17.731  -3.817
  235    H    THR  36           H        THR  36  -0.157 -10.607  -0.741
  236    HA   THR  36           HA       THR  36  -2.552 -11.446   0.628
  237    HB   THR  36           HB       THR  36  -1.519  -9.997   2.753
  238    HG1  THR  36           HG1      THR  36   0.484 -11.114   3.147
  239   1HG2  THR  36          1HG2      THR  36  -2.631 -12.482   2.289
  240   2HG2  THR  36          2HG2      THR  36  -2.171 -11.846   3.868
  241   3HG2  THR  36          3HG2      THR  36  -1.056 -12.878   2.973
  242    H    THR  37           H        THR  37  -3.980  -9.660   1.048
  243    HA   THR  37           HA       THR  37  -3.180  -7.114  -0.301
  244    HB   THR  37           HB       THR  37  -5.605  -6.819  -0.539
  245    HG1  THR  37           HG1      THR  37  -5.878  -9.225   0.922
  246   1HG2  THR  37          1HG2      THR  37  -4.295  -8.516  -1.985
  247   2HG2  THR  37          2HG2      THR  37  -6.056  -8.604  -2.005
  248   3HG2  THR  37          3HG2      THR  37  -5.127  -9.749  -1.038
  249    H    THR  38           H        THR  38  -2.981  -5.234   0.951
  250    HA   THR  38           HA       THR  38  -4.082  -5.341   3.741
  251    HB   THR  38           HB       THR  38  -1.594  -5.793   3.505
  252    HG1  THR  38           HG1      THR  38  -2.100  -3.373   4.859
  253   1HG2  THR  38          1HG2      THR  38  -0.146  -4.250   2.611
  254   2HG2  THR  38          2HG2      THR  38  -1.138  -2.879   3.103
  255   3HG2  THR  38          3HG2      THR  38  -1.574  -3.814   1.674
  256    H    TRP  39           H        TRP  39  -4.636  -3.259   4.645
  257    HA   TRP  39           HA       TRP  39  -5.664  -1.341   2.725
  258   1HB   TRP  39          1HB       TRP  39  -5.414  -1.428   5.746
  259   2HB   TRP  39          2HB       TRP  39  -6.273  -0.154   4.882
  260    HD1  TRP  39           HD1      TRP  39  -7.142  -3.003   6.729
  261    HE1  TRP  39           HE1      TRP  39  -9.283  -4.159   5.882
  262    HE3  TRP  39           HE3      TRP  39  -7.477  -0.932   2.074
  263    HZ2  TRP  39           HZ2      TRP  39 -10.920  -4.200   3.538
  264    HZ3  TRP  39           HZ3      TRP  39  -9.333  -1.552   0.556
  265    HH2  TRP  39           HH2      TRP  39 -11.054  -3.182   1.282
  266    H    GLN  40           H        GLN  40  -3.320  -1.008   5.418
  267    HA   GLN  40           HA       GLN  40  -2.343   1.558   4.827
  268   1HB   GLN  40          1HB       GLN  40  -1.424  -0.898   6.209
  269   2HB   GLN  40          2HB       GLN  40  -0.147   0.237   5.772
  270   1HG   GLN  40          1HG       GLN  40  -0.978   1.912   7.143
  271   2HG   GLN  40          2HG       GLN  40  -2.635   1.315   7.043
  272   1HE2  GLN  40          1HE2      GLN  40  -2.922  -0.971   8.125
  273   2HE2  GLN  40          2HE2      GLN  40  -2.086  -1.219   9.582
  274    H    ASP  41           H        ASP  41  -0.077   2.019   3.898
  275    HA   ASP  41           HA       ASP  41   0.206   0.524   1.326
  276   1HB   ASP  41          1HB       ASP  41   1.256   2.607   0.557
  277   2HB   ASP  41          2HB       ASP  41  -0.304   2.957   1.299
  278    HA   PRO  42           HA       PRO  42   4.148  -0.899   2.699
  279   1HB   PRO  42          1HB       PRO  42   5.230  -1.592   0.299
  280   2HB   PRO  42          2HB       PRO  42   3.947  -2.524   1.086
  281   1HG   PRO  42          1HG       PRO  42   3.801  -0.686  -1.218
  282   2HG   PRO  42          2HG       PRO  42   2.808  -2.091  -0.832
  283   1HD   PRO  42          1HD       PRO  42   2.116   0.604  -0.459
  284   2HD   PRO  42          2HD       PRO  42   1.266  -0.804   0.201
  285    H    ARG  43           H        ARG  43   3.742   2.058   1.360
  286    HA   ARG  43           HA       ARG  43   6.666   2.556   0.957
  287   1HB   ARG  43          1HB       ARG  43   4.240   4.191   0.148
  288   2HB   ARG  43          2HB       ARG  43   5.903   4.480  -0.350
  289   1HG   ARG  43          1HG       ARG  43   5.957   2.605  -1.746
  290   2HG   ARG  43          2HG       ARG  43   4.638   1.804  -0.898
  291   1HD   ARG  43          1HD       ARG  43   4.396   4.232  -2.711
  292   2HD   ARG  43          2HD       ARG  43   3.788   2.599  -3.030
  293    HE   ARG  43           HE       ARG  43   2.686   3.268  -0.569
  294   1HH1  ARG  43          1HH1      ARG  43   2.708   4.678  -3.751
  295   2HH1  ARG  43          2HH1      ARG  43   1.157   5.416  -3.554
  296   1HH2  ARG  43          1HH2      ARG  43   0.673   4.237  -0.338
  297   2HH2  ARG  43          2HH2      ARG  43   0.012   5.169  -1.637
  298    H    LYS  44           H        LYS  44   3.817   4.424   2.084
  299    HA   LYS  44           HA       LYS  44   5.412   6.108   3.824
  300   1HB   LYS  44          1HB       LYS  44   3.214   6.631   2.660
  301   2HB   LYS  44          2HB       LYS  44   2.424   5.597   3.851
  302   1HG   LYS  44          1HG       LYS  44   2.282   7.861   4.668
  303   2HG   LYS  44          2HG       LYS  44   3.483   7.026   5.652
  304   1HD   LYS  44          1HD       LYS  44   5.292   7.990   4.310
  305   2HD   LYS  44          2HD       LYS  44   4.117   8.768   3.250
  306   1HE   LYS  44          1HE       LYS  44   3.218   9.950   5.343
  307   2HE   LYS  44          2HE       LYS  44   4.682   9.377   6.165
  308   1HZ   LYS  44          1HZ       LYS  44   4.866  11.608   5.017
  309   2HZ   LYS  44          2HZ       LYS  44   4.748  10.769   3.543
  310   3HZ   LYS  44          3HZ       LYS  44   6.047  10.465   4.596
  311    H    ALA  45           H        ALA  45   3.130   3.413   4.412
  312    HA   ALA  45           HA       ALA  45   3.577   3.415   7.292
  313   1HB   ALA  45          1HB       ALA  45   2.508   0.954   6.470
  314   2HB   ALA  45          2HB       ALA  45   1.934   2.114   5.273
  315   3HB   ALA  45          3HB       ALA  45   1.592   2.371   6.983
  316    H    MET  46           H        MET  46   6.084   3.340   6.790
  317    HA   MET  46           HA       MET  46   6.933   0.466   6.610
  318   1HB   MET  46          1HB       MET  46   7.692   2.861   5.198
  319   2HB   MET  46          2HB       MET  46   9.087   2.242   6.081
  320   1HG   MET  46          1HG       MET  46   7.356   0.368   4.485
  321   2HG   MET  46          2HG       MET  46   8.605   1.319   3.683
  322   1HE   MET  46          1HE       MET  46  10.695   0.335   3.174
  323   2HE   MET  46          2HE       MET  46   9.584  -1.004   2.897
  324   3HE   MET  46          3HE       MET  46  11.129  -1.300   3.690
  325    H    LEU  47           H        LEU  47   7.451   3.596   8.212
  326    HA   LEU  47           HA       LEU  47   8.709   2.125  10.495
  327   1HB   LEU  47          1HB       LEU  47   9.646   4.606   9.033
  328   2HB   LEU  47          2HB       LEU  47  10.266   4.147  10.619
  329    HG   LEU  47           HG       LEU  47  10.275   2.227   8.285
  330   1HD1  LEU  47          1HD1      LEU  47  12.726   3.738   9.120
  331   2HD1  LEU  47          2HD1      LEU  47  11.583   4.518   8.026
  332   3HD1  LEU  47          3HD1      LEU  47  12.346   2.997   7.565
  333   1HD2  LEU  47          1HD2      LEU  47  10.566   1.212  10.470
  334   2HD2  LEU  47          2HD2      LEU  47  11.779   2.414  10.911
  335   3HD2  LEU  47          3HD2      LEU  47  12.130   1.226   9.654
  336    H    SER  48           H        SER  48   5.988   2.950  10.361
  337    HA   SER  48           HA       SER  48   5.611   5.560  11.585
  338   1HB   SER  48          1HB       SER  48   4.081   3.359  10.519
  339   2HB   SER  48          2HB       SER  48   3.415   3.835  12.081
  340    HG   SER  48           HG       SER  48   3.033   5.830  11.340
  341    H    GLN  49           H        GLN  49   6.295   2.346  12.773
  342    HA   GLN  49           HA       GLN  49   5.275   2.418  15.396
  343   1HB   GLN  49          1HB       GLN  49   6.663   0.673  13.968
  344   2HB   GLN  49          2HB       GLN  49   8.037   1.389  14.812
  345   1HG   GLN  49          1HG       GLN  49   5.569   0.378  16.248
  346   2HG   GLN  49          2HG       GLN  49   6.987  -0.630  15.957
  347   1HE2  GLN  49          1HE2      GLN  49   5.983   0.296  18.601
  348   2HE2  GLN  49          2HE2      GLN  49   7.239   1.208  19.288
  349    H    MET  50           H        MET  50   7.892   4.254  13.990
  350    HA   MET  50           HA       MET  50   8.724   5.210  16.704
  351   1HB   MET  50          1HB       MET  50  10.014   4.733  14.078
  352   2HB   MET  50          2HB       MET  50  10.559   6.177  14.932
  353   1HG   MET  50          1HG       MET  50  10.320   3.566  16.406
  354   2HG   MET  50          2HG       MET  50  11.741   3.886  15.413
  355   1HE   MET  50          1HE       MET  50  13.907   5.107  18.000
  356   2HE   MET  50          2HE       MET  50  13.599   4.261  16.486
  357   3HE   MET  50          3HE       MET  50  13.044   3.564  18.005
  358   1H    GLY  51          1H        GLY  51 -11.435  -1.459  10.167
  359   2H    GLY  51          2H        GLY  51 -11.488  -2.986  10.909
  360   3H    GLY  51          3H        GLY  51 -11.935  -1.598  11.782
  361   1HA   GLY  51          1HA       GLY  51 -14.002  -2.318  11.260
  362   2HA   GLY  51          2HA       GLY  51 -13.657  -1.366   9.815
  363    H    THR  52           H        THR  52 -13.750  -2.418   7.883
  364    HA   THR  52           HA       THR  52 -14.391  -5.275   7.832
  365    HB   THR  52           HB       THR  52 -15.473  -3.612   6.371
  366    HG1  THR  52           HG1      THR  52 -15.523  -5.008   4.803
  367   1HG2  THR  52          1HG2      THR  52 -14.299  -2.006   5.319
  368   2HG2  THR  52          2HG2      THR  52 -13.263  -3.203   4.539
  369   3HG2  THR  52          3HG2      THR  52 -12.862  -2.603   6.148
  370    HA   PRO  53           HA       PRO  53 -10.251  -6.669   7.185
  371   1HB   PRO  53          1HB       PRO  53 -10.763  -9.045   5.925
  372   2HB   PRO  53          2HB       PRO  53 -11.012  -8.800   7.664
  373   1HG   PRO  53          1HG       PRO  53 -12.995  -8.792   5.439
  374   2HG   PRO  53          2HG       PRO  53 -13.141  -9.449   7.076
  375   1HD   PRO  53          1HD       PRO  53 -14.226  -7.065   6.295
  376   2HD   PRO  53          2HD       PRO  53 -13.744  -7.425   7.965
  377    HA   PRO  54           HA       PRO  54  -9.089  -5.649   3.064
  378   1HB   PRO  54          1HB       PRO  54  -7.035  -7.384   2.536
  379   2HB   PRO  54          2HB       PRO  54  -6.878  -5.997   3.631
  380   1HG   PRO  54          1HG       PRO  54  -7.340  -8.878   4.267
  381   2HG   PRO  54          2HG       PRO  54  -6.281  -7.706   5.067
  382   1HD   PRO  54          1HD       PRO  54  -8.704  -8.416   6.059
  383   2HD   PRO  54          2HD       PRO  54  -8.005  -6.799   6.299
  384    HA   PRO  55           HA       PRO  55 -11.054  -8.353   0.205
  385   1HB   PRO  55          1HB       PRO  55  -9.640  -7.938  -2.106
  386   2HB   PRO  55          2HB       PRO  55 -10.763  -6.742  -1.429
  387   1HG   PRO  55          1HG       PRO  55  -7.794  -6.850  -1.269
  388   2HG   PRO  55          2HG       PRO  55  -8.861  -5.457  -1.496
  389   1HD   PRO  55          1HD       PRO  55  -7.705  -6.096   0.889
  390   2HD   PRO  55          2HD       PRO  55  -9.257  -5.240   0.755
  391    HA   PRO  56           HA       PRO  56  -8.824 -12.145  -0.063
  392   1HB   PRO  56          1HB       PRO  56  -9.862 -13.296  -2.321
  393   2HB   PRO  56          2HB       PRO  56 -10.768 -13.169  -0.799
  394   1HG   PRO  56          1HG       PRO  56 -10.937 -11.483  -3.249
  395   2HG   PRO  56          2HG       PRO  56 -12.229 -12.061  -2.185
  396   1HD   PRO  56          1HD       PRO  56 -11.239  -9.528  -2.088
  397   2HD   PRO  56          2HD       PRO  56 -11.936 -10.360  -0.681
  398    H    TYR  57           H        TYR  57  -6.710 -12.382  -0.709
  399    HA   TYR  57           HA       TYR  57  -5.401 -10.818  -2.633
  400   1HB   TYR  57          1HB       TYR  57  -4.509 -12.374  -0.785
  401   2HB   TYR  57          2HB       TYR  57  -4.646 -13.669  -1.977
  402    HD1  TYR  57           HD1      TYR  57  -2.895 -14.029  -3.493
  403    HD2  TYR  57           HD2      TYR  57  -3.275 -10.211  -1.571
  404    HE1  TYR  57           HE1      TYR  57  -0.782 -13.282  -4.552
  405    HE2  TYR  57           HE2      TYR  57  -1.165  -9.463  -2.628
  406    HH   TYR  57           HH       TYR  57   0.321  -9.953  -4.300
  407    H    THR  58           H        THR  58  -4.686 -11.266  -4.796
  408    HA   THR  58           HA       THR  58  -6.267 -13.373  -6.232
  409    HB   THR  58           HB       THR  58  -5.651 -10.491  -6.943
  410    HG1  THR  58           HG1      THR  58  -7.494 -10.311  -5.972
  411   1HG2  THR  58          1HG2      THR  58  -5.589 -11.310  -9.070
  412   2HG2  THR  58          2HG2      THR  58  -7.342 -11.333  -8.887
  413   3HG2  THR  58          3HG2      THR  58  -6.409 -12.807  -8.626
  414    H    VAL  59           H        VAL  59  -3.156 -12.220  -5.502
  415    HA   VAL  59           HA       VAL  59  -1.029 -12.724  -6.395
  416    HB   VAL  59           HB       VAL  59  -2.625 -14.879  -7.821
  417   1HG1  VAL  59          1HG1      VAL  59   0.017 -15.540  -6.768
  418   2HG1  VAL  59          2HG1      VAL  59   0.081 -14.222  -7.938
  419   3HG1  VAL  59          3HG1      VAL  59  -0.630 -15.772  -8.393
  420   1HG2  VAL  59          1HG2      VAL  59  -2.392 -16.239  -5.861
  421   2HG2  VAL  59          2HG2      VAL  59  -3.038 -14.692  -5.314
  422   3HG2  VAL  59          3HG2      VAL  59  -1.328 -15.062  -5.092
  423    H    GLY  60           H        GLY  60  -2.458 -10.677  -7.752
  424   1HA   GLY  60          1HA       GLY  60  -1.533  -9.569  -9.767
  425   2HA   GLY  60          2HA       GLY  60  -1.528 -11.146 -10.555
  Start of MODEL   15
    1    H    PHE   5           H        PHE   5  -8.034  10.517   4.980
    2    HA   PHE   5           HA       PHE   5  -6.821   8.130   3.626
    3   1HB   PHE   5          1HB       PHE   5  -8.734   9.009   2.351
    4   2HB   PHE   5          2HB       PHE   5  -8.035  10.628   2.398
    5    HD1  PHE   5           HD1      PHE   5  -6.646   7.209   1.697
    6    HD2  PHE   5           HD2      PHE   5  -7.182  11.243   0.321
    7    HE1  PHE   5           HE1      PHE   5  -5.313   6.696  -0.330
    8    HE2  PHE   5           HE2      PHE   5  -5.849  10.730  -1.705
    9    HZ   PHE   5           HZ       PHE   5  -4.914   8.456  -2.031
   10    H    GLU   6           H        GLU   6  -4.761   8.482   4.592
   11    HA   GLU   6           HA       GLU   6  -3.475  11.131   4.018
   12   1HB   GLU   6          1HB       GLU   6  -3.713   9.472   6.334
   13   2HB   GLU   6          2HB       GLU   6  -2.011   9.510   5.872
   14   1HG   GLU   6          1HG       GLU   6  -2.799  12.145   5.549
   15   2HG   GLU   6          2HG       GLU   6  -3.683  11.641   6.990
   16    H    ILE   7           H        ILE   7  -3.729   8.570   2.300
   17    HA   ILE   7           HA       ILE   7  -0.831   7.900   2.022
   18    HB   ILE   7           HB       ILE   7  -3.348   6.615   0.914
   19   1HG1  ILE   7          1HG1      ILE   7  -3.158   6.489   3.387
   20   2HG1  ILE   7          2HG1      ILE   7  -2.961   4.905   2.639
   21   1HG2  ILE   7          1HG2      ILE   7  -1.333   6.193  -0.454
   22   2HG2  ILE   7          2HG2      ILE   7  -1.854   4.728   0.379
   23   3HG2  ILE   7          3HG2      ILE   7  -0.475   5.644   0.984
   24   1HD1  ILE   7          1HD1      ILE   7  -1.068   6.434   4.240
   25   2HD1  ILE   7          2HD1      ILE   7  -0.377   5.972   2.685
   26   3HD1  ILE   7          3HD1      ILE   7  -1.014   4.736   3.768
   27    HA   PRO   8           HA       PRO   8  -0.778  10.368  -1.661
   28   1HB   PRO   8          1HB       PRO   8   1.492   9.356  -2.807
   29   2HB   PRO   8          2HB       PRO   8   1.520  10.467  -1.424
   30   1HG   PRO   8          1HG       PRO   8   1.850   7.507  -1.495
   31   2HG   PRO   8          2HG       PRO   8   2.679   8.710  -0.496
   32   1HD   PRO   8          1HD       PRO   8   0.637   7.133   0.406
   33   2HD   PRO   8          2HD       PRO   8   1.029   8.728   1.081
   34    H    ASP   9           H        ASP   9   0.111   9.512  -4.171
   35    HA   ASP   9           HA       ASP   9  -1.360   6.998  -4.794
   36   1HB   ASP   9          1HB       ASP   9  -2.457   9.584  -4.997
   37   2HB   ASP   9          2HB       ASP   9  -2.041   9.127  -6.648
   38    H    ASP  10           H        ASP  10   0.545   9.744  -6.056
   39    HA   ASP  10           HA       ASP  10   1.329   8.567  -8.532
   40   1HB   ASP  10          1HB       ASP  10   3.102  10.290  -8.420
   41   2HB   ASP  10          2HB       ASP  10   1.551  10.947  -7.896
   42    H    VAL  11           H        VAL  11   2.267   7.787  -5.293
   43    HA   VAL  11           HA       VAL  11   4.921   6.933  -5.526
   44    HB   VAL  11           HB       VAL  11   4.248   5.385  -3.694
   45   1HG1  VAL  11          1HG1      VAL  11   3.632   7.090  -2.167
   46   2HG1  VAL  11          2HG1      VAL  11   2.736   7.978  -3.400
   47   3HG1  VAL  11          3HG1      VAL  11   4.498   7.940  -3.448
   48   1HG2  VAL  11          1HG2      VAL  11   2.181   4.494  -3.797
   49   2HG2  VAL  11          2HG2      VAL  11   1.698   5.647  -5.041
   50   3HG2  VAL  11          3HG2      VAL  11   1.545   6.073  -3.337
   51    HA   PRO  12           HA       PRO  12   4.382   3.644  -8.504
   52   1HB   PRO  12          1HB       PRO  12   6.969   2.772  -8.540
   53   2HB   PRO  12          2HB       PRO  12   6.435   4.248  -9.364
   54   1HG   PRO  12          1HG       PRO  12   7.907   3.925  -6.810
   55   2HG   PRO  12          2HG       PRO  12   8.019   5.204  -8.024
   56   1HD   PRO  12          1HD       PRO  12   6.657   5.383  -5.609
   57   2HD   PRO  12          2HD       PRO  12   6.409   6.443  -7.012
   58    H    LEU  13           H        LEU  13   4.792   3.304  -5.220
   59    HA   LEU  13           HA       LEU  13   4.572   1.462  -3.763
   60   1HB   LEU  13          1HB       LEU  13   3.177   0.908  -6.166
   61   2HB   LEU  13          2HB       LEU  13   4.045  -0.571  -5.752
   62    HG   LEU  13           HG       LEU  13   3.108  -0.481  -3.471
   63   1HD1  LEU  13          1HD1      LEU  13   2.501   2.210  -4.283
   64   2HD1  LEU  13          2HD1      LEU  13   2.364   1.487  -2.680
   65   3HD1  LEU  13          3HD1      LEU  13   1.014   1.391  -3.809
   66   1HD2  LEU  13          1HD2      LEU  13   1.649  -0.933  -5.891
   67   2HD2  LEU  13          2HD2      LEU  13   0.552  -0.231  -4.701
   68   3HD2  LEU  13          3HD2      LEU  13   1.435  -1.709  -4.322
   69    HA   PRO  14           HA       PRO  14   8.486  -0.543  -4.188
   70   1HB   PRO  14          1HB       PRO  14   8.330  -2.247  -2.056
   71   2HB   PRO  14          2HB       PRO  14   8.609  -0.504  -1.902
   72   1HG   PRO  14          1HG       PRO  14   6.200  -2.075  -1.326
   73   2HG   PRO  14          2HG       PRO  14   6.697  -0.504  -0.701
   74   1HD   PRO  14          1HD       PRO  14   4.783  -1.041  -2.722
   75   2HD   PRO  14          2HD       PRO  14   5.359   0.543  -2.184
   76    H    ALA  15           H        ALA  15   9.387  -2.955  -4.107
   77    HA   ALA  15           HA       ALA  15   8.065  -4.427  -6.209
   78   1HB   ALA  15          1HB       ALA  15  10.565  -4.243  -5.364
   79   2HB   ALA  15          2HB       ALA  15   9.995  -5.737  -6.108
   80   3HB   ALA  15          3HB       ALA  15  10.105  -5.612  -4.352
   81    H    GLY  16           H        GLY  16   6.991  -6.491  -6.054
   82   1HA   GLY  16          1HA       GLY  16   5.567  -8.050  -5.076
   83   2HA   GLY  16          2HA       GLY  16   6.596  -7.944  -3.650
   84    H    TRP  17           H        TRP  17   5.058  -5.121  -4.997
   85    HA   TRP  17           HA       TRP  17   2.976  -5.178  -2.867
   86   1HB   TRP  17          1HB       TRP  17   5.312  -3.344  -3.225
   87   2HB   TRP  17          2HB       TRP  17   3.813  -2.681  -2.579
   88    HD1  TRP  17           HD1      TRP  17   6.881  -4.252  -1.458
   89    HE1  TRP  17           HE1      TRP  17   6.618  -5.184   0.942
   90    HE3  TRP  17           HE3      TRP  17   1.823  -4.130  -1.036
   91    HZ2  TRP  17           HZ2      TRP  17   4.504  -5.787   2.797
   92    HZ3  TRP  17           HZ3      TRP  17   0.692  -4.871   1.035
   93    HH2  TRP  17           HH2      TRP  17   2.023  -5.702   2.952
   94    H    GLU  18           H        GLU  18   1.261  -5.161  -4.348
   95    HA   GLU  18           HA       GLU  18   1.182  -2.944  -6.369
   96   1HB   GLU  18          1HB       GLU  18   0.790  -5.644  -6.648
   97   2HB   GLU  18          2HB       GLU  18  -0.859  -5.095  -6.354
   98   1HG   GLU  18          1HG       GLU  18  -0.297  -5.123  -8.772
   99   2HG   GLU  18          2HG       GLU  18  -0.706  -3.510  -8.198
  100    H    MET  19           H        MET  19  -1.476  -2.663  -6.666
  101    HA   MET  19           HA       MET  19  -2.911  -2.560  -4.148
  102   1HB   MET  19          1HB       MET  19  -2.835  -0.188  -3.808
  103   2HB   MET  19          2HB       MET  19  -1.176  -0.753  -3.964
  104   1HG   MET  19          1HG       MET  19  -1.140  -0.046  -6.320
  105   2HG   MET  19          2HG       MET  19  -2.819   0.474  -6.200
  106   1HE   MET  19          1HE       MET  19   0.568   1.068  -6.149
  107   2HE   MET  19          2HE       MET  19   0.908   2.641  -5.434
  108   3HE   MET  19          3HE       MET  19  -0.008   2.543  -6.935
  109    H    ALA  20           H        ALA  20  -5.058  -1.664  -4.417
  110    HA   ALA  20           HA       ALA  20  -5.993  -0.804  -7.030
  111   1HB   ALA  20          1HB       ALA  20  -5.885  -3.655  -6.190
  112   2HB   ALA  20          2HB       ALA  20  -5.828  -2.962  -7.810
  113   3HB   ALA  20          3HB       ALA  20  -7.375  -3.139  -6.982
  114    H    LYS  21           H        LYS  21  -8.542  -0.963  -6.980
  115    HA   LYS  21           HA       LYS  21  -9.381  -0.115  -4.250
  116   1HB   LYS  21          1HB       LYS  21 -10.205   0.393  -7.084
  117   2HB   LYS  21          2HB       LYS  21 -11.427   0.574  -5.827
  118   1HG   LYS  21          1HG       LYS  21 -10.497   2.719  -5.894
  119   2HG   LYS  21          2HG       LYS  21  -9.557   1.966  -4.607
  120   1HD   LYS  21          1HD       LYS  21  -7.710   2.495  -5.792
  121   2HD   LYS  21          2HD       LYS  21  -8.207   1.267  -6.956
  122   1HE   LYS  21          1HE       LYS  21  -9.422   4.017  -7.121
  123   2HE   LYS  21          2HE       LYS  21  -7.808   3.728  -7.799
  124   1HZ   LYS  21          1HZ       LYS  21 -10.198   2.042  -8.345
  125   2HZ   LYS  21          2HZ       LYS  21  -8.665   1.890  -9.063
  126   3HZ   LYS  21          3HZ       LYS  21  -9.629   3.250  -9.390
  127    H    THR  22           H        THR  22 -11.139  -1.097  -3.214
  128    HA   THR  22           HA       THR  22 -11.756  -3.850  -4.027
  129    HB   THR  22           HB       THR  22 -12.851  -3.903  -1.851
  130    HG1  THR  22           HG1      THR  22 -13.709  -2.164  -1.086
  131   1HG2  THR  22          1HG2      THR  22 -10.574  -2.094  -1.234
  132   2HG2  THR  22          2HG2      THR  22 -10.217  -3.523  -2.202
  133   3HG2  THR  22          3HG2      THR  22 -10.941  -3.699  -0.603
  134    H    SER  23           H        SER  23 -14.449  -3.807  -2.948
  135    HA   SER  23           HA       SER  23 -16.072  -3.627  -5.187
  136   1HB   SER  23          1HB       SER  23 -16.354  -4.169  -2.522
  137   2HB   SER  23          2HB       SER  23 -17.295  -2.685  -2.666
  138    HG   SER  23           HG       SER  23 -17.735  -5.195  -3.755
  139    H    SER  24           H        SER  24 -15.054  -0.935  -3.103
  140    HA   SER  24           HA       SER  24 -16.598   0.922  -4.885
  141   1HB   SER  24          1HB       SER  24 -15.872   0.910  -1.959
  142   2HB   SER  24          2HB       SER  24 -16.279   2.424  -2.769
  143    HG   SER  24           HG       SER  24 -18.280   1.864  -2.659
  144    H    GLY  25           H        GLY  25 -14.010   1.662  -2.581
  145   1HA   GLY  25          1HA       GLY  25 -11.997   2.016  -4.660
  146   2HA   GLY  25          2HA       GLY  25 -12.634   3.545  -4.066
  147    H    GLN  26           H        GLN  26 -12.421   0.790  -1.920
  148    HA   GLN  26           HA       GLN  26 -10.830   2.228   0.000
  149   1HB   GLN  26          1HB       GLN  26 -11.603  -0.669  -0.432
  150   2HB   GLN  26          2HB       GLN  26 -10.678  -0.146   0.972
  151   1HG   GLN  26          1HG       GLN  26 -12.504   1.518   1.465
  152   2HG   GLN  26          2HG       GLN  26 -13.446   0.784   0.167
  153   1HE2  GLN  26          1HE2      GLN  26 -12.632   0.523   3.502
  154   2HE2  GLN  26          2HE2      GLN  26 -13.327  -1.000   3.784
  155    H    ARG  27           H        ARG  27  -9.055   2.912  -1.483
  156    HA   ARG  27           HA       ARG  27  -7.343   1.338  -2.984
  157   1HB   ARG  27          1HB       ARG  27  -7.393   3.915  -1.857
  158   2HB   ARG  27          2HB       ARG  27  -5.848   3.222  -1.373
  159   1HG   ARG  27          1HG       ARG  27  -5.664   2.457  -3.844
  160   2HG   ARG  27          2HG       ARG  27  -6.932   3.649  -4.153
  161   1HD   ARG  27          1HD       ARG  27  -4.822   4.749  -2.458
  162   2HD   ARG  27          2HD       ARG  27  -4.188   4.179  -4.014
  163    HE   ARG  27           HE       ARG  27  -5.965   6.437  -3.649
  164   1HH1  ARG  27          1HH1      ARG  27  -5.237   3.753  -5.743
  165   2HH1  ARG  27          2HH1      ARG  27  -5.881   4.531  -7.147
  166   1HH2  ARG  27          1HH2      ARG  27  -6.795   7.426  -5.486
  167   2HH2  ARG  27          2HH2      ARG  27  -6.756   6.595  -7.005
  168    H    TYR  28           H        TYR  28  -6.735  -0.686  -2.254
  169    HA   TYR  28           HA       TYR  28  -5.234  -0.763   0.338
  170   1HB   TYR  28          1HB       TYR  28  -6.005  -3.021   0.582
  171   2HB   TYR  28          2HB       TYR  28  -7.407  -2.071   0.104
  172    HD1  TYR  28           HD1      TYR  28  -5.232  -4.819  -0.741
  173    HD2  TYR  28           HD2      TYR  28  -8.130  -2.094  -2.343
  174    HE1  TYR  28           HE1      TYR  28  -5.641  -6.366  -2.629
  175    HE2  TYR  28           HE2      TYR  28  -8.528  -3.632  -4.241
  176    HH   TYR  28           HH       TYR  28  -6.882  -5.597  -5.390
  177    H    PHE  29           H        PHE  29  -3.207  -1.922   0.288
  178    HA   PHE  29           HA       PHE  29  -2.082  -2.063  -2.468
  179   1HB   PHE  29          1HB       PHE  29  -0.835  -1.799   0.285
  180   2HB   PHE  29          2HB       PHE  29   0.081  -1.833  -1.224
  181    HD1  PHE  29           HD1      PHE  29  -2.769  -0.038   0.426
  182    HD2  PHE  29           HD2      PHE  29   0.454   0.169  -2.402
  183    HE1  PHE  29           HE1      PHE  29  -3.223   2.368   0.091
  184    HE2  PHE  29           HE2      PHE  29  -0.001   2.585  -2.731
  185    HZ   PHE  29           HZ       PHE  29  -1.837   3.681  -1.489
  186    H    LYS  30           H        LYS  30  -2.097  -4.032  -3.291
  187    HA   LYS  30           HA       LYS  30  -2.273  -6.508  -1.862
  188   1HB   LYS  30          1HB       LYS  30  -1.415  -5.688  -4.637
  189   2HB   LYS  30          2HB       LYS  30  -1.699  -7.365  -4.181
  190   1HG   LYS  30          1HG       LYS  30  -3.917  -5.857  -3.307
  191   2HG   LYS  30          2HG       LYS  30  -3.583  -5.324  -4.945
  192   1HD   LYS  30          1HD       LYS  30  -3.289  -8.106  -5.041
  193   2HD   LYS  30          2HD       LYS  30  -4.701  -7.854  -4.015
  194   1HE   LYS  30          1HE       LYS  30  -5.953  -7.319  -5.827
  195   2HE   LYS  30          2HE       LYS  30  -4.798  -6.052  -6.283
  196   1HZ   LYS  30          1HZ       LYS  30  -4.588  -8.962  -6.860
  197   2HZ   LYS  30          2HZ       LYS  30  -3.337  -7.848  -7.139
  198   3HZ   LYS  30          3HZ       LYS  30  -4.802  -7.718  -7.992
  199    H    ASN  31           H        ASN  31  -0.564  -8.111  -1.651
  200    HA   ASN  31           HA       ASN  31   2.215  -6.990  -1.808
  201   1HB   ASN  31          1HB       ASN  31   1.010  -7.154   0.489
  202   2HB   ASN  31          2HB       ASN  31   1.221  -8.894   0.314
  203   1HD2  ASN  31          1HD2      ASN  31   2.664  -8.468   2.336
  204   2HD2  ASN  31          2HD2      ASN  31   4.287  -8.063   2.043
  205    H    HIS  32           H        HIS  32   3.158  -8.219  -3.468
  206    HA   HIS  32           HA       HIS  32   2.358 -11.072  -3.702
  207   1HB   HIS  32          1HB       HIS  32   4.270  -9.381  -5.350
  208   2HB   HIS  32          2HB       HIS  32   3.606 -10.945  -5.807
  209    HD1  HIS  32           HD1      HIS  32   1.029 -11.032  -6.361
  210    HD2  HIS  32           HD2      HIS  32   2.511  -7.190  -5.707
  211    HE1  HIS  32           HE1      HIS  32  -0.771  -9.424  -7.140
  212    H    ILE  33           H        ILE  33   4.270  -9.577  -1.606
  213    HA   ILE  33           HA       ILE  33   6.817 -10.972  -1.884
  214    HB   ILE  33           HB       ILE  33   5.402  -9.508   0.382
  215   1HG1  ILE  33          1HG1      ILE  33   5.941  -8.035  -1.488
  216   2HG1  ILE  33          2HG1      ILE  33   7.069  -7.721  -0.168
  217   1HG2  ILE  33          1HG2      ILE  33   8.184 -10.670   0.165
  218   2HG2  ILE  33          2HG2      ILE  33   6.992 -10.921   1.442
  219   3HG2  ILE  33          3HG2      ILE  33   7.803  -9.363   1.287
  220   1HD1  ILE  33          1HD1      ILE  33   8.646  -9.392  -1.276
  221   2HD1  ILE  33          2HD1      ILE  33   8.414  -7.871  -2.140
  222   3HD1  ILE  33          3HD1      ILE  33   7.579  -9.328  -2.679
  223    H    ASP  34           H        ASP  34   4.089 -11.156   0.377
  224    HA   ASP  34           HA       ASP  34   4.666 -14.067   0.743
  225   1HB   ASP  34          1HB       ASP  34   3.793 -13.716   3.048
  226   2HB   ASP  34          2HB       ASP  34   5.176 -12.671   2.720
  227    H    GLN  35           H        GLN  35   2.814 -12.381  -1.090
  228    HA   GLN  35           HA       GLN  35   0.653 -12.565  -1.970
  229   1HB   GLN  35          1HB       GLN  35   0.707 -15.117  -0.326
  230   2HB   GLN  35          2HB       GLN  35  -0.339 -14.793  -1.708
  231   1HG   GLN  35          1HG       GLN  35   1.572 -14.664  -3.197
  232   2HG   GLN  35          2HG       GLN  35   2.690 -14.787  -1.839
  233   1HE2  GLN  35          1HE2      GLN  35  -0.237 -16.656  -2.862
  234   2HE2  GLN  35          2HE2      GLN  35   0.510 -18.174  -2.723
  235    H    THR  36           H        THR  36  -0.165 -10.737  -0.702
  236    HA   THR  36           HA       THR  36  -2.424 -11.402   0.984
  237    HB   THR  36           HB       THR  36  -1.062  -9.987   2.909
  238    HG1  THR  36           HG1      THR  36   0.998 -10.505   2.889
  239   1HG2  THR  36          1HG2      THR  36  -1.710 -11.796   4.064
  240   2HG2  THR  36          2HG2      THR  36  -0.517 -12.796   3.235
  241   3HG2  THR  36          3HG2      THR  36  -2.121 -12.576   2.538
  242    H    THR  37           H        THR  37  -3.766  -9.581   1.263
  243    HA   THR  37           HA       THR  37  -2.860  -7.081  -0.103
  244    HB   THR  37           HB       THR  37  -5.246  -6.675  -0.384
  245    HG1  THR  37           HG1      THR  37  -5.724  -8.987   1.166
  246   1HG2  THR  37          1HG2      THR  37  -5.793  -9.332  -1.009
  247   2HG2  THR  37          2HG2      THR  37  -4.041  -9.214  -1.155
  248   3HG2  THR  37          3HG2      THR  37  -5.077  -8.137  -2.086
  249    H    THR  38           H        THR  38  -2.564  -5.209   1.127
  250    HA   THR  38           HA       THR  38  -3.518  -5.307   3.971
  251    HB   THR  38           HB       THR  38  -1.024  -5.569   3.486
  252    HG1  THR  38           HG1      THR  38  -0.798  -4.738   5.386
  253   1HG2  THR  38          1HG2      THR  38  -0.940  -2.602   3.083
  254   2HG2  THR  38          2HG2      THR  38  -1.260  -3.630   1.687
  255   3HG2  THR  38          3HG2      THR  38   0.232  -3.830   2.603
  256    H    TRP  39           H        TRP  39  -3.753  -3.072   4.937
  257    HA   TRP  39           HA       TRP  39  -5.237  -1.336   3.090
  258   1HB   TRP  39          1HB       TRP  39  -4.830  -1.609   6.061
  259   2HB   TRP  39          2HB       TRP  39  -5.582  -0.155   5.405
  260    HD1  TRP  39           HD1      TRP  39  -6.720  -3.060   6.966
  261    HE1  TRP  39           HE1      TRP  39  -8.984  -3.897   6.069
  262    HE3  TRP  39           HE3      TRP  39  -6.908  -0.524   2.535
  263    HZ2  TRP  39           HZ2      TRP  39 -10.653  -3.544   3.777
  264    HZ3  TRP  39           HZ3      TRP  39  -8.843  -0.800   1.016
  265    HH2  TRP  39           HH2      TRP  39 -10.714  -2.307   1.632
  266    H    GLN  40           H        GLN  40  -3.029  -0.493   5.760
  267    HA   GLN  40           HA       GLN  40  -2.216   2.020   4.827
  268   1HB   GLN  40          1HB       GLN  40  -1.381  -0.007   6.739
  269   2HB   GLN  40          2HB       GLN  40   0.009   0.858   6.085
  270   1HG   GLN  40          1HG       GLN  40  -0.925   2.989   6.727
  271   2HG   GLN  40          2HG       GLN  40  -2.461   2.241   7.168
  272   1HE2  GLN  40          1HE2      GLN  40  -2.529   2.481   9.431
  273   2HE2  GLN  40          2HE2      GLN  40  -1.299   1.971  10.484
  274    H    ASP  41           H        ASP  41  -1.119   2.600   2.998
  275    HA   ASP  41           HA       ASP  41  -0.096   0.825   1.061
  276   1HB   ASP  41          1HB       ASP  41   0.923   2.851   0.136
  277   2HB   ASP  41          2HB       ASP  41  -0.661   3.246   0.799
  278    HA   PRO  42           HA       PRO  42   3.757  -0.508   2.730
  279   1HB   PRO  42          1HB       PRO  42   5.177  -0.923   0.428
  280   2HB   PRO  42          2HB       PRO  42   3.885  -2.006   0.977
  281   1HG   PRO  42          1HG       PRO  42   3.810   0.149  -1.083
  282   2HG   PRO  42          2HG       PRO  42   3.064  -1.455  -1.108
  283   1HD   PRO  42          1HD       PRO  42   1.692   0.826  -0.542
  284   2HD   PRO  42          2HD       PRO  42   1.250  -0.763   0.116
  285    H    ARG  43           H        ARG  43   3.493   2.331   0.764
  286    HA   ARG  43           HA       ARG  43   6.310   3.140   1.129
  287   1HB   ARG  43          1HB       ARG  43   4.026   3.788  -0.529
  288   2HB   ARG  43          2HB       ARG  43   4.708   5.259   0.165
  289   1HG   ARG  43          1HG       ARG  43   6.163   5.111  -1.587
  290   2HG   ARG  43          2HG       ARG  43   6.983   3.938  -0.556
  291   1HD   ARG  43          1HD       ARG  43   5.000   2.414  -1.768
  292   2HD   ARG  43          2HD       ARG  43   5.532   3.499  -3.067
  293    HE   ARG  43           HE       ARG  43   7.126   1.392  -1.873
  294   1HH1  ARG  43          1HH1      ARG  43   7.258   4.613  -3.188
  295   2HH1  ARG  43          2HH1      ARG  43   8.917   4.473  -3.654
  296   1HH2  ARG  43          1HH2      ARG  43   9.280   1.235  -2.487
  297   2HH2  ARG  43          2HH2      ARG  43  10.055   2.575  -3.262
  298    H    LYS  44           H        LYS  44   3.433   5.165   1.635
  299    HA   LYS  44           HA       LYS  44   4.506   6.765   3.682
  300   1HB   LYS  44          1HB       LYS  44   2.297   6.830   2.253
  301   2HB   LYS  44          2HB       LYS  44   1.605   5.976   3.631
  302   1HG   LYS  44          1HG       LYS  44   1.244   8.174   4.285
  303   2HG   LYS  44          2HG       LYS  44   2.829   7.891   5.003
  304   1HD   LYS  44          1HD       LYS  44   3.699   8.716   2.647
  305   2HD   LYS  44          2HD       LYS  44   2.109   9.475   2.559
  306   1HE   LYS  44          1HE       LYS  44   3.626   9.827   5.110
  307   2HE   LYS  44          2HE       LYS  44   4.196  10.731   3.694
  308   1HZ   LYS  44          1HZ       LYS  44   1.778  11.304   3.322
  309   2HZ   LYS  44          2HZ       LYS  44   2.510  12.050   4.662
  310   3HZ   LYS  44          3HZ       LYS  44   1.476  10.720   4.884
  311    H    ALA  45           H        ALA  45   2.575   3.771   3.997
  312    HA   ALA  45           HA       ALA  45   3.241   3.725   6.917
  313   1HB   ALA  45          1HB       ALA  45   1.306   2.074   6.921
  314   2HB   ALA  45          2HB       ALA  45   1.082   2.450   5.212
  315   3HB   ALA  45          3HB       ALA  45   0.878   3.712   6.426
  316    H    MET  46           H        MET  46   5.358   2.767   6.681
  317    HA   MET  46           HA       MET  46   5.281  -0.111   5.845
  318   1HB   MET  46          1HB       MET  46   6.379   1.798   4.325
  319   2HB   MET  46          2HB       MET  46   7.733   1.553   5.429
  320   1HG   MET  46          1HG       MET  46   6.344  -0.713   3.977
  321   2HG   MET  46          2HG       MET  46   7.780   0.098   3.353
  322   1HE   MET  46          1HE       MET  46   6.749  -2.937   5.935
  323   2HE   MET  46          2HE       MET  46   8.067  -3.567   4.951
  324   3HE   MET  46          3HE       MET  46   6.753  -2.676   4.185
  325    H    LEU  47           H        LEU  47   6.979   2.410   7.714
  326    HA   LEU  47           HA       LEU  47   8.219   0.298   9.417
  327   1HB   LEU  47          1HB       LEU  47   9.009   2.800   8.328
  328   2HB   LEU  47          2HB       LEU  47   8.933   3.012  10.077
  329    HG   LEU  47           HG       LEU  47  10.160   0.470   9.275
  330   1HD1  LEU  47          1HD1      LEU  47  11.019   1.737   7.405
  331   2HD1  LEU  47          2HD1      LEU  47  12.314   1.600   8.595
  332   3HD1  LEU  47          3HD1      LEU  47  11.406   3.105   8.448
  333   1HD2  LEU  47          1HD2      LEU  47  10.120   1.577  11.565
  334   2HD2  LEU  47          2HD2      LEU  47  11.262   2.758  10.922
  335   3HD2  LEU  47          3HD2      LEU  47  11.711   1.055  11.012
  336    H    SER  48           H        SER  48   5.327   1.006   9.583
  337    HA   SER  48           HA       SER  48   3.722   1.490  11.251
  338   1HB   SER  48          1HB       SER  48   4.702  -0.252  12.481
  339   2HB   SER  48          2HB       SER  48   6.227   0.615  12.672
  340    HG   SER  48           HG       SER  48   4.500   0.472  14.475
  341    H    GLN  49           H        GLN  49   4.109   3.831  10.326
  342    HA   GLN  49           HA       GLN  49   5.439   5.625  12.293
  343   1HB   GLN  49          1HB       GLN  49   5.296   5.522   9.540
  344   2HB   GLN  49          2HB       GLN  49   4.094   6.754   9.927
  345   1HG   GLN  49          1HG       GLN  49   5.830   7.863  11.391
  346   2HG   GLN  49          2HG       GLN  49   7.011   6.719  10.751
  347   1HE2  GLN  49          1HE2      GLN  49   4.375   8.693   9.249
  348   2HE2  GLN  49          2HE2      GLN  49   5.363   9.344   8.032
  349    H    MET  50           H        MET  50   4.227   7.525  13.084
  350    HA   MET  50           HA       MET  50   1.407   6.845  13.695
  351   1HB   MET  50          1HB       MET  50   3.347   8.973  14.655
  352   2HB   MET  50          2HB       MET  50   1.714   8.768  15.290
  353   1HG   MET  50          1HG       MET  50   2.414   6.302  15.702
  354   2HG   MET  50          2HG       MET  50   4.065   6.890  15.502
  355   1HE   MET  50          1HE       MET  50   1.270   7.132  18.954
  356   2HE   MET  50          2HE       MET  50   1.110   6.370  17.373
  357   3HE   MET  50          3HE       MET  50   0.668   8.063  17.576
  358   1H    GLY  51          1H        GLY  51 -17.096  -1.021  11.122
  359   2H    GLY  51          2H        GLY  51 -17.007  -2.645  11.612
  360   3H    GLY  51          3H        GLY  51 -17.725  -2.241  10.127
  361   1HA   GLY  51          1HA       GLY  51 -15.445  -1.238   9.547
  362   2HA   GLY  51          2HA       GLY  51 -14.874  -2.262  10.866
  363    H    THR  52           H        THR  52 -13.834  -2.958   8.527
  364    HA   THR  52           HA       THR  52 -15.084  -5.570   7.967
  365    HB   THR  52           HB       THR  52 -16.285  -3.972   6.513
  366    HG1  THR  52           HG1      THR  52 -15.874  -5.055   4.602
  367   1HG2  THR  52          1HG2      THR  52 -15.224  -2.452   5.113
  368   2HG2  THR  52          2HG2      THR  52 -13.738  -3.398   5.044
  369   3HG2  THR  52          3HG2      THR  52 -14.119  -2.462   6.488
  370    HA   PRO  53           HA       PRO  53 -10.799  -6.492   7.431
  371   1HB   PRO  53          1HB       PRO  53 -11.006  -8.859   6.072
  372   2HB   PRO  53          2HB       PRO  53 -11.342  -8.708   7.807
  373   1HG   PRO  53          1HG       PRO  53 -13.233  -8.827   5.507
  374   2HG   PRO  53          2HG       PRO  53 -13.366  -9.558   7.113
  375   1HD   PRO  53          1HD       PRO  53 -14.674  -7.276   6.370
  376   2HD   PRO  53          2HD       PRO  53 -14.216  -7.646   8.046
  377    HA   PRO  54           HA       PRO  54  -9.533  -5.271   3.400
  378   1HB   PRO  54          1HB       PRO  54  -7.460  -6.958   2.786
  379   2HB   PRO  54          2HB       PRO  54  -7.326  -5.641   3.967
  380   1HG   PRO  54          1HG       PRO  54  -7.801  -8.557   4.420
  381   2HG   PRO  54          2HG       PRO  54  -6.734  -7.445   5.292
  382   1HD   PRO  54          1HD       PRO  54  -9.149  -8.182   6.254
  383   2HD   PRO  54          2HD       PRO  54  -8.464  -6.566   6.546
  384    HA   PRO  55           HA       PRO  55 -11.445  -7.752   0.308
  385   1HB   PRO  55          1HB       PRO  55  -9.978  -7.151  -1.927
  386   2HB   PRO  55          2HB       PRO  55 -11.109  -6.003  -1.182
  387   1HG   PRO  55          1HG       PRO  55  -8.144  -6.171  -0.938
  388   2HG   PRO  55          2HG       PRO  55  -9.177  -4.749  -1.121
  389   1HD   PRO  55          1HD       PRO  55  -8.135  -5.518   1.260
  390   2HD   PRO  55          2HD       PRO  55  -9.700  -4.686   1.120
  391    HA   PRO  56           HA       PRO  56  -9.217 -11.497  -0.403
  392   1HB   PRO  56          1HB       PRO  56  -9.755 -12.158  -3.012
  393   2HB   PRO  56          2HB       PRO  56 -10.951 -12.315  -1.709
  394   1HG   PRO  56          1HG       PRO  56 -10.632 -10.144  -3.731
  395   2HG   PRO  56          2HG       PRO  56 -12.109 -10.921  -3.136
  396   1HD   PRO  56          1HD       PRO  56 -11.307  -8.500  -2.260
  397   2HD   PRO  56          2HD       PRO  56 -12.172  -9.649  -1.218
  398    H    TYR  57           H        TYR  57  -7.575 -12.508  -2.228
  399    HA   TYR  57           HA       TYR  57  -5.880 -10.239  -3.194
  400   1HB   TYR  57          1HB       TYR  57  -4.993 -11.088  -1.105
  401   2HB   TYR  57          2HB       TYR  57  -5.093 -12.746  -1.692
  402    HD1  TYR  57           HD1      TYR  57  -3.796  -9.509  -3.091
  403    HD2  TYR  57           HD2      TYR  57  -3.018 -13.639  -2.214
  404    HE1  TYR  57           HE1      TYR  57  -1.547  -9.296  -4.106
  405    HE2  TYR  57           HE2      TYR  57  -0.770 -13.427  -3.228
  406    HH   TYR  57           HH       TYR  57   0.572 -10.354  -4.102
  407    H    THR  58           H        THR  58  -4.821 -13.551  -3.457
  408    HA   THR  58           HA       THR  58  -4.417 -14.883  -5.357
  409    HB   THR  58           HB       THR  58  -6.886 -13.460  -6.390
  410    HG1  THR  58           HG1      THR  58  -7.918 -14.403  -4.847
  411   1HG2  THR  58          1HG2      THR  58  -7.217 -15.858  -7.313
  412   2HG2  THR  58          2HG2      THR  58  -5.501 -16.069  -6.964
  413   3HG2  THR  58          3HG2      THR  58  -6.023 -14.824  -8.099
  414    H    VAL  59           H        VAL  59  -4.029 -14.656  -7.829
  415    HA   VAL  59           HA       VAL  59  -2.912 -11.924  -8.366
  416    HB   VAL  59           HB       VAL  59  -1.295 -13.777  -8.111
  417   1HG1  VAL  59          1HG1      VAL  59  -3.295 -15.158  -9.668
  418   2HG1  VAL  59          2HG1      VAL  59  -1.896 -15.826  -8.826
  419   3HG1  VAL  59          3HG1      VAL  59  -1.735 -15.251 -10.486
  420   1HG2  VAL  59          1HG2      VAL  59  -0.059 -12.747  -9.685
  421   2HG2  VAL  59          2HG2      VAL  59  -1.532 -12.015 -10.323
  422   3HG2  VAL  59          3HG2      VAL  59  -0.965 -13.558 -10.963
  423    H    GLY  60           H        GLY  60  -5.572 -12.126  -8.979
  424   1HA   GLY  60          1HA       GLY  60  -5.825 -12.982 -11.800
  425   2HA   GLY  60          2HA       GLY  60  -7.145 -12.439 -10.765
  Start of MODEL   16
    1    H    PHE   5           H        PHE   5  -3.687  10.380   7.734
    2    HA   PHE   5           HA       PHE   5  -0.882  11.295   7.402
    3   1HB   PHE   5          1HB       PHE   5  -0.242   9.024   6.590
    4   2HB   PHE   5          2HB       PHE   5  -0.736   9.008   8.284
    5    HD1  PHE   5           HD1      PHE   5  -1.421   7.765   4.957
    6    HD2  PHE   5           HD2      PHE   5  -3.114   8.329   8.864
    7    HE1  PHE   5           HE1      PHE   5  -3.196   6.117   4.426
    8    HE2  PHE   5           HE2      PHE   5  -4.889   6.681   8.334
    9    HZ   PHE   5           HZ       PHE   5  -4.930   5.574   6.115
   10    H    GLU   6           H        GLU   6  -0.229  11.074   5.043
   11    HA   GLU   6           HA       GLU   6  -2.623  11.162   3.234
   12   1HB   GLU   6          1HB       GLU   6  -1.229  13.317   4.031
   13   2HB   GLU   6          2HB       GLU   6  -0.198  12.817   2.690
   14   1HG   GLU   6          1HG       GLU   6  -2.338  12.686   1.287
   15   2HG   GLU   6          2HG       GLU   6  -3.128  13.551   2.606
   16    H    ILE   7           H        ILE   7  -2.283   9.087   2.324
   17    HA   ILE   7           HA       ILE   7   0.287   8.047   1.546
   18    HB   ILE   7           HB       ILE   7  -2.531   7.447   0.590
   19   1HG1  ILE   7          1HG1      ILE   7  -2.243   7.270   3.042
   20   2HG1  ILE   7          2HG1      ILE   7  -2.479   5.684   2.311
   21   1HG2  ILE   7          1HG2      ILE   7  -0.418   6.590  -0.720
   22   2HG2  ILE   7          2HG2      ILE   7  -1.724   5.465  -0.346
   23   3HG2  ILE   7          3HG2      ILE   7  -0.260   5.476   0.637
   24   1HD1  ILE   7          1HD1      ILE   7  -0.654   5.342   3.763
   25   2HD1  ILE   7          2HD1      ILE   7   0.062   6.907   3.376
   26   3HD1  ILE   7          3HD1      ILE   7   0.120   5.595   2.199
   27    HA   PRO   8           HA       PRO   8   0.808  10.351  -2.202
   28   1HB   PRO   8          1HB       PRO   8   2.671   8.758  -3.417
   29   2HB   PRO   8          2HB       PRO   8   3.059   9.839  -2.067
   30   1HG   PRO   8          1HG       PRO   8   2.592   6.897  -2.075
   31   2HG   PRO   8          2HG       PRO   8   3.755   7.851  -1.143
   32   1HD   PRO   8          1HD       PRO   8   1.412   6.882  -0.119
   33   2HD   PRO   8          2HD       PRO   8   2.246   8.322   0.502
   34    H    ASP   9           H        ASP   9   0.931   9.691  -4.717
   35    HA   ASP   9           HA       ASP   9  -0.963   7.427  -5.228
   36   1HB   ASP   9          1HB       ASP   9  -2.149   8.980  -6.791
   37   2HB   ASP   9          2HB       ASP   9  -2.209   9.532  -5.117
   38    H    ASP  10           H        ASP  10   1.357   9.754  -6.617
   39    HA   ASP  10           HA       ASP  10   1.624   8.343  -9.142
   40   1HB   ASP  10          1HB       ASP  10   3.513   9.941  -9.411
   41   2HB   ASP  10          2HB       ASP  10   2.051  10.747  -8.841
   42    H    VAL  11           H        VAL  11   2.918   7.835  -5.974
   43    HA   VAL  11           HA       VAL  11   5.472   6.755  -6.521
   44    HB   VAL  11           HB       VAL  11   5.018   5.541  -4.359
   45   1HG1  VAL  11          1HG1      VAL  11   5.848   7.823  -4.302
   46   2HG1  VAL  11          2HG1      VAL  11   4.625   7.636  -3.046
   47   3HG1  VAL  11          3HG1      VAL  11   4.221   8.455  -4.555
   48   1HG2  VAL  11          1HG2      VAL  11   2.402   5.591  -5.169
   49   2HG2  VAL  11          2HG2      VAL  11   2.437   6.923  -4.016
   50   3HG2  VAL  11          3HG2      VAL  11   2.922   5.304  -3.509
   51    HA   PRO  12           HA       PRO  12   4.259   3.008  -8.572
   52   1HB   PRO  12          1HB       PRO  12   6.735   1.878  -8.755
   53   2HB   PRO  12          2HB       PRO  12   6.222   3.241  -9.766
   54   1HG   PRO  12          1HG       PRO  12   8.068   3.183  -7.474
   55   2HG   PRO  12          2HG       PRO  12   7.981   4.315  -8.823
   56   1HD   PRO  12          1HD       PRO  12   7.022   4.709  -6.187
   57   2HD   PRO  12          2HD       PRO  12   6.797   5.778  -7.587
   58    H    LEU  13           H        LEU  13   4.802   3.224  -5.386
   59    HA   LEU  13           HA       LEU  13   4.646   1.690  -3.587
   60   1HB   LEU  13          1HB       LEU  13   3.210   0.673  -5.842
   61   2HB   LEU  13          2HB       LEU  13   4.014  -0.686  -5.058
   62    HG   LEU  13           HG       LEU  13   3.046  -0.051  -2.899
   63   1HD1  LEU  13          1HD1      LEU  13   2.797   2.471  -4.094
   64   2HD1  LEU  13          2HD1      LEU  13   2.231   2.006  -2.491
   65   3HD1  LEU  13          3HD1      LEU  13   1.143   1.906  -3.874
   66   1HD2  LEU  13          1HD2      LEU  13   1.321  -1.335  -3.539
   67   2HD2  LEU  13          2HD2      LEU  13   1.547  -0.850  -5.219
   68   3HD2  LEU  13          3HD2      LEU  13   0.517   0.108  -4.155
   69    HA   PRO  14           HA       PRO  14   8.456  -0.537  -3.749
   70   1HB   PRO  14          1HB       PRO  14   8.156  -2.298  -1.678
   71   2HB   PRO  14          2HB       PRO  14   8.436  -0.562  -1.458
   72   1HG   PRO  14          1HG       PRO  14   5.979  -2.130  -1.091
   73   2HG   PRO  14          2HG       PRO  14   6.457  -0.594  -0.371
   74   1HD   PRO  14          1HD       PRO  14   4.657  -1.008  -2.515
   75   2HD   PRO  14          2HD       PRO  14   5.247   0.543  -1.902
   76    H    ALA  15           H        ALA  15   9.346  -2.936  -3.731
   77    HA   ALA  15           HA       ALA  15   8.143  -4.339  -5.934
   78   1HB   ALA  15          1HB       ALA  15   9.998  -5.795  -5.652
   79   2HB   ALA  15          2HB       ALA  15  10.083  -5.478  -3.919
   80   3HB   ALA  15          3HB       ALA  15  10.574  -4.234  -5.068
   81    H    GLY  16           H        GLY  16   6.988  -6.338  -5.935
   82   1HA   GLY  16          1HA       GLY  16   5.441  -7.881  -5.139
   83   2HA   GLY  16          2HA       GLY  16   6.443  -7.960  -3.697
   84    H    TRP  17           H        TRP  17   5.027  -4.975  -4.796
   85    HA   TRP  17           HA       TRP  17   2.948  -5.168  -2.670
   86   1HB   TRP  17          1HB       TRP  17   5.260  -3.286  -2.952
   87   2HB   TRP  17          2HB       TRP  17   3.754  -2.672  -2.280
   88    HD1  TRP  17           HD1      TRP  17   6.834  -4.321  -1.214
   89    HE1  TRP  17           HE1      TRP  17   6.552  -5.334   1.146
   90    HE3  TRP  17           HE3      TRP  17   1.772  -4.141  -0.793
   91    HZ2  TRP  17           HZ2      TRP  17   4.428  -5.980   2.973
   92    HZ3  TRP  17           HZ3      TRP  17   0.629  -4.952   1.245
   93    HH2  TRP  17           HH2      TRP  17   1.950  -5.875   3.130
   94    H    GLU  18           H        GLU  18   1.488  -5.357  -4.537
   95    HA   GLU  18           HA       GLU  18   1.255  -3.003  -6.340
   96   1HB   GLU  18          1HB       GLU  18   0.936  -5.688  -6.693
   97   2HB   GLU  18          2HB       GLU  18  -0.722  -5.239  -6.298
   98   1HG   GLU  18          1HG       GLU  18  -0.208  -5.222  -8.761
   99   2HG   GLU  18          2HG       GLU  18  -0.830  -3.694  -8.148
  100    H    MET  19           H        MET  19  -1.409  -2.780  -6.622
  101    HA   MET  19           HA       MET  19  -2.835  -2.736  -4.105
  102   1HB   MET  19          1HB       MET  19  -2.819  -0.389  -3.713
  103   2HB   MET  19          2HB       MET  19  -1.147  -0.860  -3.975
  104   1HG   MET  19          1HG       MET  19  -2.886   0.196  -6.221
  105   2HG   MET  19          2HG       MET  19  -1.956   1.266  -5.180
  106   1HE   MET  19          1HE       MET  19   0.329   2.142  -7.003
  107   2HE   MET  19          2HE       MET  19   1.362   1.245  -5.897
  108   3HE   MET  19          3HE       MET  19  -0.145   1.942  -5.312
  109    H    ALA  20           H        ALA  20  -4.979  -2.619  -4.476
  110    HA   ALA  20           HA       ALA  20  -5.877  -1.786  -7.202
  111   1HB   ALA  20          1HB       ALA  20  -7.454  -3.941  -6.440
  112   2HB   ALA  20          2HB       ALA  20  -5.861  -4.370  -5.816
  113   3HB   ALA  20          3HB       ALA  20  -6.072  -4.025  -7.532
  114    H    LYS  21           H        LYS  21  -8.400  -1.564  -7.133
  115    HA   LYS  21           HA       LYS  21  -9.082  -0.184  -4.569
  116   1HB   LYS  21          1HB       LYS  21  -9.430   0.307  -7.433
  117   2HB   LYS  21          2HB       LYS  21 -10.926   0.532  -6.526
  118   1HG   LYS  21          1HG       LYS  21  -9.283   1.817  -4.858
  119   2HG   LYS  21          2HG       LYS  21  -8.343   2.026  -6.335
  120   1HD   LYS  21          1HD       LYS  21 -11.093   2.541  -6.943
  121   2HD   LYS  21          2HD       LYS  21 -10.662   3.472  -5.508
  122   1HE   LYS  21          1HE       LYS  21  -9.024   4.702  -6.639
  123   2HE   LYS  21          2HE       LYS  21  -8.785   3.442  -7.864
  124   1HZ   LYS  21          1HZ       LYS  21 -11.380   4.832  -7.528
  125   2HZ   LYS  21          2HZ       LYS  21 -10.834   3.929  -8.861
  126   3HZ   LYS  21          3HZ       LYS  21 -10.170   5.459  -8.537
  127    H    THR  22           H        THR  22 -10.029  -1.869  -3.352
  128    HA   THR  22           HA       THR  22 -11.820  -3.859  -4.360
  129    HB   THR  22           HB       THR  22 -12.167  -2.731  -1.614
  130    HG1  THR  22           HG1      THR  22 -10.168  -3.376  -0.977
  131   1HG2  THR  22          1HG2      THR  22 -13.170  -4.776  -1.648
  132   2HG2  THR  22          2HG2      THR  22 -11.531  -5.352  -1.356
  133   3HG2  THR  22          3HG2      THR  22 -12.185  -5.348  -2.994
  134    H    SER  23           H        SER  23 -14.134  -3.490  -2.727
  135    HA   SER  23           HA       SER  23 -15.857  -1.972  -4.383
  136   1HB   SER  23          1HB       SER  23 -16.033  -3.642  -2.189
  137   2HB   SER  23          2HB       SER  23 -16.572  -2.098  -1.528
  138    HG   SER  23           HG       SER  23 -18.376  -2.473  -2.497
  139    H    SER  24           H        SER  24 -16.811   0.152  -4.025
  140    HA   SER  24           HA       SER  24 -16.708   2.452  -3.492
  141   1HB   SER  24          1HB       SER  24 -15.365   1.443  -0.971
  142   2HB   SER  24          2HB       SER  24 -16.360   2.887  -1.154
  143    HG   SER  24           HG       SER  24 -17.803   1.501  -0.420
  144    H    GLY  25           H        GLY  25 -14.239   0.911  -4.625
  145   1HA   GLY  25          1HA       GLY  25 -12.102   1.541  -5.352
  146   2HA   GLY  25          2HA       GLY  25 -12.511   3.186  -4.879
  147    H    GLN  26           H        GLN  26 -12.734   0.710  -2.449
  148    HA   GLN  26           HA       GLN  26 -11.032   1.974  -0.591
  149   1HB   GLN  26          1HB       GLN  26 -11.764  -0.932  -1.053
  150   2HB   GLN  26          2HB       GLN  26 -10.951  -0.364   0.401
  151   1HG   GLN  26          1HG       GLN  26 -13.245   1.303  -0.200
  152   2HG   GLN  26          2HG       GLN  26 -13.720  -0.390  -0.074
  153   1HE2  GLN  26          1HE2      GLN  26 -13.178   2.376   1.777
  154   2HE2  GLN  26          2HE2      GLN  26 -12.929   1.635   3.284
  155    H    ARG  27           H        ARG  27  -9.045   2.645  -1.533
  156    HA   ARG  27           HA       ARG  27  -7.376   1.045  -3.195
  157   1HB   ARG  27          1HB       ARG  27  -7.427   3.622  -2.082
  158   2HB   ARG  27          2HB       ARG  27  -5.922   2.907  -1.513
  159   1HG   ARG  27          1HG       ARG  27  -5.602   2.132  -3.960
  160   2HG   ARG  27          2HG       ARG  27  -6.851   3.319  -4.353
  161   1HD   ARG  27          1HD       ARG  27  -4.826   4.428  -2.556
  162   2HD   ARG  27          2HD       ARG  27  -4.126   3.860  -4.083
  163    HE   ARG  27           HE       ARG  27  -6.588   5.253  -4.598
  164   1HH1  ARG  27          1HH1      ARG  27  -3.277   5.784  -3.663
  165   2HH1  ARG  27          2HH1      ARG  27  -3.229   7.379  -4.331
  166   1HH2  ARG  27          1HH2      ARG  27  -6.501   7.325  -5.456
  167   2HH2  ARG  27          2HH2      ARG  27  -5.039   8.247  -5.338
  168    H    TYR  28           H        TYR  28  -6.787  -0.986  -2.452
  169    HA   TYR  28           HA       TYR  28  -5.426  -1.086   0.212
  170   1HB   TYR  28          1HB       TYR  28  -6.123  -3.396   0.325
  171   2HB   TYR  28          2HB       TYR  28  -7.528  -2.436  -0.115
  172    HD1  TYR  28           HD1      TYR  28  -8.242  -2.329  -2.546
  173    HD2  TYR  28           HD2      TYR  28  -5.303  -5.101  -1.104
  174    HE1  TYR  28           HE1      TYR  28  -8.612  -3.753  -4.536
  175    HE2  TYR  28           HE2      TYR  28  -5.677  -6.533  -3.093
  176    HH   TYR  28           HH       TYR  28  -8.315  -6.146  -5.166
  177    H    PHE  29           H        PHE  29  -3.370  -2.134   0.267
  178    HA   PHE  29           HA       PHE  29  -2.069  -2.242  -2.404
  179   1HB   PHE  29          1HB       PHE  29  -1.006  -2.040   0.433
  180   2HB   PHE  29          2HB       PHE  29   0.003  -2.025  -1.017
  181    HD1  PHE  29           HD1      PHE  29  -2.982  -0.273   0.464
  182    HD2  PHE  29           HD2      PHE  29   0.476   0.008  -2.060
  183    HE1  PHE  29           HE1      PHE  29  -3.403   2.137   0.156
  184    HE2  PHE  29           HE2      PHE  29   0.053   2.420  -2.367
  185    HZ   PHE  29           HZ       PHE  29  -1.886   3.490  -1.261
  186    H    LYS  30           H        LYS  30  -1.872  -4.179  -3.281
  187    HA   LYS  30           HA       LYS  30  -2.138  -6.671  -1.817
  188   1HB   LYS  30          1HB       LYS  30  -1.389  -5.884  -4.631
  189   2HB   LYS  30          2HB       LYS  30  -1.671  -7.551  -4.139
  190   1HG   LYS  30          1HG       LYS  30  -3.839  -6.027  -3.178
  191   2HG   LYS  30          2HG       LYS  30  -3.563  -5.491  -4.828
  192   1HD   LYS  30          1HD       LYS  30  -3.287  -8.279  -4.934
  193   2HD   LYS  30          2HD       LYS  30  -4.675  -8.010  -3.879
  194   1HE   LYS  30          1HE       LYS  30  -5.206  -6.206  -5.860
  195   2HE   LYS  30          2HE       LYS  30  -4.387  -7.480  -6.781
  196   1HZ   LYS  30          1HZ       LYS  30  -6.611  -8.177  -6.649
  197   2HZ   LYS  30          2HZ       LYS  30  -6.762  -7.713  -5.023
  198   3HZ   LYS  30          3HZ       LYS  30  -5.828  -9.070  -5.438
  199    H    ASN  31           H        ASN  31  -0.487  -8.142  -1.368
  200    HA   ASN  31           HA       ASN  31   2.313  -7.131  -1.730
  201   1HB   ASN  31          1HB       ASN  31   1.140  -7.299   0.589
  202   2HB   ASN  31          2HB       ASN  31   1.367  -9.040   0.404
  203   1HD2  ASN  31          1HD2      ASN  31   2.878  -8.699   2.355
  204   2HD2  ASN  31          2HD2      ASN  31   4.477  -8.228   2.034
  205    H    HIS  32           H        HIS  32   3.317  -8.374  -3.322
  206    HA   HIS  32           HA       HIS  32   2.422 -11.184  -3.687
  207   1HB   HIS  32          1HB       HIS  32   4.411  -9.470  -5.213
  208   2HB   HIS  32          2HB       HIS  32   3.754 -11.015  -5.747
  209    HD1  HIS  32           HD1      HIS  32   1.181 -11.073  -6.351
  210    HD2  HIS  32           HD2      HIS  32   2.667  -7.262  -5.548
  211    HE1  HIS  32           HE1      HIS  32  -0.602  -9.432  -7.098
  212    H    ILE  33           H        ILE  33   5.143  -9.314  -2.474
  213    HA   ILE  33           HA       ILE  33   7.089 -11.437  -2.353
  214    HB   ILE  33           HB       ILE  33   7.998  -9.965  -0.438
  215   1HG1  ILE  33          1HG1      ILE  33   5.938  -7.953  -1.352
  216   2HG1  ILE  33          2HG1      ILE  33   5.596  -9.050  -0.012
  217   1HG2  ILE  33          1HG2      ILE  33   7.978  -7.935  -2.329
  218   2HG2  ILE  33          2HG2      ILE  33   7.728  -9.398  -3.280
  219   3HG2  ILE  33          3HG2      ILE  33   9.140  -9.257  -2.234
  220   1HD1  ILE  33          1HD1      ILE  33   6.568  -7.343   1.186
  221   2HD1  ILE  33          2HD1      ILE  33   7.549  -6.804  -0.178
  222   3HD1  ILE  33          3HD1      ILE  33   8.033  -8.222   0.753
  223    H    ASP  34           H        ASP  34   4.328 -10.540  -0.408
  224    HA   ASP  34           HA       ASP  34   4.878 -12.845   1.434
  225   1HB   ASP  34          1HB       ASP  34   4.754 -10.229   2.093
  226   2HB   ASP  34          2HB       ASP  34   3.040 -10.628   2.198
  227    H    GLN  35           H        GLN  35   2.842 -11.643  -1.021
  228    HA   GLN  35           HA       GLN  35   0.805 -12.419  -1.904
  229   1HB   GLN  35          1HB       GLN  35   2.200 -14.583  -0.672
  230   2HB   GLN  35          2HB       GLN  35   0.484 -14.791  -0.325
  231   1HG   GLN  35          1HG       GLN  35   0.652 -15.834  -2.402
  232   2HG   GLN  35          2HG       GLN  35   0.204 -14.197  -2.880
  233   1HE2  GLN  35          1HE2      GLN  35   1.357 -14.145  -4.893
  234   2HE2  GLN  35          2HE2      GLN  35   3.049 -14.244  -4.986
  235    H    THR  36           H        THR  36  -0.183 -10.563  -0.630
  236    HA   THR  36           HA       THR  36  -2.495 -11.456   0.835
  237    HB   THR  36           HB       THR  36  -1.388 -10.034   2.931
  238    HG1  THR  36           HG1      THR  36   0.665 -10.038   2.191
  239   1HG2  THR  36          1HG2      THR  36  -0.780 -12.823   3.247
  240   2HG2  THR  36          2HG2      THR  36  -2.302 -12.656   2.371
  241   3HG2  THR  36          3HG2      THR  36  -2.105 -11.897   3.952
  242    H    THR  37           H        THR  37  -4.013  -9.823   0.784
  243    HA   THR  37           HA       THR  37  -3.195  -7.185  -0.291
  244    HB   THR  37           HB       THR  37  -5.578  -6.927  -0.694
  245    HG1  THR  37           HG1      THR  37  -5.744  -9.041   1.163
  246   1HG2  THR  37          1HG2      THR  37  -5.967  -8.730  -2.150
  247   2HG2  THR  37          2HG2      THR  37  -5.131  -9.876  -1.103
  248   3HG2  THR  37          3HG2      THR  37  -4.209  -8.685  -2.020
  249    H    THR  38           H        THR  38  -3.071  -5.352   1.022
  250    HA   THR  38           HA       THR  38  -4.228  -5.591   3.783
  251    HB   THR  38           HB       THR  38  -1.720  -5.910   3.550
  252    HG1  THR  38           HG1      THR  38  -1.806  -5.209   5.503
  253   1HG2  THR  38          1HG2      THR  38  -1.757  -3.899   1.779
  254   2HG2  THR  38          2HG2      THR  38  -0.335  -4.239   2.764
  255   3HG2  THR  38          3HG2      THR  38  -1.445  -2.953   3.232
  256    H    TRP  39           H        TRP  39  -4.657  -3.486   4.821
  257    HA   TRP  39           HA       TRP  39  -5.788  -1.538   2.938
  258   1HB   TRP  39          1HB       TRP  39  -5.769  -1.946   5.938
  259   2HB   TRP  39          2HB       TRP  39  -6.528  -0.541   5.193
  260    HD1  TRP  39           HD1      TRP  39  -7.605  -3.592   6.555
  261    HE1  TRP  39           HE1      TRP  39  -9.694  -4.547   5.387
  262    HE3  TRP  39           HE3      TRP  39  -7.510  -0.882   2.233
  263    HZ2  TRP  39           HZ2      TRP  39 -11.134  -4.207   2.939
  264    HZ3  TRP  39           HZ3      TRP  39  -9.244  -1.221   0.501
  265    HH2  TRP  39           HH2      TRP  39 -11.059  -2.875   0.846
  266    H    GLN  40           H        GLN  40  -3.437  -1.543   5.632
  267    HA   GLN  40           HA       GLN  40  -2.598   1.141   5.529
  268   1HB   GLN  40          1HB       GLN  40  -1.160  -1.461   6.113
  269   2HB   GLN  40          2HB       GLN  40  -0.426   0.116   6.406
  270   1HG   GLN  40          1HG       GLN  40  -2.860   0.453   7.597
  271   2HG   GLN  40          2HG       GLN  40  -2.584  -1.266   7.885
  272   1HE2  GLN  40          1HE2      GLN  40  -2.519   0.765   9.983
  273   2HE2  GLN  40          2HE2      GLN  40  -0.939   0.802  10.600
  274    H    ASP  41           H        ASP  41  -0.689   2.086   4.470
  275    HA   ASP  41           HA       ASP  41  -0.296   0.977   1.735
  276   1HB   ASP  41          1HB       ASP  41   0.496   3.657   2.921
  277   2HB   ASP  41          2HB       ASP  41   0.410   3.245   1.210
  278    HA   PRO  42           HA       PRO  42   3.782  -0.253   2.947
  279   1HB   PRO  42          1HB       PRO  42   4.752  -0.877   0.478
  280   2HB   PRO  42          2HB       PRO  42   3.597  -1.900   1.344
  281   1HG   PRO  42          1HG       PRO  42   3.171  -0.072  -0.940
  282   2HG   PRO  42          2HG       PRO  42   2.318  -1.557  -0.507
  283   1HD   PRO  42          1HD       PRO  42   1.422   1.060  -0.071
  284   2HD   PRO  42          2HD       PRO  42   0.746  -0.414   0.650
  285    H    ARG  43           H        ARG  43   3.107   2.384   0.799
  286    HA   ARG  43           HA       ARG  43   5.934   3.225   0.598
  287   1HB   ARG  43          1HB       ARG  43   3.282   4.327  -0.371
  288   2HB   ARG  43          2HB       ARG  43   4.826   5.111  -0.693
  289   1HG   ARG  43          1HG       ARG  43   3.976   2.333  -1.566
  290   2HG   ARG  43          2HG       ARG  43   4.264   3.725  -2.605
  291   1HD   ARG  43          1HD       ARG  43   6.324   2.183  -0.992
  292   2HD   ARG  43          2HD       ARG  43   6.246   2.358  -2.752
  293    HE   ARG  43           HE       ARG  43   6.345   4.970  -1.899
  294   1HH1  ARG  43          1HH1      ARG  43   8.259   2.146  -1.205
  295   2HH1  ARG  43          2HH1      ARG  43   9.699   3.059  -0.916
  296   1HH2  ARG  43          1HH2      ARG  43   8.228   6.132  -1.520
  297   2HH2  ARG  43          2HH2      ARG  43   9.685   5.297  -1.093
  298    H    LYS  44           H        LYS  44   2.899   4.413   2.086
  299    HA   LYS  44           HA       LYS  44   4.588   6.043   3.950
  300   1HB   LYS  44          1HB       LYS  44   3.402   7.197   1.918
  301   2HB   LYS  44          2HB       LYS  44   1.941   6.993   2.883
  302   1HG   LYS  44          1HG       LYS  44   2.746   8.369   4.617
  303   2HG   LYS  44          2HG       LYS  44   4.420   8.212   4.087
  304   1HD   LYS  44          1HD       LYS  44   2.333   9.517   2.339
  305   2HD   LYS  44          2HD       LYS  44   3.219  10.435   3.556
  306   1HE   LYS  44          1HE       LYS  44   5.314   9.228   2.388
  307   2HE   LYS  44          2HE       LYS  44   4.204   9.229   1.005
  308   1HZ   LYS  44          1HZ       LYS  44   5.455  11.316   1.150
  309   2HZ   LYS  44          2HZ       LYS  44   4.845  11.583   2.713
  310   3HZ   LYS  44          3HZ       LYS  44   3.795  11.582   1.377
  311    H    ALA  45           H        ALA  45   4.014   3.919   5.211
  312    HA   ALA  45           HA       ALA  45   1.991   4.528   7.166
  313   1HB   ALA  45          1HB       ALA  45   0.959   3.593   4.800
  314   2HB   ALA  45          2HB       ALA  45   0.165   3.419   6.364
  315   3HB   ALA  45          3HB       ALA  45   1.139   2.098   5.718
  316    H    MET  46           H        MET  46   2.715   3.508   8.983
  317    HA   MET  46           HA       MET  46   3.552   0.717   8.986
  318   1HB   MET  46          1HB       MET  46   5.424   2.545   8.128
  319   2HB   MET  46          2HB       MET  46   5.788   2.435   9.849
  320   1HG   MET  46          1HG       MET  46   5.383  -0.209   9.148
  321   2HG   MET  46          2HG       MET  46   6.187   0.448   7.722
  322   1HE   MET  46          1HE       MET  46   8.206  -1.423   8.455
  323   2HE   MET  46          2HE       MET  46   7.034  -1.772   9.723
  324   3HE   MET  46          3HE       MET  46   8.724  -1.501  10.144
  325    H    LEU  47           H        LEU  47   5.326   1.124  11.309
  326    HA   LEU  47           HA       LEU  47   3.237   1.460  13.360
  327   1HB   LEU  47          1HB       LEU  47   5.283  -0.233  13.087
  328   2HB   LEU  47          2HB       LEU  47   6.140   1.041  13.957
  329    HG   LEU  47           HG       LEU  47   3.696   0.757  15.308
  330   1HD1  LEU  47          1HD1      LEU  47   4.094  -1.593  13.877
  331   2HD1  LEU  47          2HD1      LEU  47   3.084  -1.420  15.313
  332   3HD1  LEU  47          3HD1      LEU  47   4.754  -1.964  15.469
  333   1HD2  LEU  47          1HD2      LEU  47   6.394  -0.449  15.990
  334   2HD2  LEU  47          2HD2      LEU  47   5.116  -0.034  17.132
  335   3HD2  LEU  47          3HD2      LEU  47   5.957   1.240  16.249
  336    H    SER  48           H        SER  48   3.566   3.916  12.146
  337    HA   SER  48           HA       SER  48   5.445   5.481  13.856
  338   1HB   SER  48          1HB       SER  48   4.020   5.829  11.239
  339   2HB   SER  48          2HB       SER  48   4.522   7.269  12.125
  340    HG   SER  48           HG       SER  48   6.549   6.816  11.756
  341    H    GLN  49           H        GLN  49   4.136   5.407  15.816
  342    HA   GLN  49           HA       GLN  49   1.405   6.547  15.704
  343   1HB   GLN  49          1HB       GLN  49   2.459   4.550  17.123
  344   2HB   GLN  49          2HB       GLN  49   2.866   5.864  18.227
  345   1HG   GLN  49          1HG       GLN  49   0.676   6.265  18.768
  346   2HG   GLN  49          2HG       GLN  49   0.098   5.875  17.148
  347   1HE2  GLN  49          1HE2      GLN  49   1.764   4.106  19.835
  348   2HE2  GLN  49          2HE2      GLN  49   0.784   2.724  19.721
  349    H    MET  50           H        MET  50   0.982   8.673  16.203
  350    HA   MET  50           HA       MET  50   3.089  10.593  16.556
  351   1HB   MET  50          1HB       MET  50   0.090  10.525  16.721
  352   2HB   MET  50          2HB       MET  50   0.944  11.978  17.240
  353   1HG   MET  50          1HG       MET  50   2.222  11.625  14.932
  354   2HG   MET  50          2HG       MET  50   0.741  10.767  14.511
  355   1HE   MET  50          1HE       MET  50  -1.728  11.879  14.895
  356   2HE   MET  50          2HE       MET  50  -0.923  11.773  13.331
  357   3HE   MET  50          3HE       MET  50  -1.786  13.244  13.772
  358   1H    GLY  51          1H        GLY  51 -17.131  -5.814   9.644
  359   2H    GLY  51          2H        GLY  51 -16.922  -5.039  11.141
  360   3H    GLY  51          3H        GLY  51 -16.378  -6.634  10.924
  361   1HA   GLY  51          1HA       GLY  51 -15.172  -4.115  10.074
  362   2HA   GLY  51          2HA       GLY  51 -14.400  -5.594  10.648
  363    H    THR  52           H        THR  52 -15.711  -3.953   7.850
  364    HA   THR  52           HA       THR  52 -15.745  -5.960   5.895
  365    HB   THR  52           HB       THR  52 -14.865  -3.913   4.465
  366    HG1  THR  52           HG1      THR  52 -14.989  -2.002   5.582
  367   1HG2  THR  52          1HG2      THR  52 -17.279  -4.809   4.960
  368   2HG2  THR  52          2HG2      THR  52 -17.077  -3.192   4.287
  369   3HG2  THR  52          3HG2      THR  52 -17.387  -3.397   6.011
  370    HA   PRO  53           HA       PRO  53 -11.351  -7.023   6.295
  371   1HB   PRO  53          1HB       PRO  53 -11.525  -9.382   4.917
  372   2HB   PRO  53          2HB       PRO  53 -11.961  -9.228   6.629
  373   1HG   PRO  53          1HG       PRO  53 -13.713  -9.301   4.220
  374   2HG   PRO  53          2HG       PRO  53 -13.956 -10.035   5.810
  375   1HD   PRO  53          1HD       PRO  53 -15.171  -7.725   5.003
  376   2HD   PRO  53          2HD       PRO  53 -14.820  -8.109   6.701
  377    HA   PRO  54           HA       PRO  54  -9.859  -5.818   2.334
  378   1HB   PRO  54          1HB       PRO  54  -7.719  -7.467   1.889
  379   2HB   PRO  54          2HB       PRO  54  -7.691  -6.139   3.065
  380   1HG   PRO  54          1HG       PRO  54  -8.116  -9.062   3.507
  381   2HG   PRO  54          2HG       PRO  54  -7.164  -7.909   4.454
  382   1HD   PRO  54          1HD       PRO  54  -9.639  -8.739   5.195
  383   2HD   PRO  54          2HD       PRO  54  -9.009  -7.124   5.586
  384    HA   PRO  55           HA       PRO  55 -11.404  -8.409  -0.869
  385   1HB   PRO  55          1HB       PRO  55  -9.649  -8.040  -2.940
  386   2HB   PRO  55          2HB       PRO  55 -10.807  -6.802  -2.423
  387   1HG   PRO  55          1HG       PRO  55  -7.902  -7.038  -1.832
  388   2HG   PRO  55          2HG       PRO  55  -8.867  -5.600  -2.189
  389   1HD   PRO  55          1HD       PRO  55  -8.095  -6.311   0.328
  390   2HD   PRO  55          2HD       PRO  55  -9.572  -5.383  -0.015
  391    HA   PRO  56           HA       PRO  56  -9.304 -12.285  -0.833
  392   1HB   PRO  56          1HB       PRO  56 -10.160 -13.425  -3.170
  393   2HB   PRO  56          2HB       PRO  56 -11.206 -13.240  -1.748
  394   1HG   PRO  56          1HG       PRO  56 -11.067 -11.592  -4.222
  395   2HG   PRO  56          2HG       PRO  56 -12.478 -12.093  -3.277
  396   1HD   PRO  56          1HD       PRO  56 -11.378  -9.603  -3.128
  397   2HD   PRO  56          2HD       PRO  56 -12.262 -10.369  -1.792
  398    H    TYR  57           H        TYR  57  -7.091 -12.094  -1.113
  399    HA   TYR  57           HA       TYR  57  -5.677 -10.816  -3.151
  400   1HB   TYR  57          1HB       TYR  57  -4.859 -11.810  -0.972
  401   2HB   TYR  57          2HB       TYR  57  -4.862 -13.385  -1.767
  402    HD1  TYR  57           HD1      TYR  57  -3.435 -13.740  -3.818
  403    HD2  TYR  57           HD2      TYR  57  -3.126 -10.228  -1.369
  404    HE1  TYR  57           HE1      TYR  57  -1.227 -13.229  -4.824
  405    HE2  TYR  57           HE2      TYR  57  -0.921  -9.719  -2.376
  406    HH   TYR  57           HH       TYR  57   0.713 -11.995  -4.457
  407    H    THR  58           H        THR  58  -4.523 -11.672  -5.024
  408    HA   THR  58           HA       THR  58  -5.229 -14.309  -6.098
  409    HB   THR  58           HB       THR  58  -7.259 -13.006  -6.546
  410    HG1  THR  58           HG1      THR  58  -7.153 -13.105  -8.871
  411   1HG2  THR  58          1HG2      THR  58  -6.084 -11.109  -8.415
  412   2HG2  THR  58          2HG2      THR  58  -5.471 -10.875  -6.777
  413   3HG2  THR  58          3HG2      THR  58  -7.207 -10.819  -7.085
  414    H    VAL  59           H        VAL  59  -4.782 -13.333  -8.874
  415    HA   VAL  59           HA       VAL  59  -2.148 -12.035  -8.881
  416    HB   VAL  59           HB       VAL  59  -1.634 -14.328  -8.147
  417   1HG1  VAL  59          1HG1      VAL  59  -2.716 -15.341 -10.770
  418   2HG1  VAL  59          2HG1      VAL  59  -3.767 -15.207  -9.360
  419   3HG1  VAL  59          3HG1      VAL  59  -2.345 -16.249  -9.305
  420   1HG2  VAL  59          1HG2      VAL  59  -0.020 -14.897  -9.883
  421   2HG2  VAL  59          2HG2      VAL  59  -0.090 -13.143  -9.721
  422   3HG2  VAL  59          3HG2      VAL  59  -0.908 -13.938 -11.067
  423    H    GLY  60           H        GLY  60  -1.305 -11.918 -11.184
  424   1HA   GLY  60          1HA       GLY  60  -3.435 -12.344 -13.225
  425   2HA   GLY  60          2HA       GLY  60  -2.693 -10.751 -13.075
  Start of MODEL   17
    1    H    PHE   5           H        PHE   5  -0.649  13.674   7.183
    2    HA   PHE   5           HA       PHE   5  -0.274  14.352   4.283
    3   1HB   PHE   5          1HB       PHE   5   1.406  12.545   4.323
    4   2HB   PHE   5          2HB       PHE   5   1.765  13.744   5.564
    5    HD1  PHE   5           HD1      PHE   5   0.328  10.380   4.949
    6    HD2  PHE   5           HD2      PHE   5   1.654  13.203   7.903
    7    HE1  PHE   5           HE1      PHE   5   0.211   8.616   6.687
    8    HE2  PHE   5           HE2      PHE   5   1.537  11.439   9.642
    9    HZ   PHE   5           HZ       PHE   5   0.814   9.145   9.034
   10    H    GLU   6           H        GLU   6  -0.296  11.941   3.112
   11    HA   GLU   6           HA       GLU   6  -2.273  10.067   4.070
   12   1HB   GLU   6          1HB       GLU   6  -3.363  12.437   3.328
   13   2HB   GLU   6          2HB       GLU   6  -3.366  11.606   1.773
   14   1HG   GLU   6          1HG       GLU   6  -4.260   9.880   3.957
   15   2HG   GLU   6          2HG       GLU   6  -5.275  11.311   3.772
   16    H    ILE   7           H        ILE   7   0.018   9.259   3.109
   17    HA   ILE   7           HA       ILE   7   1.088   8.001   1.411
   18    HB   ILE   7           HB       ILE   7  -1.659   7.821   0.152
   19   1HG1  ILE   7          1HG1      ILE   7  -1.973   7.585   2.600
   20   2HG1  ILE   7          2HG1      ILE   7  -2.236   6.052   1.777
   21   1HG2  ILE   7          1HG2      ILE   7   0.248   5.548   0.642
   22   2HG2  ILE   7          2HG2      ILE   7   0.563   6.674  -0.676
   23   3HG2  ILE   7          3HG2      ILE   7  -0.938   5.749  -0.646
   24   1HD1  ILE   7          1HD1      ILE   7  -0.819   5.306   3.431
   25   2HD1  ILE   7          2HD1      ILE   7  -0.029   6.873   3.602
   26   3HD1  ILE   7          3HD1      ILE   7   0.400   5.812   2.262
   27    HA   PRO   8           HA       PRO   8   0.564  11.766  -1.385
   28   1HB   PRO   8          1HB       PRO   8   2.997  12.915  -0.870
   29   2HB   PRO   8          2HB       PRO   8   1.532  13.285   0.060
   30   1HG   PRO   8          1HG       PRO   8   3.798  11.462   0.725
   31   2HG   PRO   8          2HG       PRO   8   2.899  12.571   1.773
   32   1HD   PRO   8          1HD       PRO   8   2.456   9.890   1.723
   33   2HD   PRO   8          2HD       PRO   8   1.196  11.079   2.119
   34    H    ASP   9           H        ASP   9   2.848  12.541  -2.775
   35    HA   ASP   9           HA       ASP   9   3.414  10.118  -4.346
   36   1HB   ASP   9          1HB       ASP   9   3.438  13.027  -4.624
   37   2HB   ASP   9          2HB       ASP   9   4.851  12.277  -5.368
   38    H    ASP  10           H        ASP  10   4.722  11.031  -1.534
   39    HA   ASP  10           HA       ASP  10   7.491  11.406  -1.864
   40   1HB   ASP  10          1HB       ASP  10   5.600  10.469   0.153
   41   2HB   ASP  10          2HB       ASP  10   7.164   9.671   0.308
   42    H    VAL  11           H        VAL  11   5.545   8.516  -2.301
   43    HA   VAL  11           HA       VAL  11   7.855   7.138  -3.529
   44    HB   VAL  11           HB       VAL  11   6.335   6.123  -1.104
   45   1HG1  VAL  11          1HG1      VAL  11   7.757   4.138  -1.269
   46   2HG1  VAL  11          2HG1      VAL  11   8.548   4.796  -2.700
   47   3HG1  VAL  11          3HG1      VAL  11   6.846   4.338  -2.765
   48   1HG2  VAL  11          1HG2      VAL  11   8.739   6.074  -0.192
   49   2HG2  VAL  11          2HG2      VAL  11   7.998   7.663  -0.376
   50   3HG2  VAL  11          3HG2      VAL  11   9.162   7.088  -1.571
   51    HA   PRO  12           HA       PRO  12   4.371   5.858  -5.961
   52   1HB   PRO  12          1HB       PRO  12   5.672   4.109  -7.616
   53   2HB   PRO  12          2HB       PRO  12   5.751   5.870  -7.797
   54   1HG   PRO  12          1HG       PRO  12   7.752   3.988  -6.683
   55   2HG   PRO  12          2HG       PRO  12   7.986   5.506  -7.550
   56   1HD   PRO  12          1HD       PRO  12   8.207   5.173  -4.802
   57   2HD   PRO  12          2HD       PRO  12   7.986   6.722  -5.638
   58    H    LEU  13           H        LEU  13   6.424   2.986  -5.791
   59    HA   LEU  13           HA       LEU  13   4.766   1.601  -3.841
   60   1HB   LEU  13          1HB       LEU  13   3.743   1.803  -6.401
   61   2HB   LEU  13          2HB       LEU  13   4.563   0.242  -6.448
   62    HG   LEU  13           HG       LEU  13   3.373  -0.373  -4.322
   63   1HD1  LEU  13          1HD1      LEU  13   2.040   2.287  -4.871
   64   2HD1  LEU  13          2HD1      LEU  13   2.876   1.784  -3.401
   65   3HD1  LEU  13          3HD1      LEU  13   1.327   1.060  -3.827
   66   1HD2  LEU  13          1HD2      LEU  13   1.747   0.372  -6.764
   67   2HD2  LEU  13          2HD2      LEU  13   1.094  -0.578  -5.429
   68   3HD2  LEU  13          3HD2      LEU  13   2.444  -1.201  -6.377
   69    HA   PRO  14           HA       PRO  14   8.600  -0.621  -4.067
   70   1HB   PRO  14          1HB       PRO  14   8.128  -2.386  -2.035
   71   2HB   PRO  14          2HB       PRO  14   8.548  -0.683  -1.775
   72   1HG   PRO  14          1HG       PRO  14   5.978  -2.052  -1.439
   73   2HG   PRO  14          2HG       PRO  14   6.559  -0.549  -0.723
   74   1HD   PRO  14          1HD       PRO  14   4.764  -0.866  -2.913
   75   2HD   PRO  14          2HD       PRO  14   5.399   0.649  -2.246
   76    H    ALA  15           H        ALA  15   9.347  -2.968  -4.301
   77    HA   ALA  15           HA       ALA  15   7.867  -4.281  -6.393
   78   1HB   ALA  15          1HB       ALA  15  10.409  -4.239  -5.659
   79   2HB   ALA  15          2HB       ALA  15   9.745  -5.668  -6.452
   80   3HB   ALA  15          3HB       ALA  15   9.941  -5.643  -4.700
   81    H    GLY  16           H        GLY  16   6.712  -6.293  -6.289
   82   1HA   GLY  16          1HA       GLY  16   5.272  -7.849  -5.326
   83   2HA   GLY  16          2HA       GLY  16   6.378  -7.870  -3.953
   84    H    TRP  17           H        TRP  17   4.890  -4.894  -5.008
   85    HA   TRP  17           HA       TRP  17   2.931  -5.062  -2.762
   86   1HB   TRP  17          1HB       TRP  17   5.291  -3.288  -3.147
   87   2HB   TRP  17          2HB       TRP  17   3.843  -2.554  -2.461
   88    HD1  TRP  17           HD1      TRP  17   6.848  -4.238  -1.397
   89    HE1  TRP  17           HE1      TRP  17   6.587  -5.240   0.971
   90    HE3  TRP  17           HE3      TRP  17   1.791  -4.058  -0.936
   91    HZ2  TRP  17           HZ2      TRP  17   4.480  -5.876   2.817
   92    HZ3  TRP  17           HZ3      TRP  17   0.666  -4.858   1.119
   93    HH2  TRP  17           HH2      TRP  17   2.005  -5.772   2.997
   94    H    GLU  18           H        GLU  18   1.477  -5.279  -4.706
   95    HA   GLU  18           HA       GLU  18   1.131  -2.882  -6.411
   96   1HB   GLU  18          1HB       GLU  18   0.762  -5.572  -6.746
   97   2HB   GLU  18          2HB       GLU  18  -0.883  -5.049  -6.367
   98   1HG   GLU  18          1HG       GLU  18  -1.120  -4.007  -8.356
   99   2HG   GLU  18          2HG       GLU  18   0.473  -3.256  -8.245
  100    H    MET  19           H        MET  19  -1.576  -2.808  -6.628
  101    HA   MET  19           HA       MET  19  -2.939  -2.688  -4.078
  102   1HB   MET  19          1HB       MET  19  -3.014  -0.266  -3.871
  103   2HB   MET  19          2HB       MET  19  -1.340  -0.811  -3.887
  104   1HG   MET  19          1HG       MET  19  -0.988  -0.054  -6.095
  105   2HG   MET  19          2HG       MET  19  -2.714   0.023  -6.441
  106   1HE   MET  19          1HE       MET  19   0.145   2.974  -4.878
  107   2HE   MET  19          2HE       MET  19  -0.257   2.791  -6.583
  108   3HE   MET  19          3HE       MET  19   0.297   1.397  -5.663
  109    H    ALA  20           H        ALA  20  -5.127  -2.168  -4.308
  110    HA   ALA  20           HA       ALA  20  -6.141  -1.402  -6.979
  111   1HB   ALA  20          1HB       ALA  20  -7.593  -3.676  -6.437
  112   2HB   ALA  20          2HB       ALA  20  -6.003  -4.106  -5.807
  113   3HB   ALA  20          3HB       ALA  20  -6.182  -3.626  -7.494
  114    H    LYS  21           H        LYS  21  -8.548  -1.049  -6.853
  115    HA   LYS  21           HA       LYS  21  -9.305  -0.177  -4.102
  116   1HB   LYS  21          1HB       LYS  21 -10.947   1.214  -5.372
  117   2HB   LYS  21          2HB       LYS  21  -9.287   1.497  -5.894
  118   1HG   LYS  21          1HG       LYS  21  -9.808   0.862  -7.990
  119   2HG   LYS  21          2HG       LYS  21 -10.384  -0.696  -7.399
  120   1HD   LYS  21          1HD       LYS  21 -12.590   0.170  -7.017
  121   2HD   LYS  21          2HD       LYS  21 -12.050   1.830  -7.271
  122   1HE   LYS  21          1HE       LYS  21 -11.501  -0.016  -9.527
  123   2HE   LYS  21          2HE       LYS  21 -13.215   0.331  -9.227
  124   1HZ   LYS  21          1HZ       LYS  21 -11.923   1.992 -10.651
  125   2HZ   LYS  21          2HZ       LYS  21 -11.163   2.467  -9.207
  126   3HZ   LYS  21          3HZ       LYS  21 -12.847   2.624  -9.375
  127    H    THR  22           H        THR  22 -10.029  -2.261  -3.324
  128    HA   THR  22           HA       THR  22 -11.905  -3.924  -4.725
  129    HB   THR  22           HB       THR  22 -10.463  -4.635  -2.846
  130    HG1  THR  22           HG1      THR  22 -12.266  -5.869  -3.140
  131   1HG2  THR  22          1HG2      THR  22 -11.142  -3.965  -0.532
  132   2HG2  THR  22          2HG2      THR  22 -12.262  -2.801  -1.240
  133   3HG2  THR  22          3HG2      THR  22 -10.526  -2.618  -1.488
  134    H    SER  23           H        SER  23 -14.213  -4.187  -4.167
  135    HA   SER  23           HA       SER  23 -16.386  -3.328  -3.842
  136   1HB   SER  23          1HB       SER  23 -16.029  -3.351  -1.552
  137   2HB   SER  23          2HB       SER  23 -14.657  -2.248  -1.650
  138    HG   SER  23           HG       SER  23 -16.252  -1.018  -0.858
  139    H    SER  24           H        SER  24 -14.899  -0.292  -2.784
  140    HA   SER  24           HA       SER  24 -15.877   0.971  -5.324
  141   1HB   SER  24          1HB       SER  24 -16.178   1.604  -2.421
  142   2HB   SER  24          2HB       SER  24 -16.044   2.964  -3.535
  143    HG   SER  24           HG       SER  24 -18.002   0.968  -3.372
  144    H    GLY  25           H        GLY  25 -14.057   2.392  -2.626
  145   1HA   GLY  25          1HA       GLY  25 -11.738   2.743  -4.479
  146   2HA   GLY  25          2HA       GLY  25 -12.337   4.092  -3.517
  147    H    GLN  26           H        GLN  26 -12.294   0.847  -2.198
  148    HA   GLN  26           HA       GLN  26 -10.717   1.660   0.083
  149   1HB   GLN  26          1HB       GLN  26 -11.712  -0.942  -1.086
  150   2HB   GLN  26          2HB       GLN  26 -10.724  -0.922   0.374
  151   1HG   GLN  26          1HG       GLN  26 -12.339   0.429   1.541
  152   2HG   GLN  26          2HG       GLN  26 -13.251   0.719   0.059
  153   1HE2  GLN  26          1HE2      GLN  26 -15.181  -0.276   1.075
  154   2HE2  GLN  26          2HE2      GLN  26 -15.289  -1.961   1.244
  155    H    ARG  27           H        ARG  27  -8.916   2.573  -1.394
  156    HA   ARG  27           HA       ARG  27  -7.212   1.060  -3.015
  157   1HB   ARG  27          1HB       ARG  27  -7.291   3.591  -1.815
  158   2HB   ARG  27          2HB       ARG  27  -5.764   2.891  -1.283
  159   1HG   ARG  27          1HG       ARG  27  -5.662   2.164  -3.861
  160   2HG   ARG  27          2HG       ARG  27  -6.672   3.602  -4.033
  161   1HD   ARG  27          1HD       ARG  27  -4.484   4.157  -2.220
  162   2HD   ARG  27          2HD       ARG  27  -3.858   3.534  -3.759
  163    HE   ARG  27           HE       ARG  27  -5.989   5.414  -4.240
  164   1HH1  ARG  27          1HH1      ARG  27  -2.653   5.215  -3.262
  165   2HH1  ARG  27          2HH1      ARG  27  -2.268   6.788  -3.867
  166   1HH2  ARG  27          1HH2      ARG  27  -5.464   7.454  -5.016
  167   2HH2  ARG  27          2HH2      ARG  27  -3.845   8.049  -4.853
  168    H    TYR  28           H        TYR  28  -6.909  -1.078  -2.144
  169    HA   TYR  28           HA       TYR  28  -5.314  -1.197   0.382
  170   1HB   TYR  28          1HB       TYR  28  -6.096  -3.473   0.549
  171   2HB   TYR  28          2HB       TYR  28  -7.487  -2.468   0.158
  172    HD1  TYR  28           HD1      TYR  28  -5.229  -5.096  -1.023
  173    HD2  TYR  28           HD2      TYR  28  -8.458  -2.491  -2.123
  174    HE1  TYR  28           HE1      TYR  28  -5.737  -6.539  -2.971
  175    HE2  TYR  28           HE2      TYR  28  -8.951  -3.923  -4.081
  176    HH   TYR  28           HH       TYR  28  -8.590  -6.075  -4.918
  177    H    PHE  29           H        PHE  29  -3.176  -1.680   0.194
  178    HA   PHE  29           HA       PHE  29  -2.057  -2.108  -2.472
  179   1HB   PHE  29          1HB       PHE  29  -0.890  -1.842   0.314
  180   2HB   PHE  29          2HB       PHE  29   0.088  -1.947  -1.153
  181    HD1  PHE  29           HD1      PHE  29  -2.522   0.069   0.582
  182    HD2  PHE  29           HD2      PHE  29   0.332  -0.071  -2.623
  183    HE1  PHE  29           HE1      PHE  29  -2.907   2.457   0.141
  184    HE2  PHE  29           HE2      PHE  29  -0.049   2.330  -3.058
  185    HZ   PHE  29           HZ       PHE  29  -1.671   3.598  -1.678
  186    H    LYS  30           H        LYS  30  -1.897  -4.058  -3.332
  187    HA   LYS  30           HA       LYS  30  -2.155  -6.525  -1.823
  188   1HB   LYS  30          1HB       LYS  30  -1.547  -5.753  -4.680
  189   2HB   LYS  30          2HB       LYS  30  -1.760  -7.428  -4.172
  190   1HG   LYS  30          1HG       LYS  30  -3.918  -5.951  -3.099
  191   2HG   LYS  30          2HG       LYS  30  -3.742  -5.427  -4.766
  192   1HD   LYS  30          1HD       LYS  30  -3.398  -8.190  -4.902
  193   2HD   LYS  30          2HD       LYS  30  -4.696  -7.988  -3.727
  194   1HE   LYS  30          1HE       LYS  30  -6.005  -7.876  -5.621
  195   2HE   LYS  30          2HE       LYS  30  -5.458  -6.189  -5.647
  196   1HZ   LYS  30          1HZ       LYS  30  -5.024  -7.491  -7.742
  197   2HZ   LYS  30          2HZ       LYS  30  -3.913  -8.420  -6.855
  198   3HZ   LYS  30          3HZ       LYS  30  -3.660  -6.752  -7.060
  199    H    ASN  31           H        ASN  31  -0.502  -8.011  -1.413
  200    HA   ASN  31           HA       ASN  31   2.292  -7.021  -1.878
  201   1HB   ASN  31          1HB       ASN  31   1.191  -7.199   0.480
  202   2HB   ASN  31          2HB       ASN  31   1.414  -8.935   0.279
  203   1HD2  ASN  31          1HD2      ASN  31   2.977  -8.593   2.191
  204   2HD2  ASN  31          2HD2      ASN  31   4.568  -8.126   1.829
  205    H    HIS  32           H        HIS  32   3.196  -8.252  -3.527
  206    HA   HIS  32           HA       HIS  32   2.331 -11.086  -3.803
  207   1HB   HIS  32          1HB       HIS  32   4.207  -9.398  -5.492
  208   2HB   HIS  32          2HB       HIS  32   3.494 -10.940  -5.951
  209    HD1  HIS  32           HD1      HIS  32   0.927 -10.966  -6.478
  210    HD2  HIS  32           HD2      HIS  32   2.455  -7.168  -5.689
  211    HE1  HIS  32           HE1      HIS  32  -0.868  -9.313  -7.167
  212    H    ILE  33           H        ILE  33   4.310  -9.695  -1.737
  213    HA   ILE  33           HA       ILE  33   6.725 -11.380  -2.161
  214    HB   ILE  33           HB       ILE  33   6.164  -9.717   0.291
  215   1HG1  ILE  33          1HG1      ILE  33   7.185  -8.502  -2.296
  216   2HG1  ILE  33          2HG1      ILE  33   5.543  -8.273  -1.684
  217   1HG2  ILE  33          1HG2      ILE  33   8.722  -9.221  -0.502
  218   2HG2  ILE  33          2HG2      ILE  33   8.479 -10.841  -1.155
  219   3HG2  ILE  33          3HG2      ILE  33   8.258 -10.542   0.569
  220   1HD1  ILE  33          1HD1      ILE  33   7.217  -6.465  -1.036
  221   2HD1  ILE  33          2HD1      ILE  33   7.986  -7.681  -0.015
  222   3HD1  ILE  33          3HD1      ILE  33   6.318  -7.198   0.293
  223    H    ASP  34           H        ASP  34   4.464 -10.637   0.476
  224    HA   ASP  34           HA       ASP  34   4.806 -13.358   1.577
  225   1HB   ASP  34          1HB       ASP  34   4.849 -11.070   2.834
  226   2HB   ASP  34          2HB       ASP  34   3.093 -11.138   2.684
  227    H    GLN  35           H        GLN  35   2.969 -12.040  -0.806
  228    HA   GLN  35           HA       GLN  35   0.947 -12.629  -1.830
  229   1HB   GLN  35          1HB       GLN  35   1.972 -14.909  -0.354
  230   2HB   GLN  35          2HB       GLN  35   0.209 -14.947  -0.404
  231   1HG   GLN  35          1HG       GLN  35   0.173 -15.368  -2.634
  232   2HG   GLN  35          2HG       GLN  35   1.448 -14.196  -2.964
  233   1HE2  GLN  35          1HE2      GLN  35   3.677 -15.083  -1.767
  234   2HE2  GLN  35          2HE2      GLN  35   4.058 -16.680  -2.197
  235    H    THR  36           H        THR  36  -0.227 -10.803  -0.907
  236    HA   THR  36           HA       THR  36  -2.534 -11.529   0.653
  237    HB   THR  36           HB       THR  36  -1.028 -11.726   2.499
  238    HG1  THR  36           HG1      THR  36  -2.640 -10.651   3.351
  239   1HG2  THR  36          1HG2      THR  36   0.887 -10.546   1.461
  240   2HG2  THR  36          2HG2      THR  36   0.581  -9.967   3.099
  241   3HG2  THR  36          3HG2      THR  36   0.061  -9.008   1.713
  242    H    THR  37           H        THR  37  -3.502  -9.395   1.662
  243    HA   THR  37           HA       THR  37  -3.019  -7.065  -0.165
  244    HB   THR  37           HB       THR  37  -5.438  -6.920  -0.536
  245    HG1  THR  37           HG1      THR  37  -6.811  -8.376   0.461
  246   1HG2  THR  37          1HG2      THR  37  -3.863  -8.813  -1.635
  247   2HG2  THR  37          2HG2      THR  37  -5.567  -8.629  -2.049
  248   3HG2  THR  37          3HG2      THR  37  -5.071  -9.849  -0.874
  249    H    THR  38           H        THR  38  -2.995  -5.120   1.007
  250    HA   THR  38           HA       THR  38  -4.165  -5.187   3.770
  251    HB   THR  38           HB       THR  38  -1.669  -5.536   3.647
  252    HG1  THR  38           HG1      THR  38  -2.203  -4.708   5.533
  253   1HG2  THR  38          1HG2      THR  38  -1.240  -2.659   3.078
  254   2HG2  THR  38          2HG2      THR  38  -1.707  -3.642   1.691
  255   3HG2  THR  38          3HG2      THR  38  -0.264  -4.054   2.619
  256    H    TRP  39           H        TRP  39  -4.787  -3.088   4.607
  257    HA   TRP  39           HA       TRP  39  -5.763  -1.234   2.569
  258   1HB   TRP  39          1HB       TRP  39  -5.782  -1.057   5.600
  259   2HB   TRP  39          2HB       TRP  39  -6.831  -0.174   4.494
  260    HD1  TRP  39           HD1      TRP  39  -6.210  -3.697   5.871
  261    HE1  TRP  39           HE1      TRP  39  -8.334  -5.105   5.498
  262    HE3  TRP  39           HE3      TRP  39  -8.957  -0.431   3.060
  263    HZ2  TRP  39           HZ2      TRP  39 -10.858  -4.880   4.185
  264    HZ3  TRP  39           HZ3      TRP  39 -11.218  -1.060   2.260
  265    HH2  TRP  39           HH2      TRP  39 -12.166  -3.285   2.819
  266    H    GLN  40           H        GLN  40  -3.445  -1.160   5.278
  267    HA   GLN  40           HA       GLN  40  -2.579   1.502   5.171
  268   1HB   GLN  40          1HB       GLN  40  -1.069  -1.090   5.628
  269   2HB   GLN  40          2HB       GLN  40  -0.415   0.501   6.014
  270   1HG   GLN  40          1HG       GLN  40  -2.657   0.807   7.338
  271   2HG   GLN  40          2HG       GLN  40  -2.722  -0.954   7.281
  272   1HE2  GLN  40          1HE2      GLN  40  -1.775  -1.883   9.097
  273   2HE2  GLN  40          2HE2      GLN  40  -0.464  -1.236   9.957
  274    H    ASP  41           H        ASP  41  -0.388   2.236   4.227
  275    HA   ASP  41           HA       ASP  41  -0.202   1.255   1.406
  276   1HB   ASP  41          1HB       ASP  41   0.499   3.915   2.677
  277   2HB   ASP  41          2HB       ASP  41   0.589   3.555   0.955
  278    HA   PRO  42           HA       PRO  42   3.911   0.000   2.554
  279   1HB   PRO  42          1HB       PRO  42   4.807  -0.650   0.062
  280   2HB   PRO  42          2HB       PRO  42   3.705  -1.682   0.986
  281   1HG   PRO  42          1HG       PRO  42   3.142   0.163  -1.271
  282   2HG   PRO  42          2HG       PRO  42   2.399  -1.391  -0.871
  283   1HD   PRO  42          1HD       PRO  42   1.275   1.079  -0.360
  284   2HD   PRO  42          2HD       PRO  42   0.845  -0.425   0.480
  285    H    ARG  43           H        ARG  43   3.097   2.554   0.350
  286    HA   ARG  43           HA       ARG  43   5.758   3.493  -0.267
  287   1HB   ARG  43          1HB       ARG  43   3.068   4.898  -0.148
  288   2HB   ARG  43          2HB       ARG  43   4.496   5.499  -0.988
  289   1HG   ARG  43          1HG       ARG  43   4.336   3.923  -2.671
  290   2HG   ARG  43          2HG       ARG  43   3.551   2.736  -1.630
  291   1HD   ARG  43          1HD       ARG  43   1.977   3.703  -3.331
  292   2HD   ARG  43          2HD       ARG  43   1.465   4.062  -1.672
  293    HE   ARG  43           HE       ARG  43   3.193   6.150  -2.411
  294   1HH1  ARG  43          1HH1      ARG  43   0.186   4.799  -3.527
  295   2HH1  ARG  43          2HH1      ARG  43  -0.388   6.307  -4.149
  296   1HH2  ARG  43          1HH2      ARG  43   2.427   8.096  -3.228
  297   2HH2  ARG  43          2HH2      ARG  43   0.870   8.161  -3.982
  298    H    LYS  44           H        LYS  44   3.309   5.138   1.764
  299    HA   LYS  44           HA       LYS  44   5.513   5.871   3.660
  300   1HB   LYS  44          1HB       LYS  44   4.867   7.698   2.101
  301   2HB   LYS  44          2HB       LYS  44   3.203   7.571   2.669
  302   1HG   LYS  44          1HG       LYS  44   3.665   8.601   4.659
  303   2HG   LYS  44          2HG       LYS  44   5.270   7.878   4.776
  304   1HD   LYS  44          1HD       LYS  44   6.255   9.526   3.456
  305   2HD   LYS  44          2HD       LYS  44   4.742   9.920   2.641
  306   1HE   LYS  44          1HE       LYS  44   4.890  11.745   4.080
  307   2HE   LYS  44          2HE       LYS  44   4.040  10.612   5.148
  308   1HZ   LYS  44          1HZ       LYS  44   6.994  10.927   4.945
  309   2HZ   LYS  44          2HZ       LYS  44   6.184   9.835   5.964
  310   3HZ   LYS  44          3HZ       LYS  44   6.034  11.509   6.216
  311    H    ALA  45           H        ALA  45   4.670   4.027   4.966
  312    HA   ALA  45           HA       ALA  45   2.591   4.912   6.836
  313   1HB   ALA  45          1HB       ALA  45   1.704   3.716   4.573
  314   2HB   ALA  45          2HB       ALA  45   0.883   3.546   6.125
  315   3HB   ALA  45          3HB       ALA  45   1.988   2.289   5.570
  316    H    MET  46           H        MET  46   4.993   4.514   7.756
  317    HA   MET  46           HA       MET  46   5.196   1.659   8.652
  318   1HB   MET  46          1HB       MET  46   7.022   3.537   7.514
  319   2HB   MET  46          2HB       MET  46   7.547   3.221   9.168
  320   1HG   MET  46          1HG       MET  46   7.526   0.813   8.750
  321   2HG   MET  46          2HG       MET  46   6.895   1.075   7.124
  322   1HE   MET  46          1HE       MET  46   9.197  -0.660   7.745
  323   2HE   MET  46          2HE       MET  46  10.582  -0.198   6.760
  324   3HE   MET  46          3HE       MET  46   8.989  -0.333   6.019
  325    H    LEU  47           H        LEU  47   5.106   5.031   9.696
  326    HA   LEU  47           HA       LEU  47   5.827   4.696  12.429
  327   1HB   LEU  47          1HB       LEU  47   5.637   6.852  11.286
  328   2HB   LEU  47          2HB       LEU  47   3.908   6.599  11.050
  329    HG   LEU  47           HG       LEU  47   3.669   6.469  13.559
  330   1HD1  LEU  47          1HD1      LEU  47   6.507   6.410  13.390
  331   2HD1  LEU  47          2HD1      LEU  47   5.513   6.383  14.847
  332   3HD1  LEU  47          3HD1      LEU  47   6.069   7.921  14.187
  333   1HD2  LEU  47          1HD2      LEU  47   3.091   8.635  13.363
  334   2HD2  LEU  47          2HD2      LEU  47   4.023   8.729  11.869
  335   3HD2  LEU  47          3HD2      LEU  47   4.789   9.110  13.410
  336    H    SER  48           H        SER  48   3.003   3.673  10.727
  337    HA   SER  48           HA       SER  48   1.031   3.754  12.782
  338   1HB   SER  48          1HB       SER  48   0.395   3.299  10.534
  339   2HB   SER  48          2HB       SER  48   1.568   1.991  10.385
  340    HG   SER  48           HG       SER  48   0.117   0.696  11.122
  341    H    GLN  49           H        GLN  49   3.659   1.474  12.138
  342    HA   GLN  49           HA       GLN  49   2.715  -0.433  14.177
  343   1HB   GLN  49          1HB       GLN  49   3.842  -1.057  12.026
  344   2HB   GLN  49          2HB       GLN  49   5.309  -0.267  12.608
  345   1HG   GLN  49          1HG       GLN  49   5.549  -2.601  13.116
  346   2HG   GLN  49          2HG       GLN  49   5.181  -1.793  14.641
  347   1HE2  GLN  49          1HE2      GLN  49   3.276  -3.172  11.887
  348   2HE2  GLN  49          2HE2      GLN  49   2.150  -3.964  12.879
  349    H    MET  50           H        MET  50   3.530  -0.567  16.265
  350    HA   MET  50           HA       MET  50   5.990   0.889  17.016
  351   1HB   MET  50          1HB       MET  50   3.253   1.876  17.385
  352   2HB   MET  50          2HB       MET  50   4.167   1.821  18.893
  353   1HG   MET  50          1HG       MET  50   5.690   2.873  16.599
  354   2HG   MET  50          2HG       MET  50   4.307   3.865  17.062
  355   1HE   MET  50          1HE       MET  50   4.979   5.411  20.256
  356   2HE   MET  50          2HE       MET  50   3.795   4.785  19.111
  357   3HE   MET  50          3HE       MET  50   5.005   5.946  18.570
  358   1H    GLY  51          1H        GLY  51  -9.423  -3.249  11.095
  359   2H    GLY  51          2H        GLY  51 -10.228  -4.573  11.793
  360   3H    GLY  51          3H        GLY  51  -9.999  -3.146  12.687
  361   1HA   GLY  51          1HA       GLY  51 -12.132  -2.784  12.073
  362   2HA   GLY  51          2HA       GLY  51 -11.314  -2.113  10.660
  363    H    THR  52           H        THR  52 -11.720  -3.046   8.695
  364    HA   THR  52           HA       THR  52 -13.448  -5.485   8.680
  365    HB   THR  52           HB       THR  52 -14.107  -4.652   6.465
  366    HG1  THR  52           HG1      THR  52 -12.335  -2.499   6.924
  367   1HG2  THR  52          1HG2      THR  52 -14.925  -2.351   7.179
  368   2HG2  THR  52          2HG2      THR  52 -14.014  -2.585   8.670
  369   3HG2  THR  52          3HG2      THR  52 -15.341  -3.674   8.268
  370    HA   PRO  53           HA       PRO  53 -10.158  -7.820   6.906
  371   1HB   PRO  53          1HB       PRO  53 -11.577  -9.662   5.461
  372   2HB   PRO  53          2HB       PRO  53 -11.454  -9.706   7.229
  373   1HG   PRO  53          1HG       PRO  53 -13.668  -8.710   5.502
  374   2HG   PRO  53          2HG       PRO  53 -13.745  -9.608   7.024
  375   1HD   PRO  53          1HD       PRO  53 -14.147  -6.911   6.830
  376   2HD   PRO  53          2HD       PRO  53 -13.541  -7.713   8.294
  377    HA   PRO  54           HA       PRO  54  -9.601  -5.912   2.936
  378   1HB   PRO  54          1HB       PRO  54  -7.433  -7.363   2.090
  379   2HB   PRO  54          2HB       PRO  54  -7.323  -6.061   3.290
  380   1HG   PRO  54          1HG       PRO  54  -7.456  -9.020   3.700
  381   2HG   PRO  54          2HG       PRO  54  -6.429  -7.821   4.501
  382   1HD   PRO  54          1HD       PRO  54  -8.653  -8.819   5.662
  383   2HD   PRO  54          2HD       PRO  54  -8.113  -7.146   5.931
  384    HA   PRO  55           HA       PRO  55 -11.424  -8.472  -0.130
  385   1HB   PRO  55          1HB       PRO  55  -9.980  -7.942  -2.401
  386   2HB   PRO  55          2HB       PRO  55 -11.115  -6.782  -1.682
  387   1HG   PRO  55          1HG       PRO  55  -8.147  -6.908  -1.462
  388   2HG   PRO  55          2HG       PRO  55  -9.201  -5.504  -1.676
  389   1HD   PRO  55          1HD       PRO  55  -8.126  -6.185   0.714
  390   2HD   PRO  55          2HD       PRO  55  -9.703  -5.380   0.564
  391    HA   PRO  56           HA       PRO  56  -9.228 -12.244  -0.729
  392   1HB   PRO  56          1HB       PRO  56  -9.887 -13.034  -3.271
  393   2HB   PRO  56          2HB       PRO  56 -11.027 -13.106  -1.912
  394   1HG   PRO  56          1HG       PRO  56 -10.784 -11.065  -4.071
  395   2HG   PRO  56          2HG       PRO  56 -12.237 -11.776  -3.351
  396   1HD   PRO  56          1HD       PRO  56 -11.325  -9.314  -2.681
  397   2HD   PRO  56          2HD       PRO  56 -12.198 -10.361  -1.542
  398    H    TYR  57           H        TYR  57  -7.354 -13.208  -1.906
  399    HA   TYR  57           HA       TYR  57  -5.832 -11.103  -3.396
  400   1HB   TYR  57          1HB       TYR  57  -5.016 -11.876  -1.154
  401   2HB   TYR  57          2HB       TYR  57  -4.828 -13.495  -1.832
  402    HD1  TYR  57           HD1      TYR  57  -2.551 -13.924  -2.158
  403    HD2  TYR  57           HD2      TYR  57  -4.147 -10.082  -3.216
  404    HE1  TYR  57           HE1      TYR  57  -0.360 -13.273  -3.112
  405    HE2  TYR  57           HE2      TYR  57  -1.957  -9.428  -4.163
  406    HH   TYR  57           HH       TYR  57   0.631 -11.739  -4.557
  407    H    THR  58           H        THR  58  -4.355 -11.902  -5.082
  408    HA   THR  58           HA       THR  58  -4.680 -14.609  -6.147
  409    HB   THR  58           HB       THR  58  -5.559 -13.378  -8.358
  410    HG1  THR  58           HG1      THR  58  -6.741 -11.866  -6.282
  411   1HG2  THR  58          1HG2      THR  58  -7.536 -14.434  -7.928
  412   2HG2  THR  58          2HG2      THR  58  -7.679 -13.734  -6.316
  413   3HG2  THR  58          3HG2      THR  58  -6.609 -15.110  -6.588
  414    H    VAL  59           H        VAL  59  -3.834 -14.193  -8.736
  415    HA   VAL  59           HA       VAL  59  -1.709 -12.234  -8.948
  416    HB   VAL  59           HB       VAL  59  -0.733 -13.710  -7.258
  417   1HG1  VAL  59          1HG1      VAL  59  -0.460 -16.085  -8.919
  418   2HG1  VAL  59          2HG1      VAL  59  -2.155 -15.696  -8.627
  419   3HG1  VAL  59          3HG1      VAL  59  -1.060 -15.943  -7.267
  420   1HG2  VAL  59          1HG2      VAL  59   0.522 -12.906  -9.504
  421   2HG2  VAL  59          2HG2      VAL  59   0.701 -14.650  -9.692
  422   3HG2  VAL  59          3HG2      VAL  59   1.333 -13.849  -8.254
  423    H    GLY  60           H        GLY  60  -3.074 -12.158 -10.973
  424   1HA   GLY  60          1HA       GLY  60  -1.820 -13.191 -13.230
  425   2HA   GLY  60          2HA       GLY  60  -3.032 -14.402 -12.811
  Start of MODEL   18
    1    H    PHE   5           H        PHE   5  -1.947  14.672   4.493
    2    HA   PHE   5           HA       PHE   5  -0.727  14.128   1.804
    3   1HB   PHE   5          1HB       PHE   5   0.526  15.526   3.597
    4   2HB   PHE   5          2HB       PHE   5   0.709  13.997   4.456
    5    HD1  PHE   5           HD1      PHE   5   1.533  15.834   1.350
    6    HD2  PHE   5           HD2      PHE   5   2.174  12.260   3.645
    7    HE1  PHE   5           HE1      PHE   5   3.437  15.232  -0.121
    8    HE2  PHE   5           HE2      PHE   5   4.078  11.658   2.174
    9    HZ   PHE   5           HZ       PHE   5   4.710  13.143   0.292
   10    H    GLU   6           H        GLU   6  -1.510  12.091   1.298
   11    HA   GLU   6           HA       GLU   6  -0.946   9.897   3.231
   12   1HB   GLU   6          1HB       GLU   6  -3.520  11.049   2.602
   13   2HB   GLU   6          2HB       GLU   6  -3.474   9.369   2.067
   14   1HG   GLU   6          1HG       GLU   6  -2.463   8.856   4.388
   15   2HG   GLU   6          2HG       GLU   6  -3.032  10.461   4.844
   16    H    ILE   7           H        ILE   7   0.736   9.415   1.595
   17    HA   ILE   7           HA       ILE   7   1.532   8.259  -0.309
   18    HB   ILE   7           HB       ILE   7  -1.285   7.135  -0.339
   19   1HG1  ILE   7          1HG1      ILE   7  -0.431   7.095   1.976
   20   2HG1  ILE   7          2HG1      ILE   7  -0.477   5.468   1.301
   21   1HG2  ILE   7          1HG2      ILE   7   0.952   5.306  -0.701
   22   2HG2  ILE   7          2HG2      ILE   7   0.987   6.613  -1.885
   23   3HG2  ILE   7          3HG2      ILE   7  -0.442   5.587  -1.747
   24   1HD1  ILE   7          1HD1      ILE   7   2.006   6.042   0.579
   25   2HD1  ILE   7          2HD1      ILE   7   1.661   5.493   2.218
   26   3HD1  ILE   7          3HD1      ILE   7   1.889   7.210   1.894
   27    HA   PRO   8           HA       PRO   8  -1.043  11.164  -2.967
   28   1HB   PRO   8          1HB       PRO   8   0.896  13.045  -3.426
   29   2HB   PRO   8          2HB       PRO   8  -0.240  13.130  -2.069
   30   1HG   PRO   8          1HG       PRO   8   2.601  12.234  -2.118
   31   2HG   PRO   8          2HG       PRO   8   1.729  13.156  -0.884
   32   1HD   PRO   8          1HD       PRO   8   2.276  10.484  -0.682
   33   2HD   PRO   8          2HD       PRO   8   0.909  11.282   0.125
   34    H    ASP   9           H        ASP   9   2.293  11.752  -3.964
   35    HA   ASP   9           HA       ASP   9   2.195   9.559  -5.955
   36   1HB   ASP   9          1HB       ASP   9   1.071  11.964  -6.553
   37   2HB   ASP   9          2HB       ASP   9   2.735  12.260  -7.061
   38    H    ASP  10           H        ASP  10   3.948  10.789  -3.652
   39    HA   ASP  10           HA       ASP  10   6.408  11.692  -4.816
   40   1HB   ASP  10          1HB       ASP  10   5.329  10.794  -2.233
   41   2HB   ASP  10          2HB       ASP  10   7.044  10.429  -2.433
   42    H    VAL  11           H        VAL  11   6.293   8.642  -3.013
   43    HA   VAL  11           HA       VAL  11   8.060   7.416  -5.044
   44    HB   VAL  11           HB       VAL  11   8.270   5.684  -3.231
   45   1HG1  VAL  11          1HG1      VAL  11   9.790   7.647  -3.389
   46   2HG1  VAL  11          2HG1      VAL  11   9.558   7.114  -1.724
   47   3HG1  VAL  11          3HG1      VAL  11   8.707   8.538  -2.321
   48   1HG2  VAL  11          1HG2      VAL  11   6.759   7.581  -1.456
   49   2HG2  VAL  11          2HG2      VAL  11   7.189   5.897  -1.162
   50   3HG2  VAL  11          3HG2      VAL  11   5.918   6.292  -2.317
   51    HA   PRO  12           HA       PRO  12   4.622   5.128  -6.651
   52   1HB   PRO  12          1HB       PRO  12   6.008   3.243  -8.066
   53   2HB   PRO  12          2HB       PRO  12   5.831   4.921  -8.615
   54   1HG   PRO  12          1HG       PRO  12   8.138   3.583  -7.297
   55   2HG   PRO  12          2HG       PRO  12   8.123   4.809  -8.571
   56   1HD   PRO  12          1HD       PRO  12   8.639   5.330  -5.922
   57   2HD   PRO  12          2HD       PRO  12   8.019   6.531  -7.074
   58    H    LEU  13           H        LEU  13   4.296   2.486  -6.942
   59    HA   LEU  13           HA       LEU  13   4.210   1.443  -4.242
   60   1HB   LEU  13          1HB       LEU  13   3.564   0.543  -7.029
   61   2HB   LEU  13          2HB       LEU  13   3.624  -0.672  -5.754
   62    HG   LEU  13           HG       LEU  13   1.985   1.877  -5.618
   63   1HD1  LEU  13          1HD1      LEU  13   0.741  -0.826  -5.802
   64   2HD1  LEU  13          2HD1      LEU  13   1.414  -0.148  -7.284
   65   3HD1  LEU  13          3HD1      LEU  13   0.156   0.723  -6.408
   66   1HD2  LEU  13          1HD2      LEU  13   1.244  -0.375  -3.915
   67   2HD2  LEU  13          2HD2      LEU  13   1.530   1.309  -3.479
   68   3HD2  LEU  13          3HD2      LEU  13   2.883   0.186  -3.593
   69    HA   PRO  14           HA       PRO  14   8.254  -0.359  -4.332
   70   1HB   PRO  14          1HB       PRO  14   8.053  -1.938  -2.110
   71   2HB   PRO  14          2HB       PRO  14   8.271  -0.181  -2.046
   72   1HG   PRO  14          1HG       PRO  14   5.864  -1.803  -1.547
   73   2HG   PRO  14          2HG       PRO  14   6.317  -0.230  -0.895
   74   1HD   PRO  14          1HD       PRO  14   4.468  -0.718  -2.949
   75   2HD   PRO  14          2HD       PRO  14   5.146   0.858  -2.498
   76    H    ALA  15           H        ALA  15   9.248  -2.675  -4.208
   77    HA   ALA  15           HA       ALA  15   8.022  -4.323  -6.212
   78   1HB   ALA  15          1HB       ALA  15   9.948  -5.672  -5.878
   79   2HB   ALA  15          2HB       ALA  15  10.078  -5.206  -4.182
   80   3HB   ALA  15          3HB       ALA  15  10.479  -4.046  -5.449
   81    H    GLY  16           H        GLY  16   6.774  -6.206  -6.009
   82   1HA   GLY  16          1HA       GLY  16   5.387  -7.779  -4.995
   83   2HA   GLY  16          2HA       GLY  16   6.448  -7.691  -3.592
   84    H    TRP  17           H        TRP  17   4.893  -4.858  -4.908
   85    HA   TRP  17           HA       TRP  17   2.855  -4.901  -2.734
   86   1HB   TRP  17          1HB       TRP  17   5.167  -3.038  -3.159
   87   2HB   TRP  17          2HB       TRP  17   3.689  -2.417  -2.429
   88    HD1  TRP  17           HD1      TRP  17   6.829  -4.010  -1.505
   89    HE1  TRP  17           HE1      TRP  17   6.702  -4.984   0.885
   90    HE3  TRP  17           HE3      TRP  17   1.810  -3.856  -0.783
   91    HZ2  TRP  17           HZ2      TRP  17   4.698  -5.614   2.847
   92    HZ3  TRP  17           HZ3      TRP  17   0.793  -4.635   1.326
   93    HH2  TRP  17           HH2      TRP  17   2.232  -5.519   3.153
   94    H    GLU  18           H        GLU  18   1.338  -5.122  -4.582
   95    HA   GLU  18           HA       GLU  18   1.198  -2.775  -6.424
   96   1HB   GLU  18          1HB       GLU  18   0.929  -5.394  -6.926
   97   2HB   GLU  18          2HB       GLU  18  -0.746  -5.046  -6.496
   98   1HG   GLU  18          1HG       GLU  18  -1.113  -3.815  -8.363
   99   2HG   GLU  18          2HG       GLU  18   0.489  -3.075  -8.308
  100    H    MET  19           H        MET  19  -1.495  -2.655  -6.819
  101    HA   MET  19           HA       MET  19  -2.775  -2.241  -4.169
  102   1HB   MET  19          1HB       MET  19  -1.299  -0.282  -5.176
  103   2HB   MET  19          2HB       MET  19  -2.768   0.017  -6.094
  104   1HG   MET  19          1HG       MET  19  -3.996  -0.123  -3.832
  105   2HG   MET  19          2HG       MET  19  -2.401   0.051  -3.103
  106   1HE   MET  19          1HE       MET  19  -0.751   1.471  -4.432
  107   2HE   MET  19          2HE       MET  19  -0.983   3.217  -4.430
  108   3HE   MET  19          3HE       MET  19  -1.336   2.291  -5.887
  109    H    ALA  20           H        ALA  20  -5.063  -1.648  -4.409
  110    HA   ALA  20           HA       ALA  20  -6.346  -1.769  -7.016
  111   1HB   ALA  20          1HB       ALA  20  -7.467  -4.040  -5.927
  112   2HB   ALA  20          2HB       ALA  20  -5.786  -4.178  -5.411
  113   3HB   ALA  20          3HB       ALA  20  -6.174  -4.040  -7.127
  114    H    LYS  21           H        LYS  21  -8.579  -1.211  -6.810
  115    HA   LYS  21           HA       LYS  21  -9.324  -0.224  -4.104
  116   1HB   LYS  21          1HB       LYS  21 -10.530   0.254  -6.850
  117   2HB   LYS  21          2HB       LYS  21 -10.914   1.149  -5.379
  118   1HG   LYS  21          1HG       LYS  21  -8.093   1.203  -5.633
  119   2HG   LYS  21          2HG       LYS  21  -8.744   1.572  -7.230
  120   1HD   LYS  21          1HD       LYS  21 -10.363   3.156  -5.896
  121   2HD   LYS  21          2HD       LYS  21  -9.128   3.050  -4.641
  122   1HE   LYS  21          1HE       LYS  21  -7.963   3.516  -7.287
  123   2HE   LYS  21          2HE       LYS  21  -9.075   4.808  -6.797
  124   1HZ   LYS  21          1HZ       LYS  21  -7.935   4.599  -4.536
  125   2HZ   LYS  21          2HZ       LYS  21  -7.060   5.366  -5.774
  126   3HZ   LYS  21          3HZ       LYS  21  -6.710   3.757  -5.353
  127    H    THR  22           H        THR  22 -10.037  -2.253  -3.183
  128    HA   THR  22           HA       THR  22 -11.940  -3.988  -4.473
  129    HB   THR  22           HB       THR  22 -10.443  -4.627  -2.609
  130    HG1  THR  22           HG1      THR  22 -12.282  -5.847  -2.837
  131   1HG2  THR  22          1HG2      THR  22 -12.194  -2.731  -1.025
  132   2HG2  THR  22          2HG2      THR  22 -10.463  -2.566  -1.321
  133   3HG2  THR  22          3HG2      THR  22 -11.062  -3.873  -0.301
  134    H    SER  23           H        SER  23 -14.236  -4.214  -3.816
  135    HA   SER  23           HA       SER  23 -16.390  -3.334  -3.423
  136   1HB   SER  23          1HB       SER  23 -14.562  -2.399  -1.338
  137   2HB   SER  23          2HB       SER  23 -15.934  -1.315  -1.559
  138    HG   SER  23           HG       SER  23 -15.869  -3.695  -0.373
  139    H    SER  24           H        SER  24 -14.781  -0.251  -2.712
  140    HA   SER  24           HA       SER  24 -15.874   0.819  -5.294
  141   1HB   SER  24          1HB       SER  24 -17.332   1.490  -3.520
  142   2HB   SER  24          2HB       SER  24 -15.975   1.886  -2.465
  143    HG   SER  24           HG       SER  24 -16.717   3.784  -3.322
  144    H    GLY  25           H        GLY  25 -14.083   2.481  -2.715
  145   1HA   GLY  25          1HA       GLY  25 -11.864   2.915  -4.679
  146   2HA   GLY  25          2HA       GLY  25 -12.421   4.175  -3.581
  147    H    GLN  26           H        GLN  26 -12.301   0.944  -2.337
  148    HA   GLN  26           HA       GLN  26 -10.419   1.681  -0.270
  149   1HB   GLN  26          1HB       GLN  26 -11.679  -0.874  -1.277
  150   2HB   GLN  26          2HB       GLN  26 -10.537  -0.886   0.065
  151   1HG   GLN  26          1HG       GLN  26 -11.943   0.500   1.404
  152   2HG   GLN  26          2HG       GLN  26 -12.956   0.929   0.025
  153   1HE2  GLN  26          1HE2      GLN  26 -14.951  -0.090   0.292
  154   2HE2  GLN  26          2HE2      GLN  26 -15.163  -1.697   0.792
  155    H    ARG  27           H        ARG  27  -8.640   2.464  -1.744
  156    HA   ARG  27           HA       ARG  27  -7.249   0.737  -3.563
  157   1HB   ARG  27          1HB       ARG  27  -5.468   2.458  -3.301
  158   2HB   ARG  27          2HB       ARG  27  -7.052   3.191  -3.519
  159   1HG   ARG  27          1HG       ARG  27  -7.016   4.124  -1.459
  160   2HG   ARG  27          2HG       ARG  27  -6.446   2.629  -0.713
  161   1HD   ARG  27          1HD       ARG  27  -4.373   3.516  -0.551
  162   2HD   ARG  27          2HD       ARG  27  -4.316   3.690  -2.314
  163    HE   ARG  27           HE       ARG  27  -5.000   5.800  -0.396
  164   1HH1  ARG  27          1HH1      ARG  27  -5.353   4.626  -3.655
  165   2HH1  ARG  27          2HH1      ARG  27  -5.698   6.194  -4.298
  166   1HH2  ARG  27          1HH2      ARG  27  -5.448   7.822  -1.255
  167   2HH2  ARG  27          2HH2      ARG  27  -5.752   7.990  -2.952
  168    H    TYR  28           H        TYR  28  -7.326  -1.226  -1.953
  169    HA   TYR  28           HA       TYR  28  -5.468  -1.155   0.286
  170   1HB   TYR  28          1HB       TYR  28  -5.946  -3.548   0.396
  171   2HB   TYR  28          2HB       TYR  28  -7.441  -2.660   0.120
  172    HD1  TYR  28           HD1      TYR  28  -4.919  -4.898  -1.408
  173    HD2  TYR  28           HD2      TYR  28  -8.611  -2.790  -1.990
  174    HE1  TYR  28           HE1      TYR  28  -5.408  -6.283  -3.399
  175    HE2  TYR  28           HE2      TYR  28  -9.091  -4.167  -3.986
  176    HH   TYR  28           HH       TYR  28  -8.483  -6.276  -4.948
  177    H    PHE  29           H        PHE  29  -3.333  -1.812   0.301
  178    HA   PHE  29           HA       PHE  29  -2.018  -1.906  -2.315
  179   1HB   PHE  29          1HB       PHE  29  -1.101  -1.805   0.559
  180   2HB   PHE  29          2HB       PHE  29   0.019  -1.838  -0.808
  181    HD1  PHE  29           HD1      PHE  29  -2.664   0.085   0.859
  182    HD2  PHE  29           HD2      PHE  29   0.229   0.063  -2.314
  183    HE1  PHE  29           HE1      PHE  29  -3.073   2.491   0.472
  184    HE2  PHE  29           HE2      PHE  29  -0.175   2.472  -2.696
  185    HZ   PHE  29           HZ       PHE  29  -1.828   3.689  -1.306
  186    H    LYS  30           H        LYS  30  -2.096  -3.776  -3.316
  187    HA   LYS  30           HA       LYS  30  -2.313  -6.393  -2.231
  188   1HB   LYS  30          1HB       LYS  30  -1.218  -5.195  -4.757
  189   2HB   LYS  30          2HB       LYS  30  -1.408  -6.933  -4.567
  190   1HG   LYS  30          1HG       LYS  30  -3.784  -5.361  -3.861
  191   2HG   LYS  30          2HG       LYS  30  -3.300  -5.193  -5.539
  192   1HD   LYS  30          1HD       LYS  30  -3.025  -7.840  -5.359
  193   2HD   LYS  30          2HD       LYS  30  -4.227  -7.637  -4.087
  194   1HE   LYS  30          1HE       LYS  30  -5.253  -6.053  -6.100
  195   2HE   LYS  30          2HE       LYS  30  -4.534  -7.396  -7.007
  196   1HZ   LYS  30          1HZ       LYS  30  -6.744  -8.013  -6.302
  197   2HZ   LYS  30          2HZ       LYS  30  -6.392  -7.607  -4.691
  198   3HZ   LYS  30          3HZ       LYS  30  -5.617  -8.928  -5.426
  199    H    ASN  31           H        ASN  31  -0.680  -7.880  -1.703
  200    HA   ASN  31           HA       ASN  31   2.131  -6.835  -1.734
  201   1HB   ASN  31          1HB       ASN  31   0.999  -6.837   0.500
  202   2HB   ASN  31          2HB       ASN  31   0.763  -8.576   0.343
  203   1HD2  ASN  31          1HD2      ASN  31   3.662  -6.669  -0.598
  204   2HD2  ASN  31          2HD2      ASN  31   4.716  -7.460   0.467
  205    H    HIS  32           H        HIS  32   3.105  -8.060  -3.366
  206    HA   HIS  32           HA       HIS  32   2.333 -10.922  -3.613
  207   1HB   HIS  32          1HB       HIS  32   4.331  -9.308  -5.231
  208   2HB   HIS  32          2HB       HIS  32   3.549 -10.810  -5.703
  209    HD1  HIS  32           HD1      HIS  32   1.333 -10.616  -6.898
  210    HD2  HIS  32           HD2      HIS  32   2.400  -7.059  -5.003
  211    HE1  HIS  32           HE1      HIS  32  -0.433  -8.904  -7.524
  212    H    ILE  33           H        ILE  33   4.234  -9.352  -1.521
  213    HA   ILE  33           HA       ILE  33   6.758 -10.795  -1.733
  214    HB   ILE  33           HB       ILE  33   5.378  -9.258   0.503
  215   1HG1  ILE  33          1HG1      ILE  33   5.833  -7.828  -1.420
  216   2HG1  ILE  33          2HG1      ILE  33   7.006  -7.468  -0.150
  217   1HG2  ILE  33          1HG2      ILE  33   6.988 -10.484   1.649
  218   2HG2  ILE  33          2HG2      ILE  33   7.912  -9.051   1.194
  219   3HG2  ILE  33          3HG2      ILE  33   8.078 -10.541   0.262
  220   1HD1  ILE  33          1HD1      ILE  33   7.445  -9.159  -2.622
  221   2HD1  ILE  33          2HD1      ILE  33   8.571  -9.130  -1.265
  222   3HD1  ILE  33          3HD1      ILE  33   8.263  -7.658  -2.186
  223    H    ASP  34           H        ASP  34   3.945 -10.910   0.442
  224    HA   ASP  34           HA       ASP  34   4.624 -13.758   1.041
  225   1HB   ASP  34          1HB       ASP  34   4.652 -11.757   2.797
  226   2HB   ASP  34          2HB       ASP  34   2.912 -12.048   2.815
  227    H    GLN  35           H        GLN  35   2.779 -12.247  -1.023
  228    HA   GLN  35           HA       GLN  35   0.722 -12.685  -2.066
  229   1HB   GLN  35          1HB       GLN  35   1.712 -15.087  -0.837
  230   2HB   GLN  35          2HB       GLN  35  -0.047 -15.071  -0.712
  231   1HG   GLN  35          1HG       GLN  35  -0.345 -15.181  -2.986
  232   2HG   GLN  35          2HG       GLN  35   1.110 -14.243  -3.326
  233   1HE2  GLN  35          1HE2      GLN  35   3.121 -15.398  -3.560
  234   2HE2  GLN  35          2HE2      GLN  35   3.202 -17.093  -3.582
  235    H    THR  36           H        THR  36  -0.294 -10.846  -0.935
  236    HA   THR  36           HA       THR  36  -2.699 -11.533   0.467
  237    HB   THR  36           HB       THR  36  -1.553 -10.178   2.601
  238    HG1  THR  36           HG1      THR  36   0.461 -10.762   2.803
  239   1HG2  THR  36          1HG2      THR  36  -2.541 -11.932   3.584
  240   2HG2  THR  36          2HG2      THR  36  -1.243 -12.987   3.023
  241   3HG2  THR  36          3HG2      THR  36  -2.669 -12.732   2.017
  242    H    THR  37           H        THR  37  -3.885  -9.562   1.189
  243    HA   THR  37           HA       THR  37  -2.907  -7.093  -0.216
  244    HB   THR  37           HB       THR  37  -5.278  -6.616  -0.568
  245    HG1  THR  37           HG1      THR  37  -5.838  -8.981   0.875
  246   1HG2  THR  37          1HG2      THR  37  -5.468  -8.109  -2.248
  247   2HG2  THR  37          2HG2      THR  37  -5.504  -9.475  -1.132
  248   3HG2  THR  37          3HG2      THR  37  -3.960  -8.800  -1.650
  249    H    THR  38           H        THR  38  -2.708  -5.210   1.063
  250    HA   THR  38           HA       THR  38  -3.730  -5.431   3.883
  251    HB   THR  38           HB       THR  38  -1.230  -5.727   3.470
  252    HG1  THR  38           HG1      THR  38  -0.724  -4.276   5.194
  253   1HG2  THR  38          1HG2      THR  38  -1.414  -2.757   2.863
  254   2HG2  THR  38          2HG2      THR  38  -1.015  -4.012   1.692
  255   3HG2  THR  38          3HG2      THR  38   0.076  -3.685   3.037
  256    H    TRP  39           H        TRP  39  -4.250  -3.382   4.917
  257    HA   TRP  39           HA       TRP  39  -5.401  -1.406   3.082
  258   1HB   TRP  39          1HB       TRP  39  -5.249  -1.549   6.112
  259   2HB   TRP  39          2HB       TRP  39  -6.307  -0.489   5.186
  260    HD1  TRP  39           HD1      TRP  39  -5.807  -4.164   6.120
  261    HE1  TRP  39           HE1      TRP  39  -8.002  -5.433   5.662
  262    HE3  TRP  39           HE3      TRP  39  -8.478  -0.496   3.770
  263    HZ2  TRP  39           HZ2      TRP  39 -10.549  -4.958   4.463
  264    HZ3  TRP  39           HZ3      TRP  39 -10.786  -0.938   2.979
  265    HH2  TRP  39           HH2      TRP  39 -11.820  -3.167   3.322
  266    H    GLN  40           H        GLN  40  -2.774  -1.679   5.432
  267    HA   GLN  40           HA       GLN  40  -1.939   0.973   5.736
  268   1HB   GLN  40          1HB       GLN  40  -1.035  -1.582   6.321
  269   2HB   GLN  40          2HB       GLN  40   0.235  -0.942   5.279
  270   1HG   GLN  40          1HG       GLN  40  -0.151   1.210   6.855
  271   2HG   GLN  40          2HG       GLN  40  -0.622  -0.056   7.989
  272   1HE2  GLN  40          1HE2      GLN  40   1.982   0.339   5.503
  273   2HE2  GLN  40          2HE2      GLN  40   3.228  -0.208   6.519
  274    H    ASP  41           H        ASP  41   0.236   1.785   4.691
  275    HA   ASP  41           HA       ASP  41   0.010   1.467   1.718
  276   1HB   ASP  41          1HB       ASP  41   0.752   3.902   3.366
  277   2HB   ASP  41          2HB       ASP  41   0.553   3.856   1.615
  278    HA   PRO  42           HA       PRO  42   4.292   0.204   2.548
  279   1HB   PRO  42          1HB       PRO  42   4.711  -0.886   0.076
  280   2HB   PRO  42          2HB       PRO  42   3.880  -1.753   1.380
  281   1HG   PRO  42          1HG       PRO  42   2.741  -0.292  -0.958
  282   2HG   PRO  42          2HG       PRO  42   2.242  -1.831  -0.244
  283   1HD   PRO  42          1HD       PRO  42   0.951   0.514   0.220
  284   2HD   PRO  42          2HD       PRO  42   1.003  -0.810   1.400
  285    H    ARG  43           H        ARG  43   2.908   2.109  -0.034
  286    HA   ARG  43           HA       ARG  43   5.182   3.040  -1.416
  287   1HB   ARG  43          1HB       ARG  43   2.490   3.457  -1.432
  288   2HB   ARG  43          2HB       ARG  43   3.044   4.989  -0.757
  289   1HG   ARG  43          1HG       ARG  43   3.687   5.671  -2.799
  290   2HG   ARG  43          2HG       ARG  43   4.767   4.283  -2.935
  291   1HD   ARG  43          1HD       ARG  43   3.240   4.084  -4.778
  292   2HD   ARG  43          2HD       ARG  43   2.648   2.931  -3.567
  293    HE   ARG  43           HE       ARG  43   0.781   4.349  -3.214
  294   1HH1  ARG  43          1HH1      ARG  43   3.321   6.027  -4.904
  295   2HH1  ARG  43          2HH1      ARG  43   2.350   7.429  -5.194
  296   1HH2  ARG  43          1HH2      ARG  43  -0.458   6.181  -3.603
  297   2HH2  ARG  43          2HH2      ARG  43   0.228   7.518  -4.464
  298    H    LYS  44           H        LYS  44   3.504   4.931   1.128
  299    HA   LYS  44           HA       LYS  44   6.105   5.610   2.370
  300   1HB   LYS  44          1HB       LYS  44   5.010   7.140   0.316
  301   2HB   LYS  44          2HB       LYS  44   4.527   7.998   1.779
  302   1HG   LYS  44          1HG       LYS  44   6.916   7.887   2.553
  303   2HG   LYS  44          2HG       LYS  44   7.342   7.200   0.985
  304   1HD   LYS  44          1HD       LYS  44   6.690   9.186  -0.170
  305   2HD   LYS  44          2HD       LYS  44   5.871   9.829   1.253
  306   1HE   LYS  44          1HE       LYS  44   8.037  10.955   0.998
  307   2HE   LYS  44          2HE       LYS  44   8.111   9.899   2.421
  308   1HZ   LYS  44          1HZ       LYS  44   8.971   9.156  -0.331
  309   2HZ   LYS  44          2HZ       LYS  44   9.057   8.157   1.041
  310   3HZ   LYS  44          3HZ       LYS  44  10.020   9.554   0.941
  311    H    ALA  45           H        ALA  45   5.120   4.567   4.245
  312    HA   ALA  45           HA       ALA  45   3.411   6.403   5.801
  313   1HB   ALA  45          1HB       ALA  45   2.565   3.605   4.981
  314   2HB   ALA  45          2HB       ALA  45   1.818   5.113   4.455
  315   3HB   ALA  45          3HB       ALA  45   1.702   4.614   6.142
  316    H    MET  46           H        MET  46   5.752   6.132   6.769
  317    HA   MET  46           HA       MET  46   5.530   4.366   9.090
  318   1HB   MET  46          1HB       MET  46   6.248   2.812   7.320
  319   2HB   MET  46          2HB       MET  46   7.603   3.870   6.926
  320   1HG   MET  46          1HG       MET  46   8.723   3.391   8.933
  321   2HG   MET  46          2HG       MET  46   7.250   2.842   9.734
  322   1HE   MET  46          1HE       MET  46   9.298   0.757  10.388
  323   2HE   MET  46          2HE       MET  46  10.245   1.786   9.316
  324   3HE   MET  46          3HE       MET  46  10.175   0.050   9.023
  325    H    LEU  47           H        LEU  47   8.010   6.048   7.110
  326    HA   LEU  47           HA       LEU  47   8.906   7.435   9.618
  327   1HB   LEU  47          1HB       LEU  47  10.290   5.635   8.108
  328   2HB   LEU  47          2HB       LEU  47  10.758   7.142   7.321
  329    HG   LEU  47           HG       LEU  47  10.977   7.843   9.952
  330   1HD1  LEU  47          1HD1      LEU  47  11.922   6.061  11.221
  331   2HD1  LEU  47          2HD1      LEU  47  12.058   5.023   9.801
  332   3HD1  LEU  47          3HD1      LEU  47  10.472   5.383  10.482
  333   1HD2  LEU  47          1HD2      LEU  47  13.378   7.662   9.611
  334   2HD2  LEU  47          2HD2      LEU  47  12.630   8.139   8.086
  335   3HD2  LEU  47          3HD2      LEU  47  13.143   6.470   8.333
  336    H    SER  48           H        SER  48   6.893   8.708   8.311
  337    HA   SER  48           HA       SER  48   7.781  10.433   6.146
  338   1HB   SER  48          1HB       SER  48   5.463   9.911   6.332
  339   2HB   SER  48          2HB       SER  48   5.428  10.332   8.044
  340    HG   SER  48           HG       SER  48   5.497  12.436   7.556
  341    H    GLN  49           H        GLN  49   6.434  11.656   9.192
  342    HA   GLN  49           HA       GLN  49   8.912  13.139   9.825
  343   1HB   GLN  49          1HB       GLN  49   6.798  14.182   8.192
  344   2HB   GLN  49          2HB       GLN  49   6.801  15.063   9.720
  345   1HG   GLN  49          1HG       GLN  49   9.477  14.942   9.194
  346   2HG   GLN  49          2HG       GLN  49   8.821  15.027   7.558
  347   1HE2  GLN  49          1HE2      GLN  49   8.886  16.735  10.697
  348   2HE2  GLN  49          2HE2      GLN  49   8.414  18.241  10.072
  349    H    MET  50           H        MET  50   5.434  12.696  10.503
  350    HA   MET  50           HA       MET  50   4.273  12.648  12.563
  351   1HB   MET  50          1HB       MET  50   6.509  11.014  12.620
  352   2HB   MET  50          2HB       MET  50   6.688  11.969  14.091
  353   1HG   MET  50          1HG       MET  50   4.056  10.676  13.374
  354   2HG   MET  50          2HG       MET  50   5.304   9.789  14.249
  355   1HE   MET  50          1HE       MET  50   2.880   9.737  15.295
  356   2HE   MET  50          2HE       MET  50   2.034  11.282  15.287
  357   3HE   MET  50          3HE       MET  50   2.592  10.598  16.812
  358   1H    GLY  51          1H        GLY  51 -14.116  -7.224  12.617
  359   2H    GLY  51          2H        GLY  51 -12.806  -7.294  13.697
  360   3H    GLY  51          3H        GLY  51 -12.812  -8.262  12.300
  361   1HA   GLY  51          1HA       GLY  51 -12.814  -5.297  12.235
  362   2HA   GLY  51          2HA       GLY  51 -11.345  -6.272  12.155
  363    H    THR  52           H        THR  52 -13.159  -4.567  10.178
  364    HA   THR  52           HA       THR  52 -14.119  -6.157   8.078
  365    HB   THR  52           HB       THR  52 -13.217  -4.083   6.719
  366    HG1  THR  52           HG1      THR  52 -12.646  -2.393   8.073
  367   1HG2  THR  52          1HG2      THR  52 -15.559  -4.494   7.575
  368   2HG2  THR  52          2HG2      THR  52 -15.100  -2.794   7.486
  369   3HG2  THR  52          3HG2      THR  52 -15.105  -3.626   9.041
  370    HA   PRO  53           HA       PRO  53 -10.107  -8.041   7.106
  371   1HB   PRO  53          1HB       PRO  53 -11.127 -10.040   5.539
  372   2HB   PRO  53          2HB       PRO  53 -11.085 -10.125   7.309
  373   1HG   PRO  53          1HG       PRO  53 -13.347  -9.444   5.492
  374   2HG   PRO  53          2HG       PRO  53 -13.347 -10.401   6.980
  375   1HD   PRO  53          1HD       PRO  53 -14.185  -7.804   6.848
  376   2HD   PRO  53          2HD       PRO  53 -13.518  -8.548   8.316
  377    HA   PRO  54           HA       PRO  54  -9.571  -6.052   3.196
  378   1HB   PRO  54          1HB       PRO  54  -7.337  -7.367   2.307
  379   2HB   PRO  54          2HB       PRO  54  -7.294  -6.124   3.573
  380   1HG   PRO  54          1HG       PRO  54  -7.298  -9.102   3.831
  381   2HG   PRO  54          2HG       PRO  54  -6.339  -7.900   4.708
  382   1HD   PRO  54          1HD       PRO  54  -8.535  -9.062   5.776
  383   2HD   PRO  54          2HD       PRO  54  -8.064  -7.389   6.153
  384    HA   PRO  55           HA       PRO  55 -11.248  -8.552  -0.004
  385   1HB   PRO  55          1HB       PRO  55  -9.818  -7.833  -2.233
  386   2HB   PRO  55          2HB       PRO  55 -11.020  -6.773  -1.470
  387   1HG   PRO  55          1HG       PRO  55  -8.052  -6.748  -1.236
  388   2HG   PRO  55          2HG       PRO  55  -9.184  -5.397  -1.377
  389   1HD   PRO  55          1HD       PRO  55  -8.071  -6.153   0.977
  390   2HD   PRO  55          2HD       PRO  55  -9.684  -5.413   0.864
  391    HA   PRO  56           HA       PRO  56  -8.864 -12.174  -0.768
  392   1HB   PRO  56          1HB       PRO  56  -9.409 -12.846  -3.370
  393   2HB   PRO  56          2HB       PRO  56 -10.580 -13.053  -2.051
  394   1HG   PRO  56          1HG       PRO  56 -10.380 -10.872  -4.075
  395   2HG   PRO  56          2HG       PRO  56 -11.815 -11.704  -3.452
  396   1HD   PRO  56          1HD       PRO  56 -11.076  -9.250  -2.596
  397   2HD   PRO  56          2HD       PRO  56 -11.899 -10.421  -1.546
  398    H    TYR  57           H        TYR  57  -7.499 -13.055  -3.079
  399    HA   TYR  57           HA       TYR  57  -5.776 -10.790  -3.936
  400   1HB   TYR  57          1HB       TYR  57  -5.007 -11.756  -1.726
  401   2HB   TYR  57          2HB       TYR  57  -4.705 -13.273  -2.569
  402    HD1  TYR  57           HD1      TYR  57  -4.104  -9.650  -3.384
  403    HD2  TYR  57           HD2      TYR  57  -2.452 -13.592  -2.990
  404    HE1  TYR  57           HE1      TYR  57  -1.894  -8.800  -4.117
  405    HE2  TYR  57           HE2      TYR  57  -0.247 -12.744  -3.732
  406    HH   TYR  57           HH       TYR  57   0.776 -10.972  -4.780
  407    H    THR  58           H        THR  58  -4.468 -11.338  -5.796
  408    HA   THR  58           HA       THR  58  -5.207 -13.928  -7.121
  409    HB   THR  58           HB       THR  58  -4.993 -11.119  -8.244
  410    HG1  THR  58           HG1      THR  58  -7.134 -12.942  -7.891
  411   1HG2  THR  58          1HG2      THR  58  -4.311 -12.307 -10.086
  412   2HG2  THR  58          2HG2      THR  58  -6.049 -12.544 -10.258
  413   3HG2  THR  58          3HG2      THR  58  -5.056 -13.804  -9.527
  414    H    VAL  59           H        VAL  59  -2.667 -12.070  -5.926
  415    HA   VAL  59           HA       VAL  59  -0.330 -12.167  -6.245
  416    HB   VAL  59           HB       VAL  59  -1.090 -14.723  -7.698
  417   1HG1  VAL  59          1HG1      VAL  59   1.163 -15.399  -6.601
  418   2HG1  VAL  59          2HG1      VAL  59   1.427 -13.664  -6.422
  419   3HG1  VAL  59          3HG1      VAL  59   1.217 -14.363  -8.028
  420   1HG2  VAL  59          1HG2      VAL  59  -2.119 -14.430  -5.392
  421   2HG2  VAL  59          2HG2      VAL  59  -0.475 -14.379  -4.755
  422   3HG2  VAL  59          3HG2      VAL  59  -1.060 -15.830  -5.566
  423    H    GLY  60           H        GLY  60   1.375 -12.284  -8.064
  424   1HA   GLY  60          1HA       GLY  60   0.915 -12.333 -10.789
  425   2HA   GLY  60          2HA       GLY  60   0.422 -10.706 -10.319
  Start of MODEL   19
    1    H    PHE   5           H        PHE   5  -7.643  12.009   6.327
    2    HA   PHE   5           HA       PHE   5  -5.011  10.569   6.382
    3   1HB   PHE   5          1HB       PHE   5  -6.717   9.542   7.851
    4   2HB   PHE   5          2HB       PHE   5  -7.830   9.446   6.486
    5    HD1  PHE   5           HD1      PHE   5  -8.053   7.228   5.798
    6    HD2  PHE   5           HD2      PHE   5  -4.165   8.722   6.848
    7    HE1  PHE   5           HE1      PHE   5  -7.041   5.068   5.121
    8    HE2  PHE   5           HE2      PHE   5  -3.152   6.561   6.170
    9    HZ   PHE   5           HZ       PHE   5  -4.590   4.734   5.306
   10    H    GLU   6           H        GLU   6  -4.249  10.084   4.352
   11    HA   GLU   6           HA       GLU   6  -5.935   9.388   2.113
   12   1HB   GLU   6          1HB       GLU   6  -5.941  12.065   2.730
   13   2HB   GLU   6          2HB       GLU   6  -4.645  11.981   1.536
   14   1HG   GLU   6          1HG       GLU   6  -6.173  10.773  -0.007
   15   2HG   GLU   6          2HG       GLU   6  -7.471  10.943   1.175
   16    H    ILE   7           H        ILE   7  -4.582   8.037   0.999
   17    HA   ILE   7           HA       ILE   7  -1.680   8.186   1.312
   18    HB   ILE   7           HB       ILE   7  -3.415   6.528  -0.550
   19   1HG1  ILE   7          1HG1      ILE   7  -4.123   6.315   1.815
   20   2HG1  ILE   7          2HG1      ILE   7  -3.362   4.831   1.240
   21   1HG2  ILE   7          1HG2      ILE   7  -1.028   6.478  -1.113
   22   2HG2  ILE   7          2HG2      ILE   7  -1.510   4.937  -0.406
   23   3HG2  ILE   7          3HG2      ILE   7  -0.623   6.113   0.563
   24   1HD1  ILE   7          1HD1      ILE   7  -2.548   6.574   3.406
   25   2HD1  ILE   7          2HD1      ILE   7  -1.254   6.422   2.217
   26   3HD1  ILE   7          3HD1      ILE   7  -1.931   4.979   2.973
   27    HA   PRO   8           HA       PRO   8  -1.031  10.834  -2.181
   28   1HB   PRO   8          1HB       PRO   8   1.620  10.309  -2.618
   29   2HB   PRO   8          2HB       PRO   8   1.043  11.323  -1.282
   30   1HG   PRO   8          1HG       PRO   8   1.921   8.475  -1.271
   31   2HG   PRO   8          2HG       PRO   8   2.193   9.744  -0.067
   32   1HD   PRO   8          1HD       PRO   8   0.308   7.784   0.195
   33   2HD   PRO   8          2HD       PRO   8   0.185   9.383   0.958
   34    H    ASP   9           H        ASP   9  -0.742  10.638  -4.491
   35    HA   ASP   9           HA       ASP   9  -0.824   7.810  -5.476
   36   1HB   ASP   9          1HB       ASP   9  -2.021   8.880  -7.411
   37   2HB   ASP   9          2HB       ASP   9  -2.839   9.123  -5.868
   38    H    ASP  10           H        ASP  10   1.599   9.621  -4.951
   39    HA   ASP  10           HA       ASP  10   2.699   9.641  -7.743
   40   1HB   ASP  10          1HB       ASP  10   2.453  11.654  -5.824
   41   2HB   ASP  10          2HB       ASP  10   4.144  11.168  -5.713
   42    H    VAL  11           H        VAL  11   3.037   8.367  -4.524
   43    HA   VAL  11           HA       VAL  11   5.771   7.737  -4.370
   44    HB   VAL  11           HB       VAL  11   4.913   5.881  -2.919
   45   1HG1  VAL  11          1HG1      VAL  11   5.076   8.258  -2.137
   46   2HG1  VAL  11          2HG1      VAL  11   3.817   7.337  -1.314
   47   3HG1  VAL  11          3HG1      VAL  11   3.385   8.475  -2.591
   48   1HG2  VAL  11          1HG2      VAL  11   2.125   6.627  -3.078
   49   2HG2  VAL  11          2HG2      VAL  11   2.852   5.027  -3.227
   50   3HG2  VAL  11          3HG2      VAL  11   2.696   6.060  -4.648
   51    HA   PRO  12           HA       PRO  12   6.196   4.875  -7.733
   52   1HB   PRO  12          1HB       PRO  12   8.607   3.790  -7.041
   53   2HB   PRO  12          2HB       PRO  12   8.440   5.406  -7.749
   54   1HG   PRO  12          1HG       PRO  12   8.861   4.605  -4.914
   55   2HG   PRO  12          2HG       PRO  12   9.524   5.981  -5.807
   56   1HD   PRO  12          1HD       PRO  12   7.423   6.150  -4.049
   57   2HD   PRO  12          2HD       PRO  12   7.695   7.285  -5.388
   58    H    LEU  13           H        LEU  13   5.673   4.010  -4.499
   59    HA   LEU  13           HA       LEU  13   4.927   2.010  -3.498
   60   1HB   LEU  13          1HB       LEU  13   4.318   1.865  -6.370
   61   2HB   LEU  13          2HB       LEU  13   4.490   0.277  -5.630
   62    HG   LEU  13           HG       LEU  13   2.151   1.142  -5.524
   63   1HD1  LEU  13          1HD1      LEU  13   3.140  -0.400  -3.788
   64   2HD1  LEU  13          2HD1      LEU  13   1.788   0.572  -3.217
   65   3HD1  LEU  13          3HD1      LEU  13   3.435   1.019  -2.787
   66   1HD2  LEU  13          1HD2      LEU  13   2.565   3.516  -5.336
   67   2HD2  LEU  13          2HD2      LEU  13   3.471   3.286  -3.841
   68   3HD2  LEU  13          3HD2      LEU  13   1.731   2.995  -3.872
   69    HA   PRO  14           HA       PRO  14   8.625  -0.403  -3.533
   70   1HB   PRO  14          1HB       PRO  14   7.938  -2.202  -1.585
   71   2HB   PRO  14          2HB       PRO  14   8.396  -0.525  -1.249
   72   1HG   PRO  14          1HG       PRO  14   5.768  -1.805  -1.113
   73   2HG   PRO  14          2HG       PRO  14   6.335  -0.315  -0.359
   74   1HD   PRO  14          1HD       PRO  14   4.720  -0.617  -2.697
   75   2HD   PRO  14          2HD       PRO  14   5.277   0.888  -1.948
   76    H    ALA  15           H        ALA  15   9.299  -2.785  -3.789
   77    HA   ALA  15           HA       ALA  15   7.878  -3.971  -6.010
   78   1HB   ALA  15          1HB       ALA  15  10.343  -4.033  -5.556
   79   2HB   ALA  15          2HB       ALA  15   9.659  -5.632  -5.849
   80   3HB   ALA  15          3HB       ALA  15  10.028  -5.119  -4.202
   81    H    GLY  16           H        GLY  16   6.695  -5.968  -6.037
   82   1HA   GLY  16          1HA       GLY  16   5.229  -7.570  -5.198
   83   2HA   GLY  16          2HA       GLY  16   6.278  -7.648  -3.784
   84    H    TRP  17           H        TRP  17   4.696  -4.721  -4.912
   85    HA   TRP  17           HA       TRP  17   2.752  -4.897  -2.671
   86   1HB   TRP  17          1HB       TRP  17   5.004  -3.012  -3.082
   87   2HB   TRP  17          2HB       TRP  17   3.538  -2.392  -2.337
   88    HD1  TRP  17           HD1      TRP  17   6.672  -4.014  -1.411
   89    HE1  TRP  17           HE1      TRP  17   6.514  -5.053   0.945
   90    HE3  TRP  17           HE3      TRP  17   1.638  -3.918  -0.771
   91    HZ2  TRP  17           HZ2      TRP  17   4.487  -5.754   2.854
   92    HZ3  TRP  17           HZ3      TRP  17   0.599  -4.768   1.302
   93    HH2  TRP  17           HH2      TRP  17   2.017  -5.693   3.123
   94    H    GLU  18           H        GLU  18   1.499  -5.234  -4.833
   95    HA   GLU  18           HA       GLU  18   1.030  -2.844  -6.478
   96   1HB   GLU  18          1HB       GLU  18   0.734  -5.552  -6.790
   97   2HB   GLU  18          2HB       GLU  18  -0.925  -5.070  -6.438
   98   1HG   GLU  18          1HG       GLU  18  -0.429  -5.046  -8.873
   99   2HG   GLU  18          2HG       GLU  18  -0.893  -3.459  -8.264
  100    H    MET  19           H        MET  19  -1.657  -2.697  -6.692
  101    HA   MET  19           HA       MET  19  -2.979  -2.625  -4.099
  102   1HB   MET  19          1HB       MET  19  -3.080  -0.191  -3.943
  103   2HB   MET  19          2HB       MET  19  -1.403  -0.728  -3.976
  104   1HG   MET  19          1HG       MET  19  -1.126  -0.081  -6.248
  105   2HG   MET  19          2HG       MET  19  -2.864   0.093  -6.491
  106   1HE   MET  19          1HE       MET  19   0.105   1.927  -6.534
  107   2HE   MET  19          2HE       MET  19   0.352   1.457  -4.855
  108   3HE   MET  19          3HE       MET  19   0.127   3.156  -5.262
  109    H    ALA  20           H        ALA  20  -5.184  -1.875  -4.268
  110    HA   ALA  20           HA       ALA  20  -6.342  -1.065  -6.797
  111   1HB   ALA  20          1HB       ALA  20  -6.337  -3.965  -5.921
  112   2HB   ALA  20          2HB       ALA  20  -5.741  -3.303  -7.441
  113   3HB   ALA  20          3HB       ALA  20  -7.474  -3.339  -7.115
  114    H    LYS  21           H        LYS  21  -8.873  -1.447  -6.603
  115    HA   LYS  21           HA       LYS  21  -9.611  -0.760  -3.794
  116   1HB   LYS  21          1HB       LYS  21 -11.657   0.137  -4.924
  117   2HB   LYS  21          2HB       LYS  21 -10.169   0.835  -5.564
  118   1HG   LYS  21          1HG       LYS  21 -10.671   0.077  -7.622
  119   2HG   LYS  21          2HG       LYS  21 -10.765  -1.575  -7.013
  120   1HD   LYS  21          1HD       LYS  21 -13.072  -1.417  -6.582
  121   2HD   LYS  21          2HD       LYS  21 -13.043   0.347  -6.578
  122   1HE   LYS  21          1HE       LYS  21 -13.970  -0.092  -8.690
  123   2HE   LYS  21          2HE       LYS  21 -12.247   0.009  -9.095
  124   1HZ   LYS  21          1HZ       LYS  21 -12.181  -2.449  -8.522
  125   2HZ   LYS  21          2HZ       LYS  21 -12.965  -2.039  -9.973
  126   3HZ   LYS  21          3HZ       LYS  21 -13.876  -2.418  -8.589
  127    H    THR  22           H        THR  22 -10.940  -2.128  -2.611
  128    HA   THR  22           HA       THR  22 -11.765  -4.675  -3.894
  129    HB   THR  22           HB       THR  22 -11.707  -3.717  -1.014
  130    HG1  THR  22           HG1      THR  22  -9.751  -4.504  -0.970
  131   1HG2  THR  22          1HG2      THR  22 -12.505  -6.303  -2.305
  132   2HG2  THR  22          2HG2      THR  22 -13.250  -5.458  -0.948
  133   3HG2  THR  22          3HG2      THR  22 -11.738  -6.333  -0.718
  134    H    SER  23           H        SER  23 -13.174  -2.125  -4.391
  135    HA   SER  23           HA       SER  23 -15.883  -2.989  -4.334
  136   1HB   SER  23          1HB       SER  23 -15.911  -2.854  -1.974
  137   2HB   SER  23          2HB       SER  23 -14.899  -1.409  -1.956
  138    HG   SER  23           HG       SER  23 -16.591  -0.199  -2.294
  139    H    SER  24           H        SER  24 -14.885   0.234  -3.240
  140    HA   SER  24           HA       SER  24 -15.618   1.302  -5.948
  141   1HB   SER  24          1HB       SER  24 -16.545   1.834  -3.244
  142   2HB   SER  24          2HB       SER  24 -15.932   3.305  -3.999
  143    HG   SER  24           HG       SER  24 -18.244   2.134  -4.412
  144    H    GLY  25           H        GLY  25 -13.914   2.384  -2.979
  145   1HA   GLY  25          1HA       GLY  25 -11.575   3.092  -4.675
  146   2HA   GLY  25          2HA       GLY  25 -12.270   4.337  -3.642
  147    H    GLN  26           H        GLN  26 -12.376   1.086  -2.448
  148    HA   GLN  26           HA       GLN  26 -10.786   1.749  -0.123
  149   1HB   GLN  26          1HB       GLN  26 -11.685  -0.908  -1.296
  150   2HB   GLN  26          2HB       GLN  26 -11.118  -0.666   0.355
  151   1HG   GLN  26          1HG       GLN  26 -13.112   1.282  -0.042
  152   2HG   GLN  26          2HG       GLN  26 -13.755  -0.199  -0.753
  153   1HE2  GLN  26          1HE2      GLN  26 -12.885  -2.216   0.860
  154   2HE2  GLN  26          2HE2      GLN  26 -13.362  -1.978   2.471
  155    H    ARG  27           H        ARG  27  -8.931   2.548  -1.609
  156    HA   ARG  27           HA       ARG  27  -7.336   0.859  -3.194
  157   1HB   ARG  27          1HB       ARG  27  -7.284   3.464  -2.147
  158   2HB   ARG  27          2HB       ARG  27  -5.779   2.727  -1.606
  159   1HG   ARG  27          1HG       ARG  27  -5.720   1.848  -4.112
  160   2HG   ARG  27          2HG       ARG  27  -6.737   3.266  -4.386
  161   1HD   ARG  27          1HD       ARG  27  -4.520   3.956  -2.653
  162   2HD   ARG  27          2HD       ARG  27  -3.923   3.226  -4.155
  163    HE   ARG  27           HE       ARG  27  -6.087   5.142  -4.591
  164   1HH1  ARG  27          1HH1      ARG  27  -2.655   4.730  -4.177
  165   2HH1  ARG  27          2HH1      ARG  27  -2.267   6.186  -5.027
  166   1HH2  ARG  27          1HH2      ARG  27  -5.558   7.026  -5.690
  167   2HH2  ARG  27          2HH2      ARG  27  -3.896   7.478  -5.877
  168    H    TYR  28           H        TYR  28  -7.062  -1.216  -2.231
  169    HA   TYR  28           HA       TYR  28  -5.519  -1.272   0.322
  170   1HB   TYR  28          1HB       TYR  28  -6.372  -3.474   0.594
  171   2HB   TYR  28          2HB       TYR  28  -7.720  -2.556  -0.064
  172    HD1  TYR  28           HD1      TYR  28  -5.276  -5.200  -0.686
  173    HD2  TYR  28           HD2      TYR  28  -8.408  -2.847  -2.429
  174    HE1  TYR  28           HE1      TYR  28  -5.495  -6.848  -2.519
  175    HE2  TYR  28           HE2      TYR  28  -8.617  -4.487  -4.272
  176    HH   TYR  28           HH       TYR  28  -8.087  -7.014  -4.550
  177    H    PHE  29           H        PHE  29  -3.369  -1.799   0.221
  178    HA   PHE  29           HA       PHE  29  -2.175  -2.162  -2.419
  179   1HB   PHE  29          1HB       PHE  29  -1.136  -1.923   0.405
  180   2HB   PHE  29          2HB       PHE  29  -0.073  -2.089  -0.995
  181    HD1  PHE  29           HD1      PHE  29  -2.632   0.041   0.619
  182    HD2  PHE  29           HD2      PHE  29   0.199  -0.288  -2.588
  183    HE1  PHE  29           HE1      PHE  29  -2.912   2.451   0.133
  184    HE2  PHE  29           HE2      PHE  29  -0.074   2.127  -3.074
  185    HZ   PHE  29           HZ       PHE  29  -1.631   3.497  -1.715
  186    H    LYS  30           H        LYS  30  -1.954  -4.057  -3.351
  187    HA   LYS  30           HA       LYS  30  -2.217  -6.597  -1.959
  188   1HB   LYS  30          1HB       LYS  30  -1.477  -5.717  -4.748
  189   2HB   LYS  30          2HB       LYS  30  -1.736  -7.402  -4.309
  190   1HG   LYS  30          1HG       LYS  30  -3.915  -5.900  -3.315
  191   2HG   LYS  30          2HG       LYS  30  -3.648  -5.373  -4.961
  192   1HD   LYS  30          1HD       LYS  30  -3.365  -8.183  -5.001
  193   2HD   LYS  30          2HD       LYS  30  -4.796  -7.858  -4.025
  194   1HE   LYS  30          1HE       LYS  30  -5.407  -6.187  -5.971
  195   2HE   LYS  30          2HE       LYS  30  -4.283  -7.186  -6.913
  196   1HZ   LYS  30          1HZ       LYS  30  -5.500  -9.121  -6.418
  197   2HZ   LYS  30          2HZ       LYS  30  -6.682  -7.970  -6.821
  198   3HZ   LYS  30          3HZ       LYS  30  -6.393  -8.361  -5.193
  199    H    ASN  31           H        ASN  31  -0.564  -7.864  -1.271
  200    HA   ASN  31           HA       ASN  31   2.230  -6.881  -1.720
  201   1HB   ASN  31          1HB       ASN  31   1.082  -7.063   0.596
  202   2HB   ASN  31          2HB       ASN  31   1.265  -8.805   0.398
  203   1HD2  ASN  31          1HD2      ASN  31   2.760  -8.440   2.386
  204   2HD2  ASN  31          2HD2      ASN  31   4.380  -8.046   2.068
  205    H    HIS  32           H        HIS  32   3.080  -8.075  -3.461
  206    HA   HIS  32           HA       HIS  32   2.334 -10.937  -3.706
  207   1HB   HIS  32          1HB       HIS  32   4.250  -9.194  -5.300
  208   2HB   HIS  32          2HB       HIS  32   3.638 -10.771  -5.786
  209    HD1  HIS  32           HD1      HIS  32   1.051 -10.925  -6.333
  210    HD2  HIS  32           HD2      HIS  32   2.476  -7.053  -5.743
  211    HE1  HIS  32           HE1      HIS  32  -0.753  -9.361  -7.178
  212    H    ILE  33           H        ILE  33   4.321  -9.344  -1.663
  213    HA   ILE  33           HA       ILE  33   6.845 -10.738  -1.929
  214    HB   ILE  33           HB       ILE  33   5.457  -9.355   0.402
  215   1HG1  ILE  33          1HG1      ILE  33   5.725  -7.813  -1.463
  216   2HG1  ILE  33          2HG1      ILE  33   6.955  -7.442  -0.250
  217   1HG2  ILE  33          1HG2      ILE  33   7.215 -10.606   1.353
  218   2HG2  ILE  33          2HG2      ILE  33   7.937  -9.021   1.079
  219   3HG2  ILE  33          3HG2      ILE  33   8.271 -10.346  -0.035
  220   1HD1  ILE  33          1HD1      ILE  33   7.334  -9.017  -2.807
  221   2HD1  ILE  33          2HD1      ILE  33   8.545  -8.939  -1.527
  222   3HD1  ILE  33          3HD1      ILE  33   8.072  -7.472  -2.383
  223    H    ASP  34           H        ASP  34   4.062 -11.017   0.254
  224    HA   ASP  34           HA       ASP  34   4.799 -13.879   0.688
  225   1HB   ASP  34          1HB       ASP  34   3.872 -11.678   2.519
  226   2HB   ASP  34          2HB       ASP  34   3.523 -13.355   2.938
  227    H    GLN  35           H        GLN  35   2.897 -12.358  -1.214
  228    HA   GLN  35           HA       GLN  35   0.758 -12.678  -2.119
  229   1HB   GLN  35          1HB       GLN  35   0.938 -15.185  -0.414
  230   2HB   GLN  35          2HB       GLN  35  -0.110 -14.955  -1.813
  231   1HG   GLN  35          1HG       GLN  35   1.865 -14.664  -3.257
  232   2HG   GLN  35          2HG       GLN  35   2.923 -14.865  -1.860
  233   1HE2  GLN  35          1HE2      GLN  35   1.761 -17.022  -0.523
  234   2HE2  GLN  35          2HE2      GLN  35   1.770 -18.398  -1.518
  235    H    THR  36           H        THR  36  -0.107 -10.849  -0.844
  236    HA   THR  36           HA       THR  36  -2.354 -11.629   0.844
  237    HB   THR  36           HB       THR  36  -1.169 -10.051   2.708
  238    HG1  THR  36           HG1      THR  36   0.890  -9.974   2.424
  239   1HG2  THR  36          1HG2      THR  36  -0.167 -12.734   3.053
  240   2HG2  THR  36          2HG2      THR  36  -1.799 -12.780   2.387
  241   3HG2  THR  36          3HG2      THR  36  -1.487 -11.926   3.900
  242    H    THR  37           H        THR  37  -3.360  -9.538   1.828
  243    HA   THR  37           HA       THR  37  -2.879  -7.190   0.018
  244    HB   THR  37           HB       THR  37  -5.344  -6.989  -0.122
  245    HG1  THR  37           HG1      THR  37  -5.459  -9.438   1.276
  246   1HG2  THR  37          1HG2      THR  37  -4.126  -9.665  -0.779
  247   2HG2  THR  37          2HG2      THR  37  -4.429  -8.307  -1.858
  248   3HG2  THR  37          3HG2      THR  37  -5.779  -9.257  -1.236
  249    H    THR  38           H        THR  38  -3.049  -5.148   1.098
  250    HA   THR  38           HA       THR  38  -3.905  -5.205   3.962
  251    HB   THR  38           HB       THR  38  -1.419  -5.625   3.640
  252    HG1  THR  38           HG1      THR  38  -1.703  -4.860   5.582
  253   1HG2  THR  38          1HG2      THR  38  -1.177  -4.049   1.697
  254   2HG2  THR  38          2HG2      THR  38  -0.005  -3.758   2.982
  255   3HG2  THR  38          3HG2      THR  38  -1.408  -2.704   2.815
  256    H    TRP  39           H        TRP  39  -3.928  -2.913   4.868
  257    HA   TRP  39           HA       TRP  39  -5.080  -1.058   2.867
  258   1HB   TRP  39          1HB       TRP  39  -5.158  -1.150   5.900
  259   2HB   TRP  39          2HB       TRP  39  -6.056  -0.010   4.899
  260    HD1  TRP  39           HD1      TRP  39  -6.417  -3.268   6.523
  261    HE1  TRP  39           HE1      TRP  39  -8.458  -4.540   5.601
  262    HE3  TRP  39           HE3      TRP  39  -7.397  -0.473   2.360
  263    HZ2  TRP  39           HZ2      TRP  39 -10.266  -4.395   3.395
  264    HZ3  TRP  39           HZ3      TRP  39  -9.283  -1.067   0.867
  265    HH2  TRP  39           HH2      TRP  39 -10.717  -3.027   1.380
  266    H    GLN  40           H        GLN  40  -4.681   1.372   4.050
  267    HA   GLN  40           HA       GLN  40  -3.065   3.083   4.283
  268   1HB   GLN  40          1HB       GLN  40  -1.575   0.788   5.600
  269   2HB   GLN  40          2HB       GLN  40  -1.287   2.506   5.873
  270   1HG   GLN  40          1HG       GLN  40  -3.986   2.316   6.342
  271   2HG   GLN  40          2HG       GLN  40  -3.409   0.763   6.945
  272   1HE2  GLN  40          1HE2      GLN  40  -2.105   0.760   8.863
  273   2HE2  GLN  40          2HE2      GLN  40  -1.773   2.167   9.752
  274    H    ASP  41           H        ASP  41  -0.685   3.613   3.716
  275    HA   ASP  41           HA       ASP  41  -0.071   2.385   1.105
  276   1HB   ASP  41          1HB       ASP  41  -0.061   4.899   1.979
  277   2HB   ASP  41          2HB       ASP  41   1.592   4.491   2.438
  278    HA   PRO  42           HA       PRO  42   3.084  -0.280   2.693
  279   1HB   PRO  42          1HB       PRO  42   4.584  -0.583   0.430
  280   2HB   PRO  42          2HB       PRO  42   3.021  -1.384   0.670
  281   1HG   PRO  42          1HG       PRO  42   3.671   1.092  -0.863
  282   2HG   PRO  42          2HG       PRO  42   2.582  -0.238  -1.285
  283   1HD   PRO  42          1HD       PRO  42   1.702   2.133  -0.309
  284   2HD   PRO  42          2HD       PRO  42   0.864   0.599  -0.002
  285    H    ARG  43           H        ARG  43   3.772   2.808   1.236
  286    HA   ARG  43           HA       ARG  43   6.457   2.825   2.581
  287   1HB   ARG  43          1HB       ARG  43   5.670   3.241  -0.117
  288   2HB   ARG  43          2HB       ARG  43   6.158   4.814   0.516
  289   1HG   ARG  43          1HG       ARG  43   8.307   3.951   1.198
  290   2HG   ARG  43          2HG       ARG  43   7.816   2.296   0.835
  291   1HD   ARG  43          1HD       ARG  43   7.857   2.678  -1.507
  292   2HD   ARG  43          2HD       ARG  43   7.829   4.440  -1.304
  293    HE   ARG  43           HE       ARG  43  10.118   3.149  -0.012
  294   1HH1  ARG  43          1HH1      ARG  43   8.862   4.524  -2.953
  295   2HH1  ARG  43          2HH1      ARG  43  10.430   4.888  -3.583
  296   1HH2  ARG  43          1HH2      ARG  43  12.143   3.632  -0.851
  297   2HH2  ARG  43          2HH2      ARG  43  12.276   4.389  -2.404
  298    H    LYS  44           H        LYS  44   3.969   5.116   1.365
  299    HA   LYS  44           HA       LYS  44   4.646   7.310   3.010
  300   1HB   LYS  44          1HB       LYS  44   3.098   7.353   1.092
  301   2HB   LYS  44          2HB       LYS  44   1.946   6.367   1.991
  302   1HG   LYS  44          1HG       LYS  44   1.106   8.489   2.422
  303   2HG   LYS  44          2HG       LYS  44   2.201   8.298   3.792
  304   1HD   LYS  44          1HD       LYS  44   3.494   9.346   1.362
  305   2HD   LYS  44          2HD       LYS  44   2.257  10.410   2.032
  306   1HE   LYS  44          1HE       LYS  44   4.237   9.168   3.918
  307   2HE   LYS  44          2HE       LYS  44   4.747  10.553   2.933
  308   1HZ   LYS  44          1HZ       LYS  44   2.863  11.800   3.695
  309   2HZ   LYS  44          2HZ       LYS  44   3.671  11.197   5.063
  310   3HZ   LYS  44          3HZ       LYS  44   2.237  10.461   4.526
  311    H    ALA  45           H        ALA  45   2.976   4.342   3.803
  312    HA   ALA  45           HA       ALA  45   2.574   5.370   6.594
  313   1HB   ALA  45          1HB       ALA  45   0.414   4.463   6.605
  314   2HB   ALA  45          2HB       ALA  45   0.782   3.325   5.309
  315   3HB   ALA  45          3HB       ALA  45   0.550   5.035   4.942
  316    H    MET  46           H        MET  46   4.903   4.185   6.361
  317    HA   MET  46           HA       MET  46   4.981   1.313   6.288
  318   1HB   MET  46          1HB       MET  46   6.907   2.814   5.936
  319   2HB   MET  46          2HB       MET  46   6.790   3.364   7.607
  320   1HG   MET  46          1HG       MET  46   8.373   1.711   7.889
  321   2HG   MET  46          2HG       MET  46   6.918   0.729   8.074
  322   1HE   MET  46          1HE       MET  46   8.441  -1.284   7.623
  323   2HE   MET  46          2HE       MET  46   8.181  -2.021   6.044
  324   3HE   MET  46          3HE       MET  46   6.800  -1.458   6.982
  325    H    LEU  47           H        LEU  47   5.572   3.371   9.161
  326    HA   LEU  47           HA       LEU  47   4.084   1.338  10.794
  327   1HB   LEU  47          1HB       LEU  47   6.763   1.736  10.788
  328   2HB   LEU  47          2HB       LEU  47   6.291   2.936  11.991
  329    HG   LEU  47           HG       LEU  47   4.776   0.715  12.683
  330   1HD1  LEU  47          1HD1      LEU  47   6.232  -1.193  12.666
  331   2HD1  LEU  47          2HD1      LEU  47   7.591  -0.229  12.090
  332   3HD1  LEU  47          3HD1      LEU  47   6.227  -0.557  11.021
  333   1HD2  LEU  47          1HD2      LEU  47   5.762   1.988  14.392
  334   2HD2  LEU  47          2HD2      LEU  47   7.366   1.897  13.663
  335   3HD2  LEU  47          3HD2      LEU  47   6.678   0.481  14.459
  336    H    SER  48           H        SER  48   2.154   2.600  10.912
  337    HA   SER  48           HA       SER  48   2.395   5.370  11.999
  338   1HB   SER  48          1HB       SER  48   1.038   5.244  10.054
  339   2HB   SER  48          2HB       SER  48   0.265   3.753  10.593
  340    HG   SER  48           HG       SER  48  -1.210   5.141  11.206
  341    H    GLN  49           H        GLN  49   3.054   3.714  13.990
  342    HA   GLN  49           HA       GLN  49   2.465   2.990  16.154
  343   1HB   GLN  49          1HB       GLN  49   0.249   4.946  15.476
  344   2HB   GLN  49          2HB       GLN  49   0.522   4.303  17.094
  345   1HG   GLN  49          1HG       GLN  49   2.541   5.438  17.350
  346   2HG   GLN  49          2HG       GLN  49   2.817   5.544  15.611
  347   1HE2  GLN  49          1HE2      GLN  49   3.175   7.945  16.170
  348   2HE2  GLN  49          2HE2      GLN  49   1.807   8.948  16.240
  349    H    MET  50           H        MET  50  -0.928   3.412  15.253
  350    HA   MET  50           HA       MET  50  -1.264   0.445  15.481
  351   1HB   MET  50          1HB       MET  50  -2.684   2.850  16.407
  352   2HB   MET  50          2HB       MET  50  -3.750   1.631  15.709
  353   1HG   MET  50          1HG       MET  50  -2.752  -0.080  17.196
  354   2HG   MET  50          2HG       MET  50  -1.716   1.157  17.909
  355   1HE   MET  50          1HE       MET  50  -6.241   0.879  17.927
  356   2HE   MET  50          2HE       MET  50  -5.338  -0.556  18.411
  357   3HE   MET  50          3HE       MET  50  -5.047   0.169  16.831
  358   1H    GLY  51          1H        GLY  51 -17.320  -5.334  11.009
  359   2H    GLY  51          2H        GLY  51 -17.400  -4.370   9.613
  360   3H    GLY  51          3H        GLY  51 -15.932  -4.536  10.452
  361   1HA   GLY  51          1HA       GLY  51 -15.700  -6.791   9.823
  362   2HA   GLY  51          2HA       GLY  51 -17.342  -6.810   9.175
  363    H    THR  52           H        THR  52 -14.411  -4.776   8.803
  364    HA   THR  52           HA       THR  52 -14.900  -4.853   5.841
  365    HB   THR  52           HB       THR  52 -13.623  -2.560   6.087
  366    HG1  THR  52           HG1      THR  52 -13.107  -2.734   8.241
  367   1HG2  THR  52          1HG2      THR  52 -15.661  -1.671   5.698
  368   2HG2  THR  52          2HG2      THR  52 -16.266  -2.180   7.275
  369   3HG2  THR  52          3HG2      THR  52 -16.293  -3.303   5.916
  370    HA   PRO  53           HA       PRO  53 -10.625  -6.426   7.040
  371   1HB   PRO  53          1HB       PRO  53 -10.879  -8.962   6.042
  372   2HB   PRO  53          2HB       PRO  53 -11.294  -8.533   7.712
  373   1HG   PRO  53          1HG       PRO  53 -13.070  -8.925   5.351
  374   2HG   PRO  53          2HG       PRO  53 -13.320  -9.395   7.038
  375   1HD   PRO  53          1HD       PRO  53 -14.475  -7.202   5.886
  376   2HD   PRO  53          2HD       PRO  53 -14.121  -7.330   7.622
  377    HA   PRO  54           HA       PRO  54  -9.105  -5.891   2.945
  378   1HB   PRO  54          1HB       PRO  54  -7.077  -7.722   2.720
  379   2HB   PRO  54          2HB       PRO  54  -6.949  -6.243   3.692
  380   1HG   PRO  54          1HG       PRO  54  -7.563  -9.038   4.555
  381   2HG   PRO  54          2HG       PRO  54  -6.505  -7.836   5.311
  382   1HD   PRO  54          1HD       PRO  54  -9.001  -8.352   6.219
  383   2HD   PRO  54          2HD       PRO  54  -8.265  -6.735   6.320
  384    HA   PRO  55           HA       PRO  55 -10.881  -8.789   0.165
  385   1HB   PRO  55          1HB       PRO  55  -9.224  -8.680  -2.017
  386   2HB   PRO  55          2HB       PRO  55 -10.341  -7.375  -1.577
  387   1HG   PRO  55          1HG       PRO  55  -7.413  -7.585  -1.145
  388   2HG   PRO  55          2HG       PRO  55  -8.401  -6.175  -1.546
  389   1HD   PRO  55          1HD       PRO  55  -7.445  -6.726   0.963
  390   2HD   PRO  55          2HD       PRO  55  -8.888  -5.742   0.637
  391    HA   PRO  56           HA       PRO  56  -8.858 -12.694   0.358
  392   1HB   PRO  56          1HB       PRO  56  -9.710 -13.974  -1.897
  393   2HB   PRO  56          2HB       PRO  56 -10.774 -13.631  -0.520
  394   1HG   PRO  56          1HG       PRO  56 -10.579 -12.271  -3.141
  395   2HG   PRO  56          2HG       PRO  56 -11.986 -12.529  -2.100
  396   1HD   PRO  56          1HD       PRO  56 -10.566 -10.155  -2.328
  397   2HD   PRO  56          2HD       PRO  56 -11.661 -10.578  -0.998
  398    H    TYR  57           H        TYR  57  -7.753 -10.455  -1.815
  399    HA   TYR  57           HA       TYR  57  -5.789 -10.297  -3.106
  400   1HB   TYR  57          1HB       TYR  57  -4.964 -11.382  -0.964
  401   2HB   TYR  57          2HB       TYR  57  -5.119 -12.938  -1.772
  402    HD1  TYR  57           HD1      TYR  57  -3.972  -9.650  -3.155
  403    HD2  TYR  57           HD2      TYR  57  -2.928 -13.688  -2.126
  404    HE1  TYR  57           HE1      TYR  57  -1.748  -9.341  -4.206
  405    HE2  TYR  57           HE2      TYR  57  -0.706 -13.377  -3.182
  406    HH   TYR  57           HH       TYR  57   0.411 -12.009  -4.737
  407    H    THR  58           H        THR  58  -4.918 -11.099  -5.095
  408    HA   THR  58           HA       THR  58  -6.315 -13.509  -6.209
  409    HB   THR  58           HB       THR  58  -5.691 -10.822  -7.474
  410    HG1  THR  58           HG1      THR  58  -7.746 -10.428  -7.168
  411   1HG2  THR  58          1HG2      THR  58  -6.346 -13.464  -8.619
  412   2HG2  THR  58          2HG2      THR  58  -5.572 -12.069  -9.372
  413   3HG2  THR  58          3HG2      THR  58  -7.327 -12.129  -9.222
  414    H    VAL  59           H        VAL  59  -3.318 -12.126  -5.459
  415    HA   VAL  59           HA       VAL  59  -1.114 -12.670  -6.076
  416    HB   VAL  59           HB       VAL  59  -2.655 -15.133  -6.938
  417   1HG1  VAL  59          1HG1      VAL  59   0.303 -14.932  -6.333
  418   2HG1  VAL  59          2HG1      VAL  59  -0.339 -14.853  -7.973
  419   3HG1  VAL  59          3HG1      VAL  59  -0.569 -16.309  -7.005
  420   1HG2  VAL  59          1HG2      VAL  59  -2.252 -15.959  -4.776
  421   2HG2  VAL  59          2HG2      VAL  59  -2.622 -14.259  -4.483
  422   3HG2  VAL  59          3HG2      VAL  59  -0.947 -14.810  -4.481
  423    H    GLY  60           H        GLY  60  -2.381 -14.547  -8.761
  424   1HA   GLY  60          1HA       GLY  60  -1.455 -12.395 -10.617
  425   2HA   GLY  60          2HA       GLY  60  -1.081 -14.094 -10.904
  Start of MODEL   20
    1    H    PHE   5           H        PHE   5  -7.706   6.871   6.572
    2    HA   PHE   5           HA       PHE   5  -6.343   9.488   6.279
    3   1HB   PHE   5          1HB       PHE   5  -5.619   6.854   6.913
    4   2HB   PHE   5          2HB       PHE   5  -4.955   7.119   5.301
    5    HD1  PHE   5           HD1      PHE   5  -3.769   7.017   8.364
    6    HD2  PHE   5           HD2      PHE   5  -4.374  10.021   5.353
    7    HE1  PHE   5           HE1      PHE   5  -1.932   8.368   9.340
    8    HE2  PHE   5           HE2      PHE   5  -2.539  11.371   6.330
    9    HZ   PHE   5           HZ       PHE   5  -1.318  10.545   8.323
   10    H    GLU   6           H        GLU   6  -4.725   8.644   4.029
   11    HA   GLU   6           HA       GLU   6  -6.320   7.930   1.739
   12   1HB   GLU   6          1HB       GLU   6  -6.543  10.611   2.779
   13   2HB   GLU   6          2HB       GLU   6  -5.808  10.666   1.176
   14   1HG   GLU   6          1HG       GLU   6  -7.816   8.814   0.825
   15   2HG   GLU   6          2HG       GLU   6  -8.554   9.954   1.951
   16    H    ILE   7           H        ILE   7  -4.432   6.773   1.123
   17    HA   ILE   7           HA       ILE   7  -1.788   7.940   1.069
   18    HB   ILE   7           HB       ILE   7  -2.985   5.580  -0.423
   19   1HG1  ILE   7          1HG1      ILE   7  -3.339   5.437   2.015
   20   2HG1  ILE   7          2HG1      ILE   7  -2.137   4.257   1.491
   21   1HG2  ILE   7          1HG2      ILE   7  -0.776   6.326  -1.273
   22   2HG2  ILE   7          2HG2      ILE   7  -0.675   4.752  -0.485
   23   3HG2  ILE   7          3HG2      ILE   7  -0.120   6.196   0.359
   24   1HD1  ILE   7          1HD1      ILE   7  -0.392   6.091   2.044
   25   2HD1  ILE   7          2HD1      ILE   7  -1.154   5.252   3.396
   26   3HD1  ILE   7          3HD1      ILE   7  -1.698   6.866   2.940
   27    HA   PRO   8           HA       PRO   8  -2.207  10.217  -2.706
   28   1HB   PRO   8          1HB       PRO   8   0.444  10.497  -3.329
   29   2HB   PRO   8          2HB       PRO   8  -0.353  11.431  -2.048
   30   1HG   PRO   8          1HG       PRO   8   1.387   9.020  -1.845
   31   2HG   PRO   8          2HG       PRO   8   1.309  10.446  -0.799
   32   1HD   PRO   8          1HD       PRO   8   0.165   8.047  -0.174
   33   2HD   PRO   8          2HD       PRO   8  -0.424   9.610   0.433
   34    H    ASP   9           H        ASP   9  -1.924   9.881  -5.021
   35    HA   ASP   9           HA       ASP   9  -1.278   7.043  -5.716
   36   1HB   ASP   9          1HB       ASP   9  -3.087   9.194  -6.800
   37   2HB   ASP   9          2HB       ASP   9  -2.633   7.824  -7.815
   38    H    ASP  10           H        ASP  10   1.049   8.298  -5.488
   39    HA   ASP  10           HA       ASP  10   1.819   8.979  -8.302
   40   1HB   ASP  10          1HB       ASP  10   3.237  10.772  -7.370
   41   2HB   ASP  10          2HB       ASP  10   1.551  11.013  -6.909
   42    H    VAL  11           H        VAL  11   2.912   7.924  -5.071
   43    HA   VAL  11           HA       VAL  11   5.569   7.209  -5.698
   44    HB   VAL  11           HB       VAL  11   5.278   5.726  -3.720
   45   1HG1  VAL  11          1HG1      VAL  11   4.770   7.473  -2.168
   46   2HG1  VAL  11          2HG1      VAL  11   3.740   8.299  -3.337
   47   3HG1  VAL  11          3HG1      VAL  11   5.487   8.264  -3.572
   48   1HG2  VAL  11          1HG2      VAL  11   2.364   6.525  -3.837
   49   2HG2  VAL  11          2HG2      VAL  11   3.120   5.380  -2.730
   50   3HG2  VAL  11          3HG2      VAL  11   2.957   4.978  -4.439
   51    HA   PRO  12           HA       PRO  12   4.882   3.701  -8.319
   52   1HB   PRO  12          1HB       PRO  12   7.421   2.698  -8.324
   53   2HB   PRO  12          2HB       PRO  12   6.957   4.158  -9.216
   54   1HG   PRO  12          1HG       PRO  12   8.459   3.880  -6.682
   55   2HG   PRO  12          2HG       PRO  12   8.577   5.120  -7.936
   56   1HD   PRO  12          1HD       PRO  12   7.257   5.373  -5.482
   57   2HD   PRO  12          2HD       PRO  12   7.082   6.451  -6.880
   58    H    LEU  13           H        LEU  13   5.196   3.505  -5.043
   59    HA   LEU  13           HA       LEU  13   4.937   1.762  -3.485
   60   1HB   LEU  13          1HB       LEU  13   3.843   0.779  -6.083
   61   2HB   LEU  13          2HB       LEU  13   4.107  -0.429  -4.832
   62    HG   LEU  13           HG       LEU  13   1.806   0.601  -4.816
   63   1HD1  LEU  13          1HD1      LEU  13   2.446  -0.415  -2.782
   64   2HD1  LEU  13          2HD1      LEU  13   1.931   1.204  -2.308
   65   3HD1  LEU  13          3HD1      LEU  13   3.643   0.828  -2.438
   66   1HD2  LEU  13          1HD2      LEU  13   3.389   3.053  -4.005
   67   2HD2  LEU  13          2HD2      LEU  13   1.640   2.897  -3.843
   68   3HD2  LEU  13          3HD2      LEU  13   2.382   2.878  -5.442
   69    HA   PRO  14           HA       PRO  14   8.665  -0.571  -3.784
   70   1HB   PRO  14          1HB       PRO  14   8.286  -2.357  -1.750
   71   2HB   PRO  14          2HB       PRO  14   8.651  -0.643  -1.490
   72   1HG   PRO  14          1HG       PRO  14   6.130  -2.095  -1.130
   73   2HG   PRO  14          2HG       PRO  14   6.673  -0.587  -0.404
   74   1HD   PRO  14          1HD       PRO  14   4.856  -0.928  -2.562
   75   2HD   PRO  14          2HD       PRO  14   5.478   0.596  -1.902
   76    H    ALA  15           H        ALA  15   9.469  -2.930  -3.993
   77    HA   ALA  15           HA       ALA  15   8.043  -4.252  -6.110
   78   1HB   ALA  15          1HB       ALA  15  10.481  -4.584  -4.472
   79   2HB   ALA  15          2HB       ALA  15  10.267  -4.760  -6.214
   80   3HB   ALA  15          3HB       ALA  15   9.832  -6.085  -5.134
   81    H    GLY  16           H        GLY  16   6.724  -6.104  -6.052
   82   1HA   GLY  16          1HA       GLY  16   5.359  -7.763  -5.147
   83   2HA   GLY  16          2HA       GLY  16   6.406  -7.764  -3.729
   84    H    TRP  17           H        TRP  17   4.916  -4.811  -4.845
   85    HA   TRP  17           HA       TRP  17   2.878  -5.016  -2.684
   86   1HB   TRP  17          1HB       TRP  17   5.164  -3.162  -2.997
   87   2HB   TRP  17          2HB       TRP  17   3.690  -2.531  -2.282
   88    HD1  TRP  17           HD1      TRP  17   6.766  -4.261  -1.326
   89    HE1  TRP  17           HE1      TRP  17   6.524  -5.337   1.011
   90    HE3  TRP  17           HE3      TRP  17   1.723  -4.011  -0.780
   91    HZ2  TRP  17           HZ2      TRP  17   4.432  -6.003   2.867
   92    HZ3  TRP  17           HZ3      TRP  17   0.612  -4.857   1.261
   93    HH2  TRP  17           HH2      TRP  17   1.960  -5.858   3.086
   94    H    GLU  18           H        GLU  18   1.588  -5.283  -4.761
   95    HA   GLU  18           HA       GLU  18   1.196  -2.896  -6.443
   96   1HB   GLU  18          1HB       GLU  18   0.884  -5.596  -6.757
   97   2HB   GLU  18          2HB       GLU  18  -0.771  -5.121  -6.382
   98   1HG   GLU  18          1HG       GLU  18  -0.277  -5.118  -8.831
   99   2HG   GLU  18          2HG       GLU  18  -0.809  -3.552  -8.228
  100    H    MET  19           H        MET  19  -1.465  -2.692  -6.684
  101    HA   MET  19           HA       MET  19  -2.861  -2.649  -4.140
  102   1HB   MET  19          1HB       MET  19  -2.939  -0.225  -3.912
  103   2HB   MET  19          2HB       MET  19  -1.267  -0.773  -3.912
  104   1HG   MET  19          1HG       MET  19  -0.836   0.096  -6.027
  105   2HG   MET  19          2HG       MET  19  -2.524   0.008  -6.520
  106   1HE   MET  19          1HE       MET  19  -0.239   3.464  -4.954
  107   2HE   MET  19          2HE       MET  19  -0.089   2.509  -6.426
  108   3HE   MET  19          3HE       MET  19   0.262   1.771  -4.865
  109    H    ALA  20           H        ALA  20  -5.051  -2.246  -4.417
  110    HA   ALA  20           HA       ALA  20  -6.011  -1.408  -7.093
  111   1HB   ALA  20          1HB       ALA  20  -7.395  -3.616  -6.997
  112   2HB   ALA  20          2HB       ALA  20  -6.197  -4.129  -5.808
  113   3HB   ALA  20          3HB       ALA  20  -5.692  -3.720  -7.446
  114    H    LYS  21           H        LYS  21  -8.408  -1.091  -7.040
  115    HA   LYS  21           HA       LYS  21  -9.282  -0.269  -4.309
  116   1HB   LYS  21          1HB       LYS  21  -9.654   0.620  -7.111
  117   2HB   LYS  21          2HB       LYS  21 -11.075   0.776  -6.081
  118   1HG   LYS  21          1HG       LYS  21 -10.050   2.784  -5.585
  119   2HG   LYS  21          2HG       LYS  21  -9.251   1.768  -4.385
  120   1HD   LYS  21          1HD       LYS  21  -7.248   2.085  -5.369
  121   2HD   LYS  21          2HD       LYS  21  -7.888   1.587  -6.935
  122   1HE   LYS  21          1HE       LYS  21  -8.670   4.302  -5.961
  123   2HE   LYS  21          2HE       LYS  21  -7.002   4.087  -6.525
  124   1HZ   LYS  21          1HZ       LYS  21  -9.440   3.224  -8.001
  125   2HZ   LYS  21          2HZ       LYS  21  -7.836   3.075  -8.544
  126   3HZ   LYS  21          3HZ       LYS  21  -8.535   4.612  -8.359
  127    H    THR  22           H        THR  22 -10.661  -1.659  -3.296
  128    HA   THR  22           HA       THR  22 -11.926  -3.909  -4.522
  129    HB   THR  22           HB       THR  22 -13.056  -4.081  -2.371
  130    HG1  THR  22           HG1      THR  22 -13.696  -2.325  -1.463
  131   1HG2  THR  22          1HG2      THR  22 -10.444  -4.237  -2.608
  132   2HG2  THR  22          2HG2      THR  22 -11.175  -4.233  -1.002
  133   3HG2  THR  22          3HG2      THR  22 -10.461  -2.756  -1.650
  134    H    SER  23           H        SER  23 -14.595  -3.567  -3.445
  135    HA   SER  23           HA       SER  23 -15.885  -2.324  -5.732
  136   1HB   SER  23          1HB       SER  23 -16.690  -3.669  -3.169
  137   2HB   SER  23          2HB       SER  23 -17.914  -2.841  -4.131
  138    HG   SER  23           HG       SER  23 -17.382  -5.181  -4.561
  139    H    SER  24           H        SER  24 -14.526  -0.918  -2.987
  140    HA   SER  24           HA       SER  24 -16.376   1.430  -3.221
  141   1HB   SER  24          1HB       SER  24 -15.278  -0.001  -0.794
  142   2HB   SER  24          2HB       SER  24 -15.906   1.644  -0.695
  143    HG   SER  24           HG       SER  24 -17.323  -0.582  -1.731
  144    H    GLY  25           H        GLY  25 -13.772   0.985  -4.512
  145   1HA   GLY  25          1HA       GLY  25 -11.739   2.104  -4.843
  146   2HA   GLY  25          2HA       GLY  25 -12.512   3.478  -4.064
  147    H    GLN  26           H        GLN  26 -12.296   0.541  -2.232
  148    HA   GLN  26           HA       GLN  26 -10.763   1.800  -0.139
  149   1HB   GLN  26          1HB       GLN  26 -11.272  -1.135  -0.740
  150   2HB   GLN  26          2HB       GLN  26 -10.841  -0.455   0.826
  151   1HG   GLN  26          1HG       GLN  26 -13.119   0.952  -0.246
  152   2HG   GLN  26          2HG       GLN  26 -13.440  -0.783  -0.236
  153   1HE2  GLN  26          1HE2      GLN  26 -12.220   1.842   1.910
  154   2HE2  GLN  26          2HE2      GLN  26 -12.795   1.140   3.344
  155    H    ARG  27           H        ARG  27  -8.948   2.567  -1.565
  156    HA   ARG  27           HA       ARG  27  -7.192   1.039  -3.076
  157   1HB   ARG  27          1HB       ARG  27  -7.276   3.578  -1.854
  158   2HB   ARG  27          2HB       ARG  27  -5.738   2.866  -1.376
  159   1HG   ARG  27          1HG       ARG  27  -5.612   2.177  -3.914
  160   2HG   ARG  27          2HG       ARG  27  -6.762   3.504  -4.124
  161   1HD   ARG  27          1HD       ARG  27  -4.627   4.342  -2.361
  162   2HD   ARG  27          2HD       ARG  27  -3.946   3.709  -3.869
  163    HE   ARG  27           HE       ARG  27  -5.023   5.465  -5.050
  164   1HH1  ARG  27          1HH1      ARG  27  -6.231   5.221  -1.792
  165   2HH1  ARG  27          2HH1      ARG  27  -7.138   6.687  -1.904
  166   1HH2  ARG  27          1HH2      ARG  27  -6.210   7.363  -5.167
  167   2HH2  ARG  27          2HH2      ARG  27  -7.129   7.891  -3.797
  168    H    TYR  28           H        TYR  28  -6.748  -1.050  -2.294
  169    HA   TYR  28           HA       TYR  28  -5.242  -1.159   0.292
  170   1HB   TYR  28          1HB       TYR  28  -5.992  -3.455   0.449
  171   2HB   TYR  28          2HB       TYR  28  -7.390  -2.448   0.098
  172    HD1  TYR  28           HD1      TYR  28  -5.122  -5.026  -1.192
  173    HD2  TYR  28           HD2      TYR  28  -8.439  -2.470  -2.124
  174    HE1  TYR  28           HE1      TYR  28  -5.685  -6.454  -3.135
  175    HE2  TYR  28           HE2      TYR  28  -8.984  -3.884  -4.078
  176    HH   TYR  28           HH       TYR  28  -8.590  -6.313  -4.755
  177    H    PHE  29           H        PHE  29  -3.138  -1.867   0.194
  178    HA   PHE  29           HA       PHE  29  -1.993  -2.181  -2.495
  179   1HB   PHE  29          1HB       PHE  29  -0.859  -1.952   0.303
  180   2HB   PHE  29          2HB       PHE  29   0.138  -2.037  -1.154
  181    HD1  PHE  29           HD1      PHE  29   0.385  -0.142  -2.599
  182    HD2  PHE  29           HD2      PHE  29  -2.521  -0.073   0.562
  183    HE1  PHE  29           HE1      PHE  29  -0.001   2.269  -3.000
  184    HE2  PHE  29           HE2      PHE  29  -2.907   2.336   0.158
  185    HZ   PHE  29           HZ       PHE  29  -1.648   3.511  -1.626
  186    H    LYS  30           H        LYS  30  -1.954  -4.123  -3.378
  187    HA   LYS  30           HA       LYS  30  -2.177  -6.612  -1.928
  188   1HB   LYS  30          1HB       LYS  30  -1.459  -5.817  -4.748
  189   2HB   LYS  30          2HB       LYS  30  -1.764  -7.483  -4.263
  190   1HG   LYS  30          1HG       LYS  30  -3.888  -5.909  -3.266
  191   2HG   LYS  30          2HG       LYS  30  -3.620  -5.389  -4.920
  192   1HD   LYS  30          1HD       LYS  30  -3.400  -8.161  -5.070
  193   2HD   LYS  30          2HD       LYS  30  -4.729  -7.916  -3.940
  194   1HE   LYS  30          1HE       LYS  30  -5.349  -6.070  -5.865
  195   2HE   LYS  30          2HE       LYS  30  -4.600  -7.346  -6.841
  196   1HZ   LYS  30          1HZ       LYS  30  -6.897  -7.900  -6.539
  197   2HZ   LYS  30          2HZ       LYS  30  -6.801  -7.650  -4.863
  198   3HZ   LYS  30          3HZ       LYS  30  -5.987  -8.959  -5.577
  199    H    ASN  31           H        ASN  31  -0.543  -7.971  -1.321
  200    HA   ASN  31           HA       ASN  31   2.263  -7.012  -1.742
  201   1HB   ASN  31          1HB       ASN  31   1.124  -7.205   0.568
  202   2HB   ASN  31          2HB       ASN  31   1.250  -8.948   0.345
  203   1HD2  ASN  31          1HD2      ASN  31   2.776  -8.813   2.278
  204   2HD2  ASN  31          2HD2      ASN  31   4.398  -8.401   1.993
  205    H    HIS  32           H        HIS  32   3.105  -8.185  -3.499
  206    HA   HIS  32           HA       HIS  32   2.306 -11.020  -3.823
  207   1HB   HIS  32          1HB       HIS  32   4.228  -9.258  -5.377
  208   2HB   HIS  32          2HB       HIS  32   3.619 -10.824  -5.899
  209    HD1  HIS  32           HD1      HIS  32   0.974 -10.967  -6.321
  210    HD2  HIS  32           HD2      HIS  32   2.503  -7.112  -5.889
  211    HE1  HIS  32           HE1      HIS  32  -0.816  -9.387  -7.171
  212    H    ILE  33           H        ILE  33   4.306  -9.584  -1.718
  213    HA   ILE  33           HA       ILE  33   6.696 -11.296  -2.068
  214    HB   ILE  33           HB       ILE  33   5.991  -9.707   0.401
  215   1HG1  ILE  33          1HG1      ILE  33   7.191  -8.472  -2.098
  216   2HG1  ILE  33          2HG1      ILE  33   5.538  -8.184  -1.540
  217   1HG2  ILE  33          1HG2      ILE  33   8.075 -11.194   0.056
  218   2HG2  ILE  33          2HG2      ILE  33   8.320  -9.568   0.693
  219   3HG2  ILE  33          3HG2      ILE  33   8.645  -9.907  -1.007
  220   1HD1  ILE  33          1HD1      ILE  33   6.309  -7.234   0.520
  221   2HD1  ILE  33          2HD1      ILE  33   7.211  -6.452  -0.779
  222   3HD1  ILE  33          3HD1      ILE  33   7.972  -7.716   0.187
  223    H    ASP  34           H        ASP  34   4.313 -10.669   0.487
  224    HA   ASP  34           HA       ASP  34   4.631 -13.436   1.482
  225   1HB   ASP  34          1HB       ASP  34   4.622 -11.111   2.782
  226   2HB   ASP  34          2HB       ASP  34   2.877 -11.360   2.738
  227    H    GLN  35           H        GLN  35   2.812 -11.951  -0.833
  228    HA   GLN  35           HA       GLN  35   0.776 -12.455  -1.885
  229   1HB   GLN  35          1HB       GLN  35   1.937 -14.792  -0.971
  230   2HB   GLN  35          2HB       GLN  35   0.316 -14.883  -0.284
  231   1HG   GLN  35          1HG       GLN  35  -0.682 -14.557  -2.483
  232   2HG   GLN  35          2HG       GLN  35   0.909 -14.311  -3.203
  233   1HE2  GLN  35          1HE2      GLN  35  -0.435 -16.343  -4.375
  234   2HE2  GLN  35          2HE2      GLN  35   0.107 -17.860  -3.839
  235    H    THR  36           H        THR  36   0.015 -10.557  -0.421
  236    HA   THR  36           HA       THR  36  -2.466 -11.369   0.907
  237    HB   THR  36           HB       THR  36  -1.458 -10.052   3.040
  238    HG1  THR  36           HG1      THR  36   0.742 -11.519   2.043
  239   1HG2  THR  36          1HG2      THR  36  -0.542 -12.828   3.059
  240   2HG2  THR  36          2HG2      THR  36  -2.178 -12.656   2.424
  241   3HG2  THR  36          3HG2      THR  36  -1.789 -12.049   4.033
  242    H    THR  37           H        THR  37  -3.912  -9.654   0.949
  243    HA   THR  37           HA       THR  37  -3.029  -7.087  -0.250
  244    HB   THR  37           HB       THR  37  -5.453  -6.755  -0.507
  245    HG1  THR  37           HG1      THR  37  -6.859  -8.295   0.401
  246   1HG2  THR  37          1HG2      THR  37  -5.838  -8.444  -2.052
  247   2HG2  THR  37          2HG2      THR  37  -5.112  -9.686  -1.030
  248   3HG2  THR  37          3HG2      THR  37  -4.084  -8.534  -1.883
  249    H    THR  38           H        THR  38  -2.788  -5.220   0.998
  250    HA   THR  38           HA       THR  38  -3.858  -5.314   3.800
  251    HB   THR  38           HB       THR  38  -1.354  -5.691   3.466
  252    HG1  THR  38           HG1      THR  38  -1.996  -3.353   4.918
  253   1HG2  THR  38          1HG2      THR  38  -1.092  -3.994   1.646
  254   2HG2  THR  38          2HG2      THR  38   0.031  -3.745   2.978
  255   3HG2  THR  38          3HG2      THR  38  -1.399  -2.725   2.827
  256    H    TRP  39           H        TRP  39  -4.100  -3.097   4.765
  257    HA   TRP  39           HA       TRP  39  -5.410  -1.296   2.867
  258   1HB   TRP  39          1HB       TRP  39  -5.031  -1.425   5.864
  259   2HB   TRP  39          2HB       TRP  39  -5.880  -0.091   5.084
  260    HD1  TRP  39           HD1      TRP  39  -6.792  -2.970   6.854
  261    HE1  TRP  39           HE1      TRP  39  -8.986  -4.036   6.022
  262    HE3  TRP  39           HE3      TRP  39  -7.172  -0.742   2.277
  263    HZ2  TRP  39           HZ2      TRP  39 -10.677  -3.955   3.717
  264    HZ3  TRP  39           HZ3      TRP  39  -9.078  -1.256   0.785
  265    HH2  TRP  39           HH2      TRP  39 -10.832  -2.858   1.497
  266    H    GLN  40           H        GLN  40  -3.182  -0.562   5.561
  267    HA   GLN  40           HA       GLN  40  -2.279   1.937   4.711
  268   1HB   GLN  40          1HB       GLN  40  -1.065  -0.347   6.249
  269   2HB   GLN  40          2HB       GLN  40  -0.127   1.119   5.967
  270   1HG   GLN  40          1HG       GLN  40  -1.842   2.478   7.032
  271   2HG   GLN  40          2HG       GLN  40  -2.895   1.073   7.203
  272   1HE2  GLN  40          1HE2      GLN  40  -2.361  -0.503   8.864
  273   2HE2  GLN  40          2HE2      GLN  40  -1.197  -0.185  10.058
  274    H    ASP  41           H        ASP  41  -0.770   2.666   3.214
  275    HA   ASP  41           HA       ASP  41   0.041   0.855   1.081
  276   1HB   ASP  41          1HB       ASP  41   0.974   2.931   0.139
  277   2HB   ASP  41          2HB       ASP  41  -0.641   3.227   0.781
  278    HA   PRO  42           HA       PRO  42   3.923  -0.262   2.903
  279   1HB   PRO  42          1HB       PRO  42   5.172  -1.204   0.660
  280   2HB   PRO  42          2HB       PRO  42   3.915  -2.111   1.519
  281   1HG   PRO  42          1HG       PRO  42   3.721  -0.483  -0.968
  282   2HG   PRO  42          2HG       PRO  42   2.939  -2.016  -0.562
  283   1HD   PRO  42          1HD       PRO  42   1.683   0.410  -0.452
  284   2HD   PRO  42          2HD       PRO  42   1.220  -0.985   0.545
  285    H    ARG  43           H        ARG  43   3.925   2.387   2.806
  286    HA   ARG  43           HA       ARG  43   6.610   3.132   2.044
  287   1HB   ARG  43          1HB       ARG  43   4.412   3.371   0.112
  288   2HB   ARG  43          2HB       ARG  43   5.272   4.889   0.364
  289   1HG   ARG  43          1HG       ARG  43   7.245   2.859   0.221
  290   2HG   ARG  43          2HG       ARG  43   6.123   2.563  -1.107
  291   1HD   ARG  43          1HD       ARG  43   7.686   4.103  -2.023
  292   2HD   ARG  43          2HD       ARG  43   6.329   5.138  -1.538
  293    HE   ARG  43           HE       ARG  43   8.020   4.846   0.720
  294   1HH1  ARG  43          1HH1      ARG  43   8.110   6.211  -2.481
  295   2HH1  ARG  43          2HH1      ARG  43   9.249   7.437  -2.047
  296   1HH2  ARG  43          1HH2      ARG  43   9.499   6.447   1.261
  297   2HH2  ARG  43          2HH2      ARG  43  10.031   7.572   0.055
  298    H    LYS  44           H        LYS  44   3.737   5.182   1.678
  299    HA   LYS  44           HA       LYS  44   4.673   7.232   3.419
  300   1HB   LYS  44          1HB       LYS  44   2.805   7.117   1.588
  301   2HB   LYS  44          2HB       LYS  44   1.762   6.633   2.926
  302   1HG   LYS  44          1HG       LYS  44   1.606   8.769   3.616
  303   2HG   LYS  44          2HG       LYS  44   3.362   8.880   3.743
  304   1HD   LYS  44          1HD       LYS  44   2.021   9.061   1.053
  305   2HD   LYS  44          2HD       LYS  44   2.122  10.481   2.094
  306   1HE   LYS  44          1HE       LYS  44   4.571  10.270   2.188
  307   2HE   LYS  44          2HE       LYS  44   4.494   8.799   1.201
  308   1HZ   LYS  44          1HZ       LYS  44   3.283  10.126  -0.489
  309   2HZ   LYS  44          2HZ       LYS  44   4.875  10.664  -0.243
  310   3HZ   LYS  44          3HZ       LYS  44   3.571  11.521   0.431
  311    H    ALA  45           H        ALA  45   2.969   4.242   4.072
  312    HA   ALA  45           HA       ALA  45   2.616   5.072   6.933
  313   1HB   ALA  45          1HB       ALA  45   0.549   4.524   5.769
  314   2HB   ALA  45          2HB       ALA  45   0.906   3.222   6.904
  315   3HB   ALA  45          3HB       ALA  45   1.237   3.009   5.184
  316    H    MET  46           H        MET  46   5.162   4.395   6.557
  317    HA   MET  46           HA       MET  46   5.365   1.490   7.287
  318   1HB   MET  46          1HB       MET  46   6.349   2.431   5.083
  319   2HB   MET  46          2HB       MET  46   7.550   3.214   6.112
  320   1HG   MET  46          1HG       MET  46   8.383   1.140   6.906
  321   2HG   MET  46          2HG       MET  46   6.967   0.259   6.332
  322   1HE   MET  46          1HE       MET  46   9.506  -1.388   4.837
  323   2HE   MET  46          2HE       MET  46   9.740  -0.359   6.248
  324   3HE   MET  46          3HE       MET  46  10.708  -0.091   4.801
  325    H    LEU  47           H        LEU  47   7.378   4.442   7.616
  326    HA   LEU  47           HA       LEU  47   7.542   3.913  10.558
  327   1HB   LEU  47          1HB       LEU  47   9.597   3.711   8.480
  328   2HB   LEU  47          2HB       LEU  47  10.072   4.785   9.796
  329    HG   LEU  47           HG       LEU  47   8.992   2.722  11.206
  330   1HD1  LEU  47          1HD1      LEU  47   8.911   1.635   8.754
  331   2HD1  LEU  47          2HD1      LEU  47   9.254   0.671  10.190
  332   3HD1  LEU  47          3HD1      LEU  47  10.577   1.230   9.166
  333   1HD2  LEU  47          1HD2      LEU  47  11.127   2.499  11.993
  334   2HD2  LEU  47          2HD2      LEU  47  11.427   3.909  10.978
  335   3HD2  LEU  47          3HD2      LEU  47  11.806   2.295  10.378
  336    H    SER  48           H        SER  48   6.106   5.796  10.743
  337    HA   SER  48           HA       SER  48   6.798   8.375   9.622
  338   1HB   SER  48          1HB       SER  48   4.946   7.319  11.757
  339   2HB   SER  48          2HB       SER  48   5.090   9.052  11.467
  340    HG   SER  48           HG       SER  48   4.107   8.845   9.612
  341    H    GLN  49           H        GLN  49   7.777   6.618  12.473
  342    HA   GLN  49           HA       GLN  49   9.232   7.203  14.244
  343   1HB   GLN  49          1HB       GLN  49  10.093   8.397  11.737
  344   2HB   GLN  49          2HB       GLN  49  10.613   9.376  13.109
  345   1HG   GLN  49          1HG       GLN  49  11.187   6.891  14.046
  346   2HG   GLN  49          2HG       GLN  49  11.434   6.639  12.318
  347   1HE2  GLN  49          1HE2      GLN  49  12.751   8.617  11.275
  348   2HE2  GLN  49          2HE2      GLN  49  14.101   9.124  12.169
  349    H    MET  50           H        MET  50  10.064   9.361  15.452
  350    HA   MET  50           HA       MET  50   7.618  10.856  16.147
  351   1HB   MET  50          1HB       MET  50   9.590   9.819  17.608
  352   2HB   MET  50          2HB       MET  50  10.331  11.390  17.301
  353   1HG   MET  50          1HG       MET  50   8.813  12.502  18.601
  354   2HG   MET  50          2HG       MET  50   7.479  11.458  18.110
  355   1HE   MET  50          1HE       MET  50   9.811  11.655  21.768
  356   2HE   MET  50          2HE       MET  50   8.160  12.244  21.582
  357   3HE   MET  50          3HE       MET  50   9.409  12.772  20.456
  358   1H    GLY  51          1H        GLY  51 -13.333  -2.021  11.657
  359   2H    GLY  51          2H        GLY  51 -14.757  -2.940  11.544
  360   3H    GLY  51          3H        GLY  51 -14.824  -1.327  12.073
  361   1HA   GLY  51          1HA       GLY  51 -15.409  -0.914   9.957
  362   2HA   GLY  51          2HA       GLY  51 -13.663  -0.974   9.710
  363    H    THR  52           H        THR  52 -12.913  -2.472   8.283
  364    HA   THR  52           HA       THR  52 -14.434  -4.977   7.822
  365    HB   THR  52           HB       THR  52 -13.910  -2.841   5.730
  366    HG1  THR  52           HG1      THR  52 -15.869  -2.301   6.177
  367   1HG2  THR  52          1HG2      THR  52 -15.298  -5.499   5.346
  368   2HG2  THR  52          2HG2      THR  52 -13.590  -5.254   4.981
  369   3HG2  THR  52          3HG2      THR  52 -14.819  -4.342   4.105
  370    HA   PRO  53           HA       PRO  53 -10.266  -6.357   7.296
  371   1HB   PRO  53          1HB       PRO  53 -10.754  -8.768   6.096
  372   2HB   PRO  53          2HB       PRO  53 -11.020  -8.476   7.825
  373   1HG   PRO  53          1HG       PRO  53 -12.982  -8.539   5.583
  374   2HG   PRO  53          2HG       PRO  53 -13.141  -9.151   7.235
  375   1HD   PRO  53          1HD       PRO  53 -14.230  -6.796   6.377
  376   2HD   PRO  53          2HD       PRO  53 -13.763  -7.107   8.062
  377    HA   PRO  54           HA       PRO  54  -9.028  -5.501   3.161
  378   1HB   PRO  54          1HB       PRO  54  -7.090  -7.367   2.637
  379   2HB   PRO  54          2HB       PRO  54  -6.839  -5.984   3.718
  380   1HG   PRO  54          1HG       PRO  54  -7.488  -8.822   4.385
  381   2HG   PRO  54          2HG       PRO  54  -6.345  -7.719   5.164
  382   1HD   PRO  54          1HD       PRO  54  -8.796  -8.248   6.190
  383   2HD   PRO  54          2HD       PRO  54  -7.995  -6.673   6.391
  384    HA   PRO  55           HA       PRO  55 -11.226  -8.098   0.371
  385   1HB   PRO  55          1HB       PRO  55  -9.906  -7.664  -1.991
  386   2HB   PRO  55          2HB       PRO  55 -10.972  -6.458  -1.242
  387   1HG   PRO  55          1HG       PRO  55  -8.002  -6.634  -1.217
  388   2HG   PRO  55          2HG       PRO  55  -9.047  -5.214  -1.364
  389   1HD   PRO  55          1HD       PRO  55  -7.799  -5.933   0.952
  390   2HD   PRO  55          2HD       PRO  55  -9.333  -5.037   0.906
  391    HA   PRO  56           HA       PRO  56  -9.133 -11.933  -0.166
  392   1HB   PRO  56          1HB       PRO  56 -10.103 -12.892  -2.540
  393   2HB   PRO  56          2HB       PRO  56 -11.074 -12.831  -1.054
  394   1HG   PRO  56          1HG       PRO  56 -11.072 -10.988  -3.393
  395   2HG   PRO  56          2HG       PRO  56 -12.430 -11.579  -2.422
  396   1HD   PRO  56          1HD       PRO  56 -11.345  -9.098  -2.125
  397   2HD   PRO  56          2HD       PRO  56 -12.146  -9.982  -0.810
  398    H    TYR  57           H        TYR  57  -7.117 -12.559  -0.936
  399    HA   TYR  57           HA       TYR  57  -5.751 -10.816  -2.845
  400   1HB   TYR  57          1HB       TYR  57  -4.816 -11.897  -0.738
  401   2HB   TYR  57          2HB       TYR  57  -4.829 -13.427  -1.615
  402    HD1  TYR  57           HD1      TYR  57  -3.175 -10.219  -1.186
  403    HD2  TYR  57           HD2      TYR  57  -3.461 -13.684  -3.701
  404    HE1  TYR  57           HE1      TYR  57  -1.029  -9.607  -2.266
  405    HE2  TYR  57           HE2      TYR  57  -1.314 -13.075  -4.783
  406    HH   TYR  57           HH       TYR  57   0.571 -11.770  -4.514
  407    H    THR  58           H        THR  58  -4.670 -11.663  -4.791
  408    HA   THR  58           HA       THR  58  -5.438 -14.257  -5.894
  409    HB   THR  58           HB       THR  58  -7.526 -12.991  -6.142
  410    HG1  THR  58           HG1      THR  58  -6.771 -14.350  -7.876
  411   1HG2  THR  58          1HG2      THR  58  -5.689 -10.953  -7.401
  412   2HG2  THR  58          2HG2      THR  58  -6.807 -10.728  -6.055
  413   3HG2  THR  58          3HG2      THR  58  -7.428 -10.949  -7.690
  414    H    VAL  59           H        VAL  59  -5.237 -13.222  -8.666
  415    HA   VAL  59           HA       VAL  59  -2.668 -11.829  -8.880
  416    HB   VAL  59           HB       VAL  59  -1.983 -14.079  -8.167
  417   1HG1  VAL  59          1HG1      VAL  59  -3.542 -15.006 -10.601
  418   2HG1  VAL  59          2HG1      VAL  59  -3.998 -15.283  -8.921
  419   3HG1  VAL  59          3HG1      VAL  59  -2.544 -16.035  -9.574
  420   1HG2  VAL  59          1HG2      VAL  59  -1.291 -14.405 -10.984
  421   2HG2  VAL  59          2HG2      VAL  59  -0.247 -14.030  -9.612
  422   3HG2  VAL  59          3HG2      VAL  59  -1.104 -12.735 -10.447
  423    H    GLY  60           H        GLY  60  -2.540 -10.896 -10.913
  424   1HA   GLY  60          1HA       GLY  60  -3.032 -10.466 -13.173
  425   2HA   GLY  60          2HA       GLY  60  -3.694 -12.099 -13.279