*HEADER    BLOOD CLOTTING                          28-AUG-01   1JV8              
*TITLE     NMR STRUCTURE OF BPTI MUTANT G37A                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRYPSIN INHIBITOR;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BOS TAURUS;                                     
*SOURCE   3 ORGANISM_COMMON: BOVINE;                                             
*SOURCE   4 ORGAN: PANCREAS;                                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: HB101;                                     
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PTI103                                    
*KEYWDS    BPTI, G37A MUTANT, CONFORMATIONAL STRAIN                              
*EXPDTA    NMR, 23 STRUCTURES                                                    
*AUTHOR    J.L.BATTISTE, R.LI, C.WOODWARD                                        
*REVDAT   1   12-SEP-01 1JV8    0                                                
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assi ( resi  19 and name HA   ) ( resi  34 and name HA   ) 0 0 4.0
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assi ( resi  21 and name HD*  ) ( resi  31 and name HA   ) 0 0 5.0
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assi ( resi  21 and name HE*  ) ( resi  48 and name HA   ) 0 0 5.0
assi ( resi  21 and name HE*  ) ( resi  48 and name HB*  ) 0 0 4.0
assi ( resi  22 and name HE*  ) ( resi  24 and name HA   ) 0 0 3.0
assi ( resi  22 and name HE*  ) ( resi  24 and name HB1  ) 0 0 3.0
assi ( resi  22 and name HZ   ) ( resi  24 and name HB1  ) 0 0 4.0
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assi ( resi  22 and name HB2  ) ( resi  33 and name HD*  ) 0 0 3.0
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assi ( resi  22 and name HE*  ) ( resi  33 and name HB2  ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  25 and name HA   ) 0 0 3.0
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assi ( resi  48 and name HB*  ) ( resi  49 and name HA   ) 0 0 5.0
assi ( resi  49 and name HA   ) ( resi  52 and name HB1  ) 0 0 4.0
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assi ( resi  51 and name HA   ) ( resi  54 and name HB   ) 0 0 5.0
assi ( resi  52 and name HA   ) ( resi  56 and name HA*  ) 0 0 4.0
assi ( resi  54 and name HG2* ) ( resi  55 and name HA   ) 0 0 5.0
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assi ( resi  16 and name HB*  ) ( resi  37 and name HA   ) 0 0 5.0
assi ( resi  18 and name HB   ) ( resi  35 and name HD2  ) 0 0 4.0
assi ( resi  18 and name HD1* ) ( resi  35 and name HD2  ) 0 0 5.0
assi ( resi  18 and name HD1* ) ( resi  35 and name HE2  ) 0 0 5.0
assi ( resi  18 and name HG2* ) ( resi  35 and name HD2  ) 0 0 4.0
assi ( resi  20 and name HG*  ) ( resi  35 and name HD2  ) 0 0 5.0
assi ( resi  21 and name HE*  ) ( resi  31 and name HA   ) 0 0 5.0
assi ( resi  22 and name HA   ) ( resi  45 and name HD*  ) 0 0 4.0
assi ( resi  23 and name HD1  ) ( resi  25 and name HB*  ) 0 0 5.0
assi ( resi  33 and name HE*  ) ( resi  35 and name HD1  ) 0 0 5.0
assi ( resi  35 and name HA   ) ( resi  35 and name HD1  ) 0 0 4.0
assi ( resi  35 and name HE2  ) ( resi  37 and name HB*  ) 0 0 5.0
assi ( resi  35 and name HD2  ) ( resi  37 and name HA   ) 0 0 5.0
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assi ( resi  35 and name HE1  ) ( resi  40 and name HA   ) 0 0 3.0
assi ( resi  35 and name HE1  ) ( resi  40 and name HB*  ) 0 0 5.0
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assi ( resi  35 and name HD1  ) ( resi  36 and name HN   ) 0 0 5.0
assi ( resi  35 and name HD1  ) ( resi  37 and name HN   ) 0 0 5.0
assi ( resi  35 and name HE2  ) ( resi  37 and name HN   ) 0 0 5.0
assi ( resi  35 and name HD2  ) ( resi  44 and name HD22 ) 0 0 5.0

assi ( resi   1 and name HE   ) ( resi   6 and name HD2* ) 0 0 5.0
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assi ( resi   2 and name HB1  ) ( resi   4 and name HN   ) 0 0 4.0
assi ( resi   2 and name HB1  ) ( resi   4 and name HZ   ) 0 0 5.0
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assi ( resi   2 and name HB1  ) ( resi   5 and name HN   ) 0 0 4.0
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assi ( resi   3 and name HB*  ) ( resi   4 and name HN   ) 0 0 4.0
assi ( resi   3 and name HN   ) ( resi   4 and name HD*  ) 0 0 5.0
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assi ( resi   3 and name HN   ) ( resi   6 and name HD1* ) 0 0 5.0
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assi ( resi   4 and name HN   ) ( resi   5 and name HN   ) 0 0 4.0
assi ( resi   4 and name HA   ) ( resi   6 and name HN   ) 0 0 4.0
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assi ( resi   4 and name HB1  ) ( resi  42 and name HN   ) 0 0 5.0
assi ( resi   4 and name HD*  ) ( resi  42 and name HB1  ) 0 0 4.0
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assi ( resi   4 and name HE*  ) ( resi  42 and name HD*  ) 0 0 4.0
assi ( resi   4 and name HD*  ) ( resi  43 and name HA   ) 0 0 4.0
assi ( resi   4 and name HD*  ) ( resi  43 and name HB1  ) 0 0 4.0
assi ( resi   4 and name HE*  ) ( resi  43 and name HA   ) 0 0 4.0
assi ( resi   4 and name HE*  ) ( resi  45 and name HZ   ) 0 0 3.0
assi ( resi   4 and name HZ   ) ( resi  45 and name HZ   ) 0 0 4.0
assi ( resi   4 and name HE*  ) ( resi  54 and name HG2* ) 0 0 3.0
assi ( resi   5 and name HA   ) ( resi   6 and name HN   ) 0 0 4.0
assi ( resi   5 and name HB*  ) ( resi   6 and name HN   ) 0 0 4.0
assi ( resi   5 and name HN   ) ( resi   6 and name HN   ) 0 0 3.0
assi ( resi   5 and name HA   ) ( resi   7 and name HN   ) 0 0 4.0
assi ( resi   5 and name HA   ) ( resi  43 and name HD22 ) 0 0 5.0
assi ( resi   5 and name HA   ) ( resi  43 and name HD21 ) 0 0 4.0
assi ( resi   6 and name HA   ) ( resi   7 and name HN   ) 0 0 4.0
assi ( resi   6 and name HB*  ) ( resi   7 and name HN   ) 0 0 4.0
assi ( resi   6 and name HD1* ) ( resi   7 and name HN   ) 0 0 5.0
assi ( resi   6 and name HD2* ) ( resi   7 and name HN   ) 0 0 5.0
assi ( resi   6 and name HG   ) ( resi   7 and name HN   ) 0 0 4.0
assi ( resi   6 and name HN   ) ( resi   7 and name HN   ) 0 0 2.5
assi ( resi   6 and name HD1* ) ( resi  23 and name HE*  ) 0 0 5.0
assi ( resi   6 and name HD2* ) ( resi  23 and name HE*  ) 0 0 4.0
assi ( resi   6 and name HD2* ) ( resi  25 and name HN   ) 0 0 5.0
assi ( resi   7 and name HB*  ) ( resi  43 and name HD21 ) 0 0 4.0
assi ( resi   7 and name HN   ) ( resi  43 and name HD22 ) 0 0 5.0
assi ( resi   7 and name HN   ) ( resi  43 and name HD21 ) 0 0 4.0
assi ( resi   9 and name HA   ) ( resi  10 and name HN   ) 0 0 3.0
assi ( resi   9 and name HB1  ) ( resi  10 and name HN   ) 0 0 4.0
assi ( resi   9 and name HB2  ) ( resi  10 and name HN   ) 0 0 5.0
assi ( resi   9 and name HD2  ) ( resi  22 and name HE*  ) 0 0 4.0
assi ( resi   9 and name HG2  ) ( resi  22 and name HE*  ) 0 0 4.0
assi ( resi   9 and name HG2  ) ( resi  22 and name HZ   ) 0 0 5.0
assi ( resi   9 and name HB1  ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi   9 and name HB1  ) ( resi  33 and name HE*  ) 0 0 4.0
assi ( resi   9 and name HB2  ) ( resi  33 and name HD*  ) 0 0 5.0
assi ( resi   9 and name HB2  ) ( resi  33 and name HE*  ) 0 0 4.0
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assi ( resi  10 and name HD*  ) ( resi  11 and name HN   ) 0 0 5.0
assi ( resi  10 and name HA   ) ( resi  12 and name HN   ) 0 0 3.0
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assi ( resi  10 and name HE*  ) ( resi  12 and name HA1  ) 0 0 4.0
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assi ( resi  10 and name HD*  ) ( resi  40 and name HA   ) 0 0 4.0
assi ( resi  10 and name HB*  ) ( resi  41 and name HN   ) 0 0 5.0
assi ( resi  10 and name HD*  ) ( resi  41 and name HD*  ) 0 0 3.0
assi ( resi  10 and name HD*  ) ( resi  41 and name HN   ) 0 0 4.0
assi ( resi  11 and name HB   ) ( resi  12 and name HN   ) 0 0 4.0
assi ( resi  11 and name HG2* ) ( resi  12 and name HN   ) 0 0 4.0
assi ( resi  11 and name HN   ) ( resi  12 and name HN   ) 0 0 4.0
assi ( resi  11 and name HA   ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  11 and name HA   ) ( resi  33 and name HE*  ) 0 0 3.0
assi ( resi  11 and name HN   ) ( resi  10 and name HB*  ) 0 0 5.0
assi ( resi  11 and name HA   ) ( resi  36 and name HN   ) 0 0 4.0
assi ( resi  12 and name HA1  ) ( resi  12 and name HN   ) 0 0 3.0
assi ( resi  12 and name HA2  ) ( resi  12 and name HN   ) 0 0 4.0
assi ( resi  14 and name HA   ) ( resi  15 and name HN   ) 0 0 4.0
assi ( resi  14 and name HB2  ) ( resi  15 and name HN   ) 0 0 4.0
assi ( resi  14 and name HB2  ) ( resi  16 and name HN   ) 0 0 4.0
assi ( resi  14 and name HB1  ) ( resi  38 and name HN   ) 0 0 4.0
assi ( resi  15 and name HA   ) ( resi  16 and name HN   ) 0 0 4.0
assi ( resi  15 and name HB1  ) ( resi  16 and name HN   ) 0 0 5.0
assi ( resi  16 and name HA   ) ( resi  17 and name HN   ) 0 0 3.0
assi ( resi  16 and name HB*  ) ( resi  17 and name HN   ) 0 0 3.0
assi ( resi  16 and name HN   ) ( resi  36 and name HA*  ) 0 0 4.0
assi ( resi  16 and name HN   ) ( resi  37 and name HB*  ) 0 0 4.0
assi ( resi  17 and name HA   ) ( resi  18 and name HN   ) 0 0 2.5
assi ( resi  18 and name HA   ) ( resi  19 and name HN   ) 0 0 2.5
assi ( resi  18 and name HD1* ) ( resi  19 and name HN   ) 0 0 5.0
assi ( resi  18 and name HG2* ) ( resi  19 and name HN   ) 0 0 4.0
assi ( resi  18 and name HN   ) ( resi  19 and name HN   ) 0 0 5.0
assi ( resi  18 and name HG2* ) ( resi  20 and name HE   ) 0 0 3.0
assi ( resi  18 and name HN   ) ( resi  34 and name HG1* ) 0 0 4.0
assi ( resi  18 and name HB   ) ( resi  35 and name HN   ) 0 0 5.0
assi ( resi  18 and name HD1* ) ( resi  35 and name HE*  ) 0 0 4.0
assi ( resi  18 and name HG2* ) ( resi  35 and name HE*  ) 0 0 5.0
assi ( resi  18 and name HN   ) ( resi  35 and name HN   ) 0 0 4.0
assi ( resi  19 and name HA   ) ( resi  20 and name HN   ) 0 0 2.5
assi ( resi  19 and name HD1* ) ( resi  20 and name HN   ) 0 0 4.0
assi ( resi  19 and name HG2* ) ( resi  20 and name HN   ) 0 0 4.0
assi ( resi  19 and name HN   ) ( resi  20 and name HN   ) 0 0 4.0
assi ( resi  19 and name HG2* ) ( resi  21 and name HD*  ) 0 0 5.0
assi ( resi  19 and name HG2* ) ( resi  21 and name HE*  ) 0 0 4.0
assi ( resi  19 and name HG2* ) ( resi  33 and name HN   ) 0 0 4.0
assi ( resi  20 and name HA   ) ( resi  21 and name HN   ) 0 0 3.0
assi ( resi  20 and name HB1  ) ( resi  21 and name HN   ) 0 0 4.0
assi ( resi  20 and name HD*  ) ( resi  21 and name HN   ) 0 0 4.0
assi ( resi  20 and name HN   ) ( resi  32 and name HB   ) 0 0 5.0
assi ( resi  20 and name HB1  ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  20 and name HB1  ) ( resi  33 and name HE*  ) 0 0 4.0
assi ( resi  20 and name HB2  ) ( resi  33 and name HE*  ) 0 0 4.0
assi ( resi  20 and name HN   ) ( resi  33 and name HN   ) 0 0 4.0
assi ( resi  20 and name HN   ) ( resi  34 and name HA   ) 0 0 4.0
assi ( resi  20 and name HN   ) ( resi  35 and name HN   ) 0 0 5.0
assi ( resi  20 and name HB2  ) ( resi  45 and name HN   ) 0 0 4.0
assi ( resi  20 and name HD*  ) ( resi  45 and name HN   ) 0 0 5.0
assi ( resi  20 and name HE   ) ( resi  46 and name HA   ) 0 0 4.0
assi ( resi  21 and name HA   ) ( resi  22 and name HN   ) 0 0 2.5
assi ( resi  21 and name HD*  ) ( resi  22 and name HN   ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  30 and name HB1  ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  31 and name HA   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  31 and name HN   ) 0 0 5.0
assi ( resi  21 and name HA   ) ( resi  32 and name HG2* ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  32 and name HA   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  32 and name HG2* ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  32 and name HN   ) 0 0 5.0
assi ( resi  21 and name HE*  ) ( resi  32 and name HG2* ) 0 0 3.0
assi ( resi  21 and name HE*  ) ( resi  32 and name HN   ) 0 0 5.0
assi ( resi  21 and name HA   ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  21 and name HA   ) ( resi  33 and name HE*  ) 0 0 4.0
assi ( resi  21 and name HA   ) ( resi  33 and name HN   ) 0 0 5.0
assi ( resi  21 and name HN   ) ( resi  33 and name HE*  ) 0 0 5.0
assi ( resi  21 and name HB*  ) ( resi  45 and name HN   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  45 and name HB1  ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  45 and name HN   ) 0 0 5.0
assi ( resi  21 and name HN   ) ( resi  45 and name HB1  ) 0 0 4.0
assi ( resi  21 and name HN   ) ( resi  45 and name HN   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  46 and name HA   ) 0 0 4.0
assi ( resi  21 and name HE*  ) ( resi  46 and name HA   ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  47 and name HA   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  21 and name HE*  ) ( resi  47 and name HA   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  48 and name HA   ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  48 and name HB*  ) 0 0 4.0
assi ( resi  21 and name HD*  ) ( resi  48 and name HN   ) 0 0 4.0
assi ( resi  21 and name HE*  ) ( resi  48 and name HA   ) 0 0 5.0
assi ( resi  21 and name HE*  ) ( resi  48 and name HB*  ) 0 0 3.0
assi ( resi  21 and name HE*  ) ( resi  48 and name HN   ) 0 0 4.0
assi ( resi  22 and name HA   ) ( resi  23 and name HN   ) 0 0 3.0
assi ( resi  22 and name HB1  ) ( resi  23 and name HN   ) 0 0 4.0
assi ( resi  22 and name HB2  ) ( resi  23 and name HN   ) 0 0 4.0
assi ( resi  22 and name HD*  ) ( resi  23 and name HN   ) 0 0 5.0
assi ( resi  22 and name HE*  ) ( resi  24 and name HA   ) 0 0 3.0
assi ( resi  22 and name HE*  ) ( resi  24 and name HB1  ) 0 0 3.0
assi ( resi  22 and name HE*  ) ( resi  24 and name HD21 ) 0 0 5.0
assi ( resi  22 and name HZ   ) ( resi  24 and name HA   ) 0 0 4.0
assi ( resi  22 and name HZ   ) ( resi  24 and name HB1  ) 0 0 4.0
assi ( resi  22 and name HZ   ) ( resi  24 and name HD21 ) 0 0 4.0
assi ( resi  22 and name HN   ) ( resi  30 and name HA   ) 0 0 5.0
assi ( resi  22 and name HE*  ) ( resi  31 and name HB1  ) 0 0 3.0
assi ( resi  22 and name HE*  ) ( resi  31 and name HN   ) 0 0 5.0
assi ( resi  22 and name HN   ) ( resi  31 and name HN   ) 0 0 4.0
assi ( resi  22 and name HB1  ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  22 and name HB2  ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  22 and name HB2  ) ( resi  33 and name HE*  ) 0 0 3.0
assi ( resi  22 and name HD*  ) ( resi  33 and name HB2  ) 0 0 4.0
assi ( resi  22 and name HE*  ) ( resi  33 and name HA   ) 0 0 4.0
assi ( resi  22 and name HE*  ) ( resi  33 and name HB2  ) 0 0 3.0
assi ( resi  22 and name HN   ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  22 and name HA   ) ( resi  43 and name HD22 ) 0 0 5.0
assi ( resi  22 and name HB1  ) ( resi  43 and name HD22 ) 0 0 4.0
assi ( resi  22 and name HB1  ) ( resi  43 and name HD21 ) 0 0 5.0
assi ( resi  22 and name HA   ) ( resi  45 and name HN   ) 0 0 5.0
assi ( resi  23 and name HA   ) ( resi  24 and name HN   ) 0 0 2.5
assi ( resi  23 and name HE*  ) ( resi  25 and name HA   ) 0 0 3.0
assi ( resi  23 and name HE*  ) ( resi  25 and name HB*  ) 0 0 3.0
assi ( resi  23 and name HE*  ) ( resi  25 and name HN   ) 0 0 5.0
assi ( resi  23 and name HE*  ) ( resi  28 and name HA1  ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  28 and name HA2  ) 0 0 5.0
assi ( resi  23 and name HE*  ) ( resi  29 and name HA   ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  29 and name HN   ) 0 0 4.0
assi ( resi  23 and name HA   ) ( resi  31 and name HN   ) 0 0 4.0
assi ( resi  23 and name HB2  ) ( resi  43 and name HD22 ) 0 0 3.0
assi ( resi  23 and name HB2  ) ( resi  43 and name HD21 ) 0 0 5.0
assi ( resi  23 and name HN   ) ( resi  43 and name HD22 ) 0 0 4.0
assi ( resi  23 and name HN   ) ( resi  43 and name HD21 ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  52 and name HA   ) 0 0 5.0
assi ( resi  23 and name HE*  ) ( resi  52 and name HE*  ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  55 and name HB*  ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  56 and name HA*  ) 0 0 4.0
assi ( resi  23 and name HE*  ) ( resi  58 and name HB*  ) 0 0 5.0
assi ( resi  24 and name HA   ) ( resi  25 and name HN   ) 0 0 2.5
assi ( resi  24 and name HN   ) ( resi  25 and name HN   ) 0 0 5.0
assi ( resi  24 and name HA   ) ( resi  26 and name HN   ) 0 0 4.0
assi ( resi  24 and name HD22 ) ( resi  26 and name HB*  ) 0 0 4.0
assi ( resi  24 and name HB1  ) ( resi  27 and name HN   ) 0 0 4.0
assi ( resi  24 and name HD22 ) ( resi  27 and name HB*  ) 0 0 4.0
assi ( resi  24 and name HD22 ) ( resi  27 and name HN   ) 0 0 4.0
assi ( resi  24 and name HD21 ) ( resi  27 and name HB*  ) 0 0 4.0
assi ( resi  24 and name HB2  ) ( resi  29 and name HN   ) 0 0 4.0
assi ( resi  24 and name HN   ) ( resi  29 and name HN   ) 0 0 4.0
assi ( resi  24 and name HN   ) ( resi  30 and name HA   ) 0 0 4.0
assi ( resi  24 and name HD21 ) ( resi  31 and name HE22 ) 0 0 4.0
assi ( resi  24 and name HD21 ) ( resi  31 and name HE21 ) 0 0 5.0
assi ( resi  24 and name HN   ) ( resi  31 and name HN   ) 0 0 5.0
assi ( resi  25 and name HA   ) ( resi  26 and name HN   ) 0 0 4.0
assi ( resi  25 and name HB*  ) ( resi  26 and name HN   ) 0 0 3.0
assi ( resi  25 and name HN   ) ( resi  26 and name HN   ) 0 0 4.0
assi ( resi  25 and name HA   ) ( resi  27 and name HN   ) 0 0 4.0
assi ( resi  25 and name HN   ) ( resi  27 and name HN   ) 0 0 5.0
assi ( resi  25 and name HA   ) ( resi  28 and name HN   ) 0 0 4.0
assi ( resi  25 and name HB*  ) ( resi  28 and name HN   ) 0 0 5.0
assi ( resi  26 and name HB*  ) ( resi  27 and name HN   ) 0 0 4.0
assi ( resi  26 and name HN   ) ( resi  27 and name HN   ) 0 0 3.0
assi ( resi  26 and name HN   ) ( resi  28 and name HN   ) 0 0 4.0
assi ( resi  27 and name HA   ) ( resi  28 and name HN   ) 0 0 4.0
assi ( resi  27 and name HB*  ) ( resi  28 and name HN   ) 0 0 4.0
assi ( resi  27 and name HN   ) ( resi  28 and name HN   ) 0 0 2.5
assi ( resi  27 and name HB*  ) ( resi  31 and name HE22 ) 0 0 4.0
assi ( resi  27 and name HB*  ) ( resi  31 and name HE21 ) 0 0 4.0
assi ( resi  28 and name HA1  ) ( resi  29 and name HN   ) 0 0 4.0
assi ( resi  28 and name HA2  ) ( resi  29 and name HN   ) 0 0 4.0
assi ( resi  28 and name HN   ) ( resi  29 and name HN   ) 0 0 3.0
assi ( resi  29 and name HA   ) ( resi  30 and name HN   ) 0 0 3.0
assi ( resi  29 and name HB*  ) ( resi  30 and name HN   ) 0 0 3.0
assi ( resi  29 and name HD1* ) ( resi  30 and name HN   ) 0 0 4.0
assi ( resi  29 and name HD2* ) ( resi  30 and name HN   ) 0 0 4.0
assi ( resi  29 and name HN   ) ( resi  30 and name HN   ) 0 0 4.0
assi ( resi  29 and name HD1* ) ( resi  31 and name HE22 ) 0 0 5.0
assi ( resi  29 and name HD1* ) ( resi  31 and name HE21 ) 0 0 4.0
assi ( resi  30 and name HA   ) ( resi  31 and name HN   ) 0 0 2.5
assi ( resi  30 and name HB1  ) ( resi  31 and name HN   ) 0 0 4.0
assi ( resi  30 and name HB2  ) ( resi  31 and name HN   ) 0 0 4.0
assi ( resi  30 and name HN   ) ( resi  31 and name HN   ) 0 0 5.0
assi ( resi  30 and name HN   ) ( resi  52 and name HE*  ) 0 0 5.0
assi ( resi  31 and name HA   ) ( resi  32 and name HN   ) 0 0 3.0
assi ( resi  31 and name HB1  ) ( resi  32 and name HN   ) 0 0 4.0
assi ( resi  31 and name HB2  ) ( resi  32 and name HN   ) 0 0 3.0
assi ( resi  31 and name HN   ) ( resi  32 and name HN   ) 0 0 5.0
assi ( resi  32 and name HA   ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  32 and name HA   ) ( resi  33 and name HN   ) 0 0 2.5
assi ( resi  32 and name HB   ) ( resi  33 and name HN   ) 0 0 4.0
assi ( resi  32 and name HG2* ) ( resi  33 and name HN   ) 0 0 4.0
assi ( resi  33 and name HA   ) ( resi  34 and name HN   ) 0 0 3.0
assi ( resi  33 and name HB1  ) ( resi  34 and name HN   ) 0 0 3.0
assi ( resi  33 and name HB2  ) ( resi  34 and name HN   ) 0 0 4.0
assi ( resi  33 and name HD*  ) ( resi  34 and name HN   ) 0 0 4.0
assi ( resi  33 and name HD*  ) ( resi  35 and name HA   ) 0 0 4.0
assi ( resi  33 and name HD*  ) ( resi  35 and name HB1  ) 0 0 5.0
assi ( resi  33 and name HE*  ) ( resi  35 and name HA   ) 0 0 4.0
assi ( resi  33 and name HE*  ) ( resi  35 and name HB1  ) 0 0 4.0
assi ( resi  33 and name HD*  ) ( resi  44 and name HA   ) 0 0 4.0
assi ( resi  33 and name HE*  ) ( resi  44 and name HA   ) 0 0 3.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HA   ) 0 0 4.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HB1  ) 0 0 4.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HB2  ) 0 0 4.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HD22 ) 0 0 4.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HD21 ) 0 0 4.0
assi ( resi  34 and name HA   ) ( resi  35 and name HN   ) 0 0 2.5
assi ( resi  34 and name HG1* ) ( resi  35 and name HN   ) 0 0 4.0
assi ( resi  34 and name HG2* ) ( resi  35 and name HN   ) 0 0 5.0
assi ( resi  35 and name HA   ) ( resi  36 and name HN   ) 0 0 3.0
assi ( resi  35 and name HE*  ) ( resi  37 and name HA   ) 0 0 3.0
assi ( resi  35 and name HE*  ) ( resi  37 and name HB*  ) 0 0 4.0
assi ( resi  35 and name HE*  ) ( resi  37 and name HN   ) 0 0 4.0
assi ( resi  35 and name HE*  ) ( resi  38 and name HN   ) 0 0 4.0
assi ( resi  35 and name HE*  ) ( resi  40 and name HA   ) 0 0 3.0
assi ( resi  35 and name HE*  ) ( resi  40 and name HB*  ) 0 0 3.0
assi ( resi  35 and name HE*  ) ( resi  40 and name HN   ) 0 0 4.0
assi ( resi  35 and name HE*  ) ( resi  44 and name HD21 ) 0 0 4.0
assi ( resi  35 and name HE*  ) ( resi  44 and name HD22 ) 0 0 4.0
assi ( resi  37 and name HA   ) ( resi  38 and name HN   ) 0 0 4.0
assi ( resi  37 and name HB*  ) ( resi  38 and name HN   ) 0 0 5.0
assi ( resi  37 and name HN   ) ( resi  38 and name HN   ) 0 0 4.0
assi ( resi  38 and name HA   ) ( resi  39 and name HN   ) 0 0 3.0
assi ( resi  38 and name HA   ) ( resi  40 and name HN   ) 0 0 4.0
assi ( resi  39 and name HA   ) ( resi  40 and name HN   ) 0 0 4.0
assi ( resi  39 and name HN   ) ( resi  40 and name HN   ) 0 0 4.0
assi ( resi  40 and name HA   ) ( resi  41 and name HN   ) 0 0 2.5
assi ( resi  40 and name HB*  ) ( resi  41 and name HN   ) 0 0 3.0
assi ( resi  40 and name HA   ) ( resi  44 and name HD21 ) 0 0 4.0
assi ( resi  40 and name HB*  ) ( resi  44 and name HD21 ) 0 0 4.0
assi ( resi  40 and name HB*  ) ( resi  44 and name HD22 ) 0 0 4.0
assi ( resi  41 and name HA   ) ( resi  42 and name HN   ) 0 0 3.0
assi ( resi  41 and name HB1  ) ( resi  42 and name HN   ) 0 0 3.0
assi ( resi  41 and name HB2  ) ( resi  42 and name HN   ) 0 0 2.5
assi ( resi  41 and name HB2  ) ( resi  43 and name HN   ) 0 0 4.0
assi ( resi  41 and name HN   ) ( resi  44 and name HD21 ) 0 0 4.0
assi ( resi  42 and name HA   ) ( resi  43 and name HN   ) 0 0 5.0
assi ( resi  42 and name HB1  ) ( resi  43 and name HN   ) 0 0 4.0
assi ( resi  42 and name HN   ) ( resi  43 and name HN   ) 0 0 4.0
assi ( resi  42 and name HA   ) ( resi  44 and name HN   ) 0 0 5.0
assi ( resi  43 and name HA   ) ( resi  44 and name HN   ) 0 0 3.0
assi ( resi  43 and name HA   ) ( resi  45 and name HZ   ) 0 0 4.0
assi ( resi  44 and name HA   ) ( resi  45 and name HN   ) 0 0 2.5
assi ( resi  45 and name HA   ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  45 and name HB1  ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  45 and name HB2  ) ( resi  47 and name HN   ) 0 0 3.0
assi ( resi  45 and name HB1  ) ( resi  51 and name HN   ) 0 0 4.0
assi ( resi  45 and name HB2  ) ( resi  51 and name HN   ) 0 0 4.0
assi ( resi  45 and name HZ   ) ( resi  51 and name HA   ) 0 0 5.0
assi ( resi  45 and name HZ   ) ( resi  54 and name HB   ) 0 0 4.0
assi ( resi  45 and name HZ   ) ( resi  54 and name HG2* ) 0 0 3.0
assi ( resi  46 and name HA   ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  46 and name HB*  ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  46 and name HG*  ) ( resi  47 and name HN   ) 0 0 4.0
assi ( resi  46 and name HN   ) ( resi  47 and name HN   ) 0 0 3.0
assi ( resi  46 and name HN   ) ( resi  50 and name HB*  ) 0 0 4.0
assi ( resi  47 and name HA   ) ( resi  48 and name HN   ) 0 0 2.5
assi ( resi  47 and name HB1  ) ( resi  48 and name HN   ) 0 0 3.0
assi ( resi  47 and name HB2  ) ( resi  48 and name HN   ) 0 0 4.0
assi ( resi  47 and name HN   ) ( resi  48 and name HN   ) 0 0 5.0
assi ( resi  47 and name HA   ) ( resi  49 and name HN   ) 0 0 4.0
assi ( resi  47 and name HB1  ) ( resi  49 and name HN   ) 0 0 4.0
assi ( resi  47 and name HN   ) ( resi  49 and name HN   ) 0 0 5.0
assi ( resi  47 and name HA   ) ( resi  50 and name HN   ) 0 0 5.0
assi ( resi  47 and name HB1  ) ( resi  50 and name HN   ) 0 0 4.0
assi ( resi  48 and name HA   ) ( resi  49 and name HN   ) 0 0 5.0
assi ( resi  48 and name HB*  ) ( resi  49 and name HN   ) 0 0 3.0
assi ( resi  48 and name HN   ) ( resi  49 and name HN   ) 0 0 3.0
assi ( resi  48 and name HA   ) ( resi  50 and name HN   ) 0 0 5.0
assi ( resi  48 and name HN   ) ( resi  50 and name HN   ) 0 0 5.0
assi ( resi  49 and name HA   ) ( resi  50 and name HN   ) 0 0 4.0
assi ( resi  49 and name HB*  ) ( resi  50 and name HN   ) 0 0 3.0
assi ( resi  49 and name HG*  ) ( resi  50 and name HN   ) 0 0 5.0
assi ( resi  49 and name HN   ) ( resi  50 and name HN   ) 0 0 4.0
assi ( resi  49 and name HA   ) ( resi  51 and name HN   ) 0 0 5.0
assi ( resi  49 and name HN   ) ( resi  51 and name HN   ) 0 0 4.0
assi ( resi  49 and name HA   ) ( resi  52 and name HN   ) 0 0 4.0
assi ( resi  49 and name HA   ) ( resi  53 and name HN   ) 0 0 4.0
assi ( resi  50 and name HA   ) ( resi  51 and name HN   ) 0 0 4.0
assi ( resi  50 and name HB*  ) ( resi  51 and name HN   ) 0 0 3.0
assi ( resi  50 and name HN   ) ( resi  51 and name HN   ) 0 0 3.0
assi ( resi  50 and name HN   ) ( resi  52 and name HN   ) 0 0 4.0
assi ( resi  50 and name HA   ) ( resi  53 and name HE   ) 0 0 4.0
assi ( resi  50 and name HA   ) ( resi  53 and name HN   ) 0 0 4.0
assi ( resi  50 and name HA   ) ( resi  54 and name HN   ) 0 0 5.0
assi ( resi  51 and name HA   ) ( resi  52 and name HN   ) 0 0 5.0
assi ( resi  51 and name HB1  ) ( resi  52 and name HN   ) 0 0 4.0
assi ( resi  51 and name HB2  ) ( resi  52 and name HN   ) 0 0 3.0
assi ( resi  51 and name HN   ) ( resi  52 and name HN   ) 0 0 4.0
assi ( resi  51 and name HN   ) ( resi  53 and name HN   ) 0 0 5.0
assi ( resi  51 and name HA   ) ( resi  54 and name HN   ) 0 0 4.0
assi ( resi  51 and name HA   ) ( resi  55 and name HN   ) 0 0 4.0
assi ( resi  52 and name HA   ) ( resi  53 and name HN   ) 0 0 4.0
assi ( resi  52 and name HB1  ) ( resi  53 and name HN   ) 0 0 4.0
assi ( resi  52 and name HG*  ) ( resi  53 and name HN   ) 0 0 5.0
assi ( resi  52 and name HN   ) ( resi  53 and name HN   ) 0 0 3.0
assi ( resi  52 and name HN   ) ( resi  54 and name HN   ) 0 0 5.0
assi ( resi  52 and name HA   ) ( resi  55 and name HN   ) 0 0 4.0
assi ( resi  52 and name HA   ) ( resi  56 and name HN   ) 0 0 4.0
assi ( resi  53 and name HB*  ) ( resi  54 and name HN   ) 0 0 4.0
assi ( resi  53 and name HN   ) ( resi  54 and name HN   ) 0 0 3.0
assi ( resi  54 and name HA   ) ( resi  55 and name HN   ) 0 0 4.0
assi ( resi  54 and name HB   ) ( resi  55 and name HN   ) 0 0 3.0
assi ( resi  54 and name HG2* ) ( resi  55 and name HN   ) 0 0 3.0
assi ( resi  54 and name HN   ) ( resi  55 and name HN   ) 0 0 3.0
assi ( resi  54 and name HN   ) ( resi  56 and name HN   ) 0 0 4.0
assi ( resi  55 and name HA   ) ( resi  56 and name HN   ) 0 0 4.0
assi ( resi  55 and name HN   ) ( resi  56 and name HN   ) 0 0 3.0
assi ( resi  56 and name HA*  ) ( resi  56 and name HN   ) 0 0 2.5
assi ( resi  56 and name HA*  ) ( resi  57 and name HN   ) 0 0 4.0
assi ( resi  57 and name HA*  ) ( resi  58 and name HN   ) 0 0 3.0
assi ( resi  58 and name HA   ) ( resi  58 and name HN   ) 0 0 4.0
assi ( resi  58 and name HB*  ) ( resi  58 and name HN   ) 0 0 3.0
assign (resid  2 and name c ) (resid  3 and name n )
       (resid  3 and name ca) (resid  3 and name c ) 1.0  -80.0   85.0 2
assign (resid  3 and name n ) (resid  3 and name ca)
       (resid  3 and name c ) (resid  4 and name n ) 1.0    5.0  100.0 2
assign (resid  3 and name c ) (resid  4 and name n )
       (resid  4 and name ca) (resid  4 and name c ) 1.0  -50.0   15.0 2
assign (resid  4 and name n ) (resid  4 and name ca)
       (resid  4 and name c ) (resid  5 and name n ) 1.0  -60.0   45.0 2
assign (resid  4 and name c ) (resid  5 and name n )
       (resid  5 and name ca) (resid  5 and name c ) 1.0  -65.0   20.0 2
assign (resid  5 and name n ) (resid  5 and name ca)
       (resid  5 and name c ) (resid  6 and name n ) 1.0  -40.0   45.0 2
assign (resid  5 and name c ) (resid  6 and name n )
       (resid  6 and name ca) (resid  6 and name c ) 1.0  160.0  125.0 2
assign (resid  6 and name n ) (resid  6 and name ca)
       (resid  6 and name c ) (resid  7 and name n ) 1.0   60.0  165.0 2
assign (resid  6 and name c ) (resid  7 and name n )
       (resid  7 and name ca) (resid  7 and name c ) 1.0  -55.0  100.0 2
assign (resid  7 and name n ) (resid  7 and name ca)
       (resid  7 and name c ) (resid  8 and name n ) 1.0   60.0  165.0 2
assign (resid  9 and name c ) (resid 10 and name n )
       (resid 10 and name ca) (resid 10 and name c ) 1.0 -120.0   35.0 2
assign (resid 10 and name n ) (resid 10 and name ca)
       (resid 10 and name c ) (resid 11 and name n ) 1.0  135.0   40.0 2
assign (resid 10 and name c ) (resid 11 and name n )
       (resid 11 and name ca) (resid 11 and name c ) 1.0  -60.0   25.0 2
assign (resid 11 and name n ) (resid 11 and name ca)
       (resid 11 and name c ) (resid 12 and name n ) 1.0  -55.0   30.0 2
assign (resid 13 and name c ) (resid 14 and name n )
       (resid 14 and name ca) (resid 14 and name c ) 1.0  125.0  120.0 2
assign (resid 14 and name n ) (resid 14 and name ca)
       (resid 14 and name c ) (resid 15 and name n ) 1.0  175.0   30.0 2
assign (resid 14 and name c ) (resid 15 and name n )
       (resid 15 and name ca) (resid 15 and name c ) 1.0  -60.0  115.0 2
assign (resid 15 and name n ) (resid 15 and name ca)
       (resid 15 and name c ) (resid 16 and name n ) 1.0  115.0  160.0 2
assign (resid 16 and name c ) (resid 17 and name n )
       (resid 17 and name ca) (resid 17 and name c ) 1.0 -120.0   35.0 2
assign (resid 17 and name n ) (resid 17 and name ca)
       (resid 17 and name c ) (resid 18 and name n ) 1.0  115.0   80.0 2
assign (resid 17 and name c ) (resid 18 and name n )
       (resid 18 and name ca) (resid 18 and name c ) 1.0 -120.0   45.0 2
assign (resid 18 and name n ) (resid 18 and name ca)
       (resid 18 and name c ) (resid 19 and name n ) 1.0  115.0   50.0 2
assign (resid 18 and name c ) (resid 19 and name n )
       (resid 19 and name ca) (resid 19 and name c ) 1.0  -80.0   25.0 2
assign (resid 19 and name n ) (resid 19 and name ca)
       (resid 19 and name c ) (resid 20 and name n ) 1.0  115.0   50.0 2
assign (resid 19 and name c ) (resid 20 and name n )
       (resid 20 and name ca) (resid 20 and name c ) 1.0 -120.0   45.0 2
assign (resid 20 and name n ) (resid 20 and name ca)
       (resid 20 and name c ) (resid 21 and name n ) 1.0  210.0   65.0 2
assign (resid 20 and name c ) (resid 21 and name n )
       (resid 21 and name ca) (resid 21 and name c ) 1.0 -120.0   35.0 2
assign (resid 21 and name n ) (resid 21 and name ca)
       (resid 21 and name c ) (resid 22 and name n ) 1.0  165.0   20.0 2
assign (resid 21 and name c ) (resid 22 and name n )
       (resid 22 and name ca) (resid 22 and name c ) 1.0  170.0  115.0 2
assign (resid 22 and name n ) (resid 22 and name ca)
       (resid 22 and name c ) (resid 23 and name n ) 1.0  160.0   25.0 2
assign (resid 22 and name c ) (resid 23 and name n )
       (resid 23 and name ca) (resid 23 and name c ) 1.0 -100.0   35.0 2
assign (resid 23 and name n ) (resid 23 and name ca)
       (resid 23 and name c ) (resid 24 and name n ) 1.0  115.0   60.0 2
assign (resid 23 and name c ) (resid 24 and name n )
       (resid 24 and name ca) (resid 24 and name c ) 1.0 -105.0   30.0 2
assign (resid 24 and name n ) (resid 24 and name ca)
       (resid 24 and name c ) (resid 25 and name n ) 1.0  120.0   65.0 2
assign (resid 25 and name c ) (resid 26 and name n )
       (resid 26 and name ca) (resid 26 and name c ) 1.0  185.0  130.0 2
assign (resid 26 and name n ) (resid 26 and name ca)
       (resid 26 and name c ) (resid 27 and name n ) 1.0    0.0   85.0 2
assign (resid 28 and name c ) (resid 29 and name n )
       (resid 29 and name ca) (resid 29 and name c ) 1.0  185.0  130.0 2
assign (resid 29 and name n ) (resid 29 and name ca)
       (resid 29 and name c ) (resid 30 and name n ) 1.0  165.0  130.0 2
assign (resid 29 and name c ) (resid 30 and name n )
       (resid 30 and name ca) (resid 30 and name c ) 1.0 -120.0   45.0 2
assign (resid 30 and name n ) (resid 30 and name ca)
       (resid 30 and name c ) (resid 31 and name n ) 1.0  145.0   20.0 2
assign (resid 30 and name c ) (resid 31 and name n )
       (resid 31 and name ca) (resid 31 and name c ) 1.0 -120.0   45.0 2
assign (resid 31 and name n ) (resid 31 and name ca)
       (resid 31 and name c ) (resid 32 and name n ) 1.0  165.0   20.0 2
assign (resid 31 and name c ) (resid 32 and name n )
       (resid 32 and name ca) (resid 32 and name c ) 1.0  175.0  120.0 2
assign (resid 32 and name n ) (resid 32 and name ca)
       (resid 32 and name c ) (resid 33 and name n ) 1.0  155.0   10.0 2
assign (resid 32 and name c ) (resid 33 and name n )
       (resid 33 and name ca) (resid 33 and name c ) 1.0  170.0  125.0 2
assign (resid 33 and name n ) (resid 33 and name ca)
       (resid 33 and name c ) (resid 34 and name n ) 1.0  165.0   10.0 2
assign (resid 33 and name c ) (resid 34 and name n )
       (resid 34 and name ca) (resid 34 and name c ) 1.0 -115.0   40.0 2
assign (resid 34 and name n ) (resid 34 and name ca)
       (resid 34 and name c ) (resid 35 and name n ) 1.0  115.0   50.0 2
assign (resid 34 and name c ) (resid 35 and name n )
       (resid 35 and name ca) (resid 35 and name c ) 1.0 -100.0   25.0 2
assign (resid 35 and name n ) (resid 35 and name ca)
       (resid 35 and name c ) (resid 36 and name n ) 1.0  130.0   55.0 2
assign (resid 37 and name c ) (resid 38 and name n )
       (resid 38 and name ca) (resid 38 and name c ) 1.0  165.0  130.0 2
assign (resid 38 and name n ) (resid 38 and name ca)
       (resid 38 and name c ) (resid 39 and name n ) 1.0  140.0   55.0 2
assign (resid 38 and name c ) (resid 39 and name n )
       (resid 39 and name ca) (resid 39 and name c ) 1.0   65.0   30.0 2
assign (resid 39 and name n ) (resid 39 and name ca)
       (resid 39 and name c ) (resid 40 and name n ) 1.0   60.0   45.0 2
assign (resid 40 and name c ) (resid 41 and name n )
       (resid 41 and name ca) (resid 41 and name c ) 1.0 -120.0   35.0 2
assign (resid 41 and name n ) (resid 41 and name ca)
       (resid 41 and name c ) (resid 42 and name n ) 1.0  185.0   20.0 2
assign (resid 41 and name c ) (resid 42 and name n )
       (resid 42 and name ca) (resid 42 and name c ) 1.0  -60.0   25.0 2
assign (resid 42 and name n ) (resid 42 and name ca)
       (resid 42 and name c ) (resid 43 and name n ) 1.0  -40.0   45.0 2
assign (resid 42 and name c ) (resid 43 and name n )
       (resid 43 and name ca) (resid 43 and name c ) 1.0 -100.0   35.0 2
assign (resid 43 and name n ) (resid 43 and name ca)
       (resid 43 and name c ) (resid 44 and name n ) 1.0  120.0   65.0 2
assign (resid 43 and name c ) (resid 44 and name n )
       (resid 44 and name ca) (resid 44 and name c ) 1.0  -55.0  120.0 2
assign (resid 44 and name n ) (resid 44 and name ca)
       (resid 44 and name c ) (resid 45 and name n ) 1.0  105.0   50.0 2
assign (resid 44 and name c ) (resid 45 and name n )
       (resid 45 and name ca) (resid 45 and name c ) 1.0 -120.0   35.0 2
assign (resid 45 and name n ) (resid 45 and name ca)
       (resid 45 and name c ) (resid 46 and name n ) 1.0  160.0   25.0 2
assign (resid 45 and name c ) (resid 46 and name n )
       (resid 46 and name ca) (resid 46 and name c ) 1.0 -105.0   60.0 2
assign (resid 46 and name n ) (resid 46 and name ca)
       (resid 46 and name c ) (resid 47 and name n ) 1.0  -35.0   60.0 2
assign (resid 46 and name c ) (resid 47 and name n )
       (resid 47 and name ca) (resid 47 and name c ) 1.0  165.0  120.0 2
assign (resid 47 and name n ) (resid 47 and name ca)
       (resid 47 and name c ) (resid 48 and name n ) 1.0  165.0   20.0 2
assign (resid 48 and name c ) (resid 49 and name n )
       (resid 49 and name ca) (resid 49 and name c ) 1.0   60.0  135.0 2
assign (resid 49 and name n ) (resid 49 and name ca)
       (resid 49 and name c ) (resid 50 and name n ) 1.0    5.0   90.0 2
assign (resid 49 and name c ) (resid 50 and name n )
       (resid 50 and name ca) (resid 50 and name c ) 1.0  180.0  145.0 2
assign (resid 50 and name n ) (resid 50 and name ca)
       (resid 50 and name c ) (resid 51 and name n ) 1.0    0.0   85.0 2
assign (resid 50 and name c ) (resid 51 and name n )
       (resid 51 and name ca) (resid 51 and name c ) 1.0  -60.0   25.0 2
assign (resid 51 and name n ) (resid 51 and name ca)
       (resid 51 and name c ) (resid 52 and name n ) 1.0  -70.0   25.0 2
assign (resid 51 and name c ) (resid 52 and name n )
       (resid 52 and name ca) (resid 52 and name c ) 1.0  -60.0   25.0 2
assign (resid 52 and name n ) (resid 52 and name ca)
       (resid 52 and name c ) (resid 53 and name n ) 1.0  -55.0   40.0 2
assign (resid 52 and name c ) (resid 53 and name n )
       (resid 53 and name ca) (resid 53 and name c ) 1.0   60.0  135.0 2
assign (resid 53 and name n ) (resid 53 and name ca)
       (resid 53 and name c ) (resid 54 and name n ) 1.0    5.0   90.0 2
assign (resid 53 and name c ) (resid 54 and name n )
       (resid 54 and name ca) (resid 54 and name c ) 1.0 -105.0   50.0 2
assign (resid 54 and name n ) (resid 54 and name ca)
       (resid 54 and name c ) (resid 55 and name n ) 1.0  -55.0   30.0 2
assign (resid 54 and name c ) (resid 55 and name n )
       (resid 55 and name ca) (resid 55 and name c ) 1.0 -120.0   45.0 2
assign (resid 55 and name n ) (resid 55 and name ca)
       (resid 55 and name c ) (resid 56 and name n ) 1.0  -15.0   70.0 2
!Chi1 Angle Restraints
assign (resid  4 and name n ) (resid  4 and name ca)
       (resid  4 and name cb) (resid  4 and name cg) 1.0   60.0   15.0 2
assign (resid  5 and name n ) (resid  5 and name ca)
       (resid  5 and name cb) (resid  5 and name sg) 1.0  240.0   75.0 2
assign (resid  7 and name n ) (resid  7 and name ca)
       (resid  7 and name cb) (resid  7 and name cg) 1.0  185.0  150.0 2
assign (resid 10 and name n ) (resid 10 and name ca)
       (resid 10 and name cb) (resid 10 and name cg) 1.0  150.0   95.0 2
assign (resid 11 and name n ) (resid 11 and name ca)
       (resid 11 and name cb) (resid 11 and name og1) 1.0  -100.0   15.0 2
assign (resid 14 and name n ) (resid 14 and name ca)
       (resid 14 and name cb) (resid 14 and name sg) 1.0  -70.0   25.0 2
assign (resid 15 and name n ) (resid 15 and name ca)
       (resid 15 and name cb) (resid 15 and name cg) 1.0  -85.0  110.0 2
assign (resid 17 and name n ) (resid 17 and name ca)
       (resid 17 and name cb) (resid 17 and name cg) 1.0 -165.0  170.0 2
assign (resid 18 and name n ) (resid 18 and name ca)
       (resid 18 and name cb) (resid 18 and name cg1) 1.0  -65.0   40.0 2
assign (resid 19 and name n ) (resid 19 and name ca)
       (resid 19 and name cb) (resid 19 and name cg1) 1.0  -75.0   30.0 2
assign (resid 20 and name n ) (resid 20 and name ca)
       (resid 20 and name cb) (resid 20 and name cg) 1.0  -70.0   25.0 2
assign (resid 21 and name n ) (resid 21 and name ca)
       (resid 21 and name cb) (resid 21 and name cg) 1.0  -85.0   90.0 2
assign (resid 22 and name n ) (resid 22 and name ca)
       (resid 22 and name cb) (resid 22 and name cg) 1.0   65.0   20.0 2
assign (resid 23 and name n ) (resid 23 and name ca)
       (resid 23 and name cb) (resid 23 and name cg) 1.0  185.0   30.0 2
assign (resid 24 and name n ) (resid 24 and name ca)
       (resid 24 and name cb) (resid 24 and name cg) 1.0  180.0   15.0 2
assign (resid 30 and name n ) (resid 30 and name ca)
       (resid 30 and name cb) (resid 30 and name sg) 1.0  -70.0   25.0 2
assign (resid 31 and name n ) (resid 31 and name ca)
       (resid 31 and name cb) (resid 31 and name cg) 1.0  -75.0   30.0 2
assign (resid 32 and name n ) (resid 32 and name ca)
       (resid 32 and name cb) (resid 32 and name og1) 1.0   45.0   30.0 2
assign (resid 33 and name n ) (resid 33 and name ca)
       (resid 33 and name cb) (resid 33 and name cg) 1.0   65.0   20.0 2
assign (resid 34 and name n ) (resid 34 and name ca)
       (resid 34 and name cb) (resid 34 and name cg1) 1.0  175.0   40.0 2
assign (resid 35 and name n ) (resid 35 and name ca)
       (resid 35 and name cb) (resid 35 and name cg) 1.0  160.0   15.0 2
assign (resid 38 and name n ) (resid 38 and name ca)
       (resid 38 and name cb) (resid 38 and name sg) 1.0   60.0   45.0 2
assign (resid 41 and name n ) (resid 41 and name ca)
       (resid 41 and name cb) (resid 41 and name cg) 1.0  -70.0   25.0 2
assign (resid 42 and name n ) (resid 42 and name ca)
       (resid 42 and name cb) (resid 42 and name cg) 1.0  200.0  125.0 2
assign (resid 43 and name n ) (resid 43 and name ca)
       (resid 43 and name cb) (resid 43 and name cg) 1.0  190.0   25.0 2
assign (resid 44 and name n ) (resid 44 and name ca)
       (resid 44 and name cb) (resid 44 and name cg) 1.0  240.0   85.0 2
assign (resid 45 and name n ) (resid 45 and name ca)
       (resid 45 and name cb) (resid 45 and name cg) 1.0  -65.0   30.0 2
assign (resid 46 and name n ) (resid 46 and name ca)
       (resid 46 and name cb) (resid 46 and name cg) 1.0  240.0   85.0 2
assign (resid 47 and name n ) (resid 47 and name ca)
       (resid 47 and name cb) (resid 47 and name og) 1.0   70.0    5.0 2
assign (resid 51 and name n ) (resid 51 and name ca)
       (resid 51 and name cb) (resid 51 and name sg) 1.0  165.0   20.0 2
assign (resid 52 and name n ) (resid 52 and name ca)
       (resid 52 and name cb) (resid 52 and name cg) 1.0  240.0   75.0 2
assign (resid 54 and name n ) (resid 54 and name ca)
       (resid 54 and name cb) (resid 54 and name og1) 1.0  -70.0   35.0 2
assign (resid 55 and name n ) (resid 55 and name ca)
       (resid 55 and name cb) (resid 55 and name sg) 1.0  240.0   65.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ARG   1          1H        ARG   1  14.413  -5.431   4.060
    2   2H    ARG   1          2H        ARG   1  14.742  -4.653   5.533
    3   3H    ARG   1          3H        ARG   1  14.998  -3.839   4.065
    4    HA   ARG   1           HA       ARG   1  12.851  -3.364   5.457
    5   1HB   ARG   1          1HB       ARG   1  11.914  -2.643   3.342
    6   2HB   ARG   1          2HB       ARG   1  13.665  -2.526   3.206
    7   1HG   ARG   1          1HG       ARG   1  13.783  -4.579   1.961
    8   2HG   ARG   1          2HG       ARG   1  12.094  -4.951   2.302
    9   1HD   ARG   1          1HD       ARG   1  11.857  -4.034   0.173
   10   2HD   ARG   1          2HD       ARG   1  11.762  -2.541   1.127
   11    HE   ARG   1           HE       ARG   1  13.825  -1.966   0.123
   12   1HH1  ARG   1          1HH2      ARG   1  13.249  -5.304  -0.281
   13   2HH1  ARG   1          2HH2      ARG   1  14.893  -5.694  -0.662
   14   1HH2  ARG   1          1HH1      ARG   1  16.071  -2.488  -0.063
   15   2HH2  ARG   1          2HH1      ARG   1  16.489  -4.100  -0.538
   16    HA   PRO   2           HA       PRO   2   9.996  -6.698   5.743
   17   1HB   PRO   2          1HB       PRO   2   7.611  -5.518   5.102
   18   2HB   PRO   2          2HB       PRO   2   8.429  -5.285   6.658
   19   1HG   PRO   2          1HG       PRO   2   8.416  -3.547   4.219
   20   2HG   PRO   2          2HG       PRO   2   8.254  -3.085   5.923
   21   1HD   PRO   2          1HD       PRO   2  10.575  -2.822   4.576
   22   2HD   PRO   2          2HD       PRO   2  10.537  -3.249   6.302
   23    H    ASP   3           H        ASP   3   8.435  -8.024   4.482
   24    HA   ASP   3           HA       ASP   3   9.115  -7.933   1.588
   25   1HB   ASP   3          1HB       ASP   3   9.386  -9.937   3.233
   26   2HB   ASP   3          2HB       ASP   3   7.639 -10.113   3.062
   27    H    PHE   4           H        PHE   4   6.455  -7.352   3.783
   28    HA   PHE   4           HA       PHE   4   4.311  -7.952   1.944
   29   1HB   PHE   4          1HB       PHE   4   2.957  -6.566   3.479
   30   2HB   PHE   4          2HB       PHE   4   3.974  -7.701   4.355
   31    HD1  PHE   4           1HD      PHE   4   3.857  -4.119   3.200
   32    HD2  PHE   4           2HD      PHE   4   5.437  -6.965   6.017
   33    HE1  PHE   4           1HE      PHE   4   4.822  -2.280   4.537
   34    HE2  PHE   4           2HE      PHE   4   6.402  -5.106   7.341
   35    HZ   PHE   4           HZ       PHE   4   6.086  -2.765   6.596
   36    H    CYS   5           H        CYS   5   6.556  -5.327   2.141
   37    HA   CYS   5           HA       CYS   5   4.923  -3.496   0.502
   38   1HB   CYS   5          1HB       CYS   5   7.540  -3.536   1.926
   39   2HB   CYS   5          2HB       CYS   5   7.403  -2.436   0.553
   40    H    LEU   6           H        LEU   6   7.282  -6.013   0.082
   41    HA   LEU   6           HA       LEU   6   8.196  -5.231  -2.570
   42   1HB   LEU   6          1HB       LEU   6   8.152  -7.955  -1.227
   43   2HB   LEU   6          2HB       LEU   6   9.242  -7.427  -2.508
   44    HG   LEU   6           HG       LEU   6   9.107  -6.274   0.296
   45   1HD1  LEU   6          1HD1      LEU   6  10.225  -8.634  -0.406
   46   2HD1  LEU   6          2HD1      LEU   6  10.904  -7.587   0.839
   47   3HD1  LEU   6          3HD1      LEU   6  11.558  -7.547  -0.797
   48   1HD2  LEU   6          1HD2      LEU   6  11.472  -5.518  -1.042
   49   2HD2  LEU   6          2HD2      LEU   6  10.116  -4.474  -0.620
   50   3HD2  LEU   6          3HD2      LEU   6  10.170  -5.254  -2.199
   51    H    GLU   7           H        GLU   7   5.474  -6.938  -1.235
   52    HA   GLU   7           HA       GLU   7   4.668  -8.252  -3.723
   53   1HB   GLU   7          1HB       GLU   7   4.121  -8.382  -0.966
   54   2HB   GLU   7          2HB       GLU   7   2.611  -7.849  -1.704
   55   1HG   GLU   7          1HG       GLU   7   3.501  -9.845  -3.421
   56   2HG   GLU   7          2HG       GLU   7   3.925 -10.462  -1.824
   57    HA   PRO   8           HA       PRO   8   2.338  -4.919  -5.390
   58   1HB   PRO   8          1HB       PRO   8   0.165  -6.210  -6.448
   59   2HB   PRO   8          2HB       PRO   8   1.787  -6.296  -7.164
   60   1HG   PRO   8          1HG       PRO   8   0.343  -8.264  -5.457
   61   2HG   PRO   8          2HG       PRO   8   1.423  -8.541  -6.831
   62   1HD   PRO   8          1HD       PRO   8   2.149  -8.813  -4.188
   63   2HD   PRO   8          2HD       PRO   8   3.289  -8.488  -5.512
   64    HA   PRO   9           HA       PRO   9  -0.777  -3.676  -2.556
   65   1HB   PRO   9          1HB       PRO   9  -2.528  -2.274  -4.138
   66   2HB   PRO   9          2HB       PRO   9  -0.933  -1.657  -3.665
   67   1HG   PRO   9          1HG       PRO   9  -1.807  -2.936  -6.217
   68   2HG   PRO   9          2HG       PRO   9  -0.723  -1.559  -5.960
   69   1HD   PRO   9          1HD       PRO   9   0.149  -4.088  -6.514
   70   2HD   PRO   9          2HD       PRO   9   1.092  -2.916  -5.569
   71    H    TYR  10           H        TYR  10  -3.261  -3.790  -2.184
   72    HA   TYR  10           HA       TYR  10  -4.533  -6.019  -3.731
   73   1HB   TYR  10          1HB       TYR  10  -3.265  -6.814  -1.682
   74   2HB   TYR  10          2HB       TYR  10  -4.374  -5.850  -0.707
   75    HD1  TYR  10           1HD      TYR  10  -6.159  -7.009   0.214
   76    HD2  TYR  10           2HD      TYR  10  -4.601  -8.250  -3.591
   77    HE1  TYR  10           1HE      TYR  10  -7.832  -8.839   0.124
   78    HE2  TYR  10           2HE      TYR  10  -6.273 -10.078  -3.682
   79    HH   TYR  10           HH       TYR  10  -8.828 -10.349  -1.271
   80    H    THR  11           H        THR  11  -6.032  -4.511  -4.588
   81    HA   THR  11           HA       THR  11  -7.477  -2.528  -3.203
   82    HB   THR  11           HB       THR  11  -7.978  -4.354  -5.547
   83    HG1  THR  11           1HG      THR  11  -8.268  -1.671  -5.846
   84   1HG2  THR  11          1HG2      THR  11 -10.032  -2.651  -5.838
   85   2HG2  THR  11          2HG2      THR  11  -9.998  -2.726  -4.076
   86   3HG2  THR  11          3HG2      THR  11 -10.215  -4.203  -5.017
   87    H    GLY  12           H        GLY  12  -7.630  -5.996  -3.058
   88   1HA   GLY  12          1HA       GLY  12  -8.860  -7.423  -1.650
   89   2HA   GLY  12          2HA       GLY  12  -9.265  -5.997  -0.695
   90    HA   PRO  13           HA       PRO  13 -13.071  -7.524  -2.860
   91   1HB   PRO  13          1HB       PRO  13 -14.602  -7.710  -0.589
   92   2HB   PRO  13          2HB       PRO  13 -13.588  -9.037  -1.188
   93   1HG   PRO  13          1HG       PRO  13 -13.079  -7.077   1.001
   94   2HG   PRO  13          2HG       PRO  13 -12.699  -8.805   0.923
   95   1HD   PRO  13          1HD       PRO  13 -10.871  -6.805   0.507
   96   2HD   PRO  13          2HD       PRO  13 -10.731  -8.437  -0.185
   97    H    CYS  14           H        CYS  14 -15.460  -6.483  -1.617
   98    HA   CYS  14           HA       CYS  14 -16.693  -4.479  -1.452
   99   1HB   CYS  14          1HB       CYS  14 -13.987  -3.276  -0.783
  100   2HB   CYS  14          2HB       CYS  14 -15.573  -2.693  -0.277
  101    H    LYS  15           H        LYS  15 -16.182  -1.910  -2.227
  102    HA   LYS  15           HA       LYS  15 -14.929  -2.042  -4.932
  103   1HB   LYS  15          1HB       LYS  15 -17.179  -0.634  -5.485
  104   2HB   LYS  15          2HB       LYS  15 -17.082  -2.381  -5.675
  105   1HG   LYS  15          1HG       LYS  15 -17.960  -2.631  -3.337
  106   2HG   LYS  15          2HG       LYS  15 -18.173  -0.881  -3.273
  107   1HD   LYS  15          1HD       LYS  15 -20.294  -1.834  -3.904
  108   2HD   LYS  15          2HD       LYS  15 -19.614  -1.084  -5.348
  109   1HE   LYS  15          1HE       LYS  15 -18.679  -3.819  -5.125
  110   2HE   LYS  15          2HE       LYS  15 -20.453  -3.768  -5.077
  111   1HZ   LYS  15          1HZ       LYS  15 -19.961  -3.693  -7.341
  112   2HZ   LYS  15          2HZ       LYS  15 -18.606  -2.689  -7.124
  113   3HZ   LYS  15          3HZ       LYS  15 -20.174  -2.056  -6.954
  114    H    ALA  16           H        ALA  16 -14.533  -0.653  -2.185
  115    HA   ALA  16           HA       ALA  16 -15.061   2.116  -2.339
  116   1HB   ALA  16          1HB       ALA  16 -13.456   2.252  -0.609
  117   2HB   ALA  16          2HB       ALA  16 -12.483   0.950  -1.292
  118   3HB   ALA  16          3HB       ALA  16 -14.018   0.584  -0.505
  119    H    ARG  17           H        ARG  17 -13.353   3.837  -2.786
  120    HA   ARG  17           HA       ARG  17 -11.437   3.076  -4.944
  121   1HB   ARG  17          1HB       ARG  17 -13.908   4.709  -5.098
  122   2HB   ARG  17          2HB       ARG  17 -12.497   5.411  -5.890
  123   1HG   ARG  17          1HG       ARG  17 -12.196   3.410  -7.237
  124   2HG   ARG  17          2HG       ARG  17 -13.474   2.575  -6.353
  125   1HD   ARG  17          1HD       ARG  17 -14.894   4.707  -7.148
  126   2HD   ARG  17          2HD       ARG  17 -13.689   4.696  -8.451
  127    HE   ARG  17           HE       ARG  17 -15.816   2.821  -8.217
  128   1HH1  ARG  17          1HH2      ARG  17 -14.212   2.919 -10.670
  129   2HH1  ARG  17          2HH2      ARG  17 -13.329   1.429 -10.629
  130   1HH2  ARG  17          1HH1      ARG  17 -13.896   0.882  -7.250
  131   2HH2  ARG  17          2HH1      ARG  17 -13.147   0.276  -8.689
  132    H    ILE  18           H        ILE  18 -10.174   3.520  -2.795
  133    HA   ILE  18           HA       ILE  18  -9.731   6.454  -2.414
  134    HB   ILE  18           HB       ILE  18  -9.174   3.987  -0.748
  135   1HG1  ILE  18          1HG1      ILE  18 -10.645   6.161   0.485
  136   2HG1  ILE  18          2HG1      ILE  18 -11.417   5.662  -1.021
  137   1HG2  ILE  18          1HG2      ILE  18  -8.101   5.340   0.877
  138   2HG2  ILE  18          2HG2      ILE  18  -8.634   6.833   0.103
  139   3HG2  ILE  18          3HG2      ILE  18  -7.384   5.845  -0.654
  140   1HD1  ILE  18          1HD1      ILE  18 -11.770   3.482  -0.265
  141   2HD1  ILE  18          2HD1      ILE  18 -11.997   4.409   1.219
  142   3HD1  ILE  18          3HD1      ILE  18 -10.470   3.578   0.922
  143    H    ILE  19           H        ILE  19  -7.599   7.273  -2.549
  144    HA   ILE  19           HA       ILE  19  -5.734   5.623  -4.166
  145    HB   ILE  19           HB       ILE  19  -5.814   8.549  -3.357
  146   1HG1  ILE  19          1HG1      ILE  19  -7.594   8.078  -4.893
  147   2HG1  ILE  19          2HG1      ILE  19  -6.295   8.781  -5.858
  148   1HG2  ILE  19          1HG2      ILE  19  -3.689   8.692  -4.078
  149   2HG2  ILE  19          2HG2      ILE  19  -4.193   8.077  -5.651
  150   3HG2  ILE  19          3HG2      ILE  19  -3.665   6.957  -4.395
  151   1HD1  ILE  19          1HD1      ILE  19  -5.529   6.439  -6.387
  152   2HD1  ILE  19          2HD1      ILE  19  -7.124   6.830  -7.030
  153   3HD1  ILE  19          3HD1      ILE  19  -6.978   5.841  -5.577
  154    H    ARG  20           H        ARG  20  -5.228   4.251  -2.215
  155    HA   ARG  20           HA       ARG  20  -3.773   5.517   0.002
  156   1HB   ARG  20          1HB       ARG  20  -4.457   2.691  -0.833
  157   2HB   ARG  20          2HB       ARG  20  -3.497   3.040   0.605
  158   1HG   ARG  20          1HG       ARG  20  -6.015   4.591   0.307
  159   2HG   ARG  20          2HG       ARG  20  -6.205   2.868   0.635
  160   1HD   ARG  20          1HD       ARG  20  -5.085   3.020   2.708
  161   2HD   ARG  20          2HD       ARG  20  -4.287   4.543   2.266
  162    HE   ARG  20           HE       ARG  20  -6.730   5.466   2.225
  163   1HH1  ARG  20          1HH2      ARG  20  -5.116   3.833   4.679
  164   2HH1  ARG  20          2HH2      ARG  20  -6.495   3.668   5.714
  165   1HH2  ARG  20          1HH1      ARG  20  -8.743   4.845   3.349
  166   2HH2  ARG  20          2HH1      ARG  20  -8.550   4.241   4.961
  167    H    TYR  21           H        TYR  21  -1.590   4.106   0.521
  168    HA   TYR  21           HA       TYR  21   0.065   4.293  -1.977
  169   1HB   TYR  21          1HB       TYR  21   0.534   4.994   0.921
  170   2HB   TYR  21          2HB       TYR  21   1.884   4.773  -0.191
  171    HD1  TYR  21           1HD      TYR  21  -1.111   6.807   0.561
  172    HD2  TYR  21           2HD      TYR  21   2.348   6.364  -1.946
  173    HE1  TYR  21           1HE      TYR  21  -1.430   9.116  -0.284
  174    HE2  TYR  21           2HE      TYR  21   2.027   8.674  -2.794
  175    HH   TYR  21           HH       TYR  21   0.198  10.933  -1.322
  176    H    PHE  22           H        PHE  22   1.531   2.639  -2.383
  177    HA   PHE  22           HA       PHE  22   1.809   0.444  -0.382
  178   1HB   PHE  22          1HB       PHE  22   1.087  -1.197  -1.910
  179   2HB   PHE  22          2HB       PHE  22  -0.022   0.129  -2.217
  180    HD1  PHE  22           1HD      PHE  22   0.231   1.555  -4.231
  181    HD2  PHE  22           2HD      PHE  22   2.771  -1.835  -3.520
  182    HE1  PHE  22           1HE      PHE  22   0.968   1.614  -6.599
  183    HE2  PHE  22           2HE      PHE  22   3.514  -1.776  -5.885
  184    HZ   PHE  22           HZ       PHE  22   2.617  -0.053  -7.424
  185    H    TYR  23           H        TYR  23   3.733  -0.949  -0.967
  186    HA   TYR  23           HA       TYR  23   5.885   0.784  -2.062
  187   1HB   TYR  23          1HB       TYR  23   6.014  -0.424   0.142
  188   2HB   TYR  23          2HB       TYR  23   6.036  -1.945  -0.757
  189    HD1  TYR  23           1HD      TYR  23   8.026  -2.694  -1.862
  190    HD2  TYR  23           2HD      TYR  23   7.805   1.285  -0.260
  191    HE1  TYR  23           1HE      TYR  23  10.448  -2.392  -2.291
  192    HE2  TYR  23           2HE      TYR  23  10.227   1.594  -0.681
  193    HH   TYR  23           HH       TYR  23  12.326  -0.633  -1.037
  194    H    ASN  24           H        ASN  24   6.365   0.613  -4.198
  195    HA   ASN  24           HA       ASN  24   5.774  -1.881  -5.694
  196   1HB   ASN  24          1HB       ASN  24   5.208   0.369  -6.588
  197   2HB   ASN  24          2HB       ASN  24   6.910   0.817  -6.520
  198   1HD2  ASN  24          1HD2      ASN  24   5.183   0.590  -8.956
  199   2HD2  ASN  24          2HD2      ASN  24   5.935  -0.564  -9.947
  200    H    ALA  25           H        ALA  25   7.446  -3.291  -4.823
  201    HA   ALA  25           HA       ALA  25  10.109  -2.765  -4.299
  202   1HB   ALA  25          1HB       ALA  25   8.561  -5.064  -5.397
  203   2HB   ALA  25          2HB       ALA  25   9.507  -4.954  -3.912
  204   3HB   ALA  25          3HB       ALA  25  10.320  -5.181  -5.460
  205    H    LYS  26           H        LYS  26   8.569  -2.922  -7.459
  206    HA   LYS  26           HA       LYS  26  11.049  -2.966  -8.983
  207   1HB   LYS  26          1HB       LYS  26   8.200  -3.076  -9.385
  208   2HB   LYS  26          2HB       LYS  26   8.889  -1.869 -10.472
  209   1HG   LYS  26          1HG       LYS  26  10.269  -3.434 -11.536
  210   2HG   LYS  26          2HG       LYS  26  10.212  -4.555 -10.175
  211   1HD   LYS  26          1HD       LYS  26   7.714  -3.878 -11.721
  212   2HD   LYS  26          2HD       LYS  26   8.820  -5.124 -12.300
  213   1HE   LYS  26          1HE       LYS  26   7.749  -6.556 -10.891
  214   2HE   LYS  26          2HE       LYS  26   8.483  -5.657  -9.548
  215   1HZ   LYS  26          1HZ       LYS  26   6.533  -3.997 -10.249
  216   2HZ   LYS  26          2HZ       LYS  26   6.315  -5.220  -9.091
  217   3HZ   LYS  26          3HZ       LYS  26   5.802  -5.462 -10.692
  218    H    ALA  27           H        ALA  27   9.079  -0.501  -7.475
  219    HA   ALA  27           HA       ALA  27  10.384   1.686  -8.999
  220   1HB   ALA  27          1HB       ALA  27   8.521   2.035  -6.667
  221   2HB   ALA  27          2HB       ALA  27   7.886   1.387  -8.180
  222   3HB   ALA  27          3HB       ALA  27   8.636   2.983  -8.150
  223    H    GLY  28           H        GLY  28  10.783  -0.041  -6.024
  224   1HA   GLY  28          1HA       GLY  28  12.590   0.176  -4.493
  225   2HA   GLY  28          2HA       GLY  28  13.069   1.662  -5.315
  226    H    LEU  29           H        LEU  29   9.888   2.102  -4.882
  227    HA   LEU  29           HA       LEU  29  10.011   2.950  -2.041
  228   1HB   LEU  29          1HB       LEU  29   9.312   5.237  -2.745
  229   2HB   LEU  29          2HB       LEU  29  10.888   4.805  -3.404
  230    HG   LEU  29           HG       LEU  29   8.688   3.968  -5.140
  231   1HD1  LEU  29          1HD1      LEU  29   8.099   6.253  -5.887
  232   2HD1  LEU  29          2HD1      LEU  29   9.065   6.926  -4.574
  233   3HD1  LEU  29          3HD1      LEU  29   7.618   5.984  -4.212
  234   1HD2  LEU  29          1HD2      LEU  29  10.830   5.970  -5.804
  235   2HD2  LEU  29          2HD2      LEU  29  10.158   4.688  -6.810
  236   3HD2  LEU  29          3HD2      LEU  29  11.276   4.292  -5.506
  237    H    CYS  30           H        CYS  30   7.571   4.635  -2.693
  238    HA   CYS  30           HA       CYS  30   5.647   2.361  -2.991
  239   1HB   CYS  30          1HB       CYS  30   5.914   4.652  -1.131
  240   2HB   CYS  30          2HB       CYS  30   4.272   4.287  -1.657
  241    H    GLN  31           H        GLN  31   3.525   2.958  -3.859
  242    HA   GLN  31           HA       GLN  31   3.436   5.411  -5.543
  243   1HB   GLN  31          1HB       GLN  31   3.119   2.534  -6.472
  244   2HB   GLN  31          2HB       GLN  31   2.720   3.938  -7.462
  245   1HG   GLN  31          1HG       GLN  31   5.271   4.528  -6.563
  246   2HG   GLN  31          2HG       GLN  31   5.344   2.784  -6.822
  247   1HE2  GLN  31          1HE2      GLN  31   6.895   3.896  -8.616
  248   2HE2  GLN  31          2HE2      GLN  31   6.154   4.142 -10.123
  249    H    THR  32           H        THR  32   1.115   5.688  -6.390
  250    HA   THR  32           HA       THR  32  -0.763   5.055  -4.223
  251    HB   THR  32           HB       THR  32  -2.253   6.508  -5.569
  252    HG1  THR  32           1HG      THR  32  -0.960   7.418  -7.473
  253   1HG2  THR  32          1HG2      THR  32   0.511   7.254  -4.814
  254   2HG2  THR  32          2HG2      THR  32  -1.024   7.971  -4.326
  255   3HG2  THR  32          3HG2      THR  32  -0.314   8.387  -5.885
  256    H    PHE  33           H        PHE  33  -2.534   3.684  -4.373
  257    HA   PHE  33           HA       PHE  33  -3.031   2.246  -6.925
  258   1HB   PHE  33          1HB       PHE  33  -2.545   0.136  -6.025
  259   2HB   PHE  33          2HB       PHE  33  -1.290   1.140  -5.307
  260    HD1  PHE  33           1HD      PHE  33  -4.352  -0.774  -4.688
  261    HD2  PHE  33           2HD      PHE  33  -1.418   1.830  -2.935
  262    HE1  PHE  33           1HE      PHE  33  -5.128  -1.423  -2.423
  263    HE2  PHE  33           2HE      PHE  33  -2.196   1.190  -0.676
  264    HZ   PHE  33           HZ       PHE  33  -4.050  -0.441  -0.415
  265    H    VAL  34           H        VAL  34  -5.079   0.797  -6.592
  266    HA   VAL  34           HA       VAL  34  -7.118   2.473  -5.290
  267    HB   VAL  34           HB       VAL  34  -7.283  -0.126  -6.847
  268   1HG1  VAL  34          1HG1      VAL  34  -9.286   1.723  -5.645
  269   2HG1  VAL  34          2HG1      VAL  34  -9.392  -0.014  -5.939
  270   3HG1  VAL  34          3HG1      VAL  34  -9.638   1.121  -7.266
  271   1HG2  VAL  34          1HG2      VAL  34  -7.586   2.767  -7.721
  272   2HG2  VAL  34          2HG2      VAL  34  -7.868   1.360  -8.745
  273   3HG2  VAL  34          3HG2      VAL  34  -6.247   1.699  -8.139
  274    H    TYR  35           H        TYR  35  -7.753   2.142  -3.230
  275    HA   TYR  35           HA       TYR  35  -7.142  -0.450  -1.883
  276   1HB   TYR  35          1HB       TYR  35  -6.330   1.630  -0.894
  277   2HB   TYR  35          2HB       TYR  35  -7.947   2.326  -0.948
  278    HD1  TYR  35           1HD      TYR  35  -7.193  -1.195  -0.034
  279    HD2  TYR  35           2HD      TYR  35  -8.236   2.722   1.392
  280    HE1  TYR  35           1HE      TYR  35  -7.674  -2.136   2.212
  281    HE2  TYR  35           2HE      TYR  35  -8.717   1.780   3.632
  282    HH   TYR  35           HH       TYR  35  -9.059  -0.136   4.782
  283    H    GLY  36           H        GLY  36  -8.845  -1.634  -0.827
  284   1HA   GLY  36          1HA       GLY  36 -11.555  -1.062  -1.901
  285   2HA   GLY  36          2HA       GLY  36 -11.034  -2.591  -1.199
  286    H    ALA  37           H        ALA  37  -9.846  -0.365   0.891
  287    HA   ALA  37           HA       ALA  37 -10.631   0.583   2.922
  288   1HB   ALA  37          1HB       ALA  37 -12.846   1.342   2.940
  289   2HB   ALA  37          2HB       ALA  37 -13.434  -0.063   2.051
  290   3HB   ALA  37          3HB       ALA  37 -12.526   1.195   1.212
  291    H    CYS  38           H        CYS  38 -11.079  -2.605   1.935
  292    HA   CYS  38           HA       CYS  38 -11.682  -3.408   4.751
  293   1HB   CYS  38          1HB       CYS  38 -13.254  -5.109   3.825
  294   2HB   CYS  38          2HB       CYS  38 -13.763  -3.461   3.455
  295    H    ARG  39           H        ARG  39 -10.796  -5.480   5.320
  296    HA   ARG  39           HA       ARG  39  -9.072  -7.099   5.281
  297   1HB   ARG  39          1HB       ARG  39 -10.477  -7.115   2.635
  298   2HB   ARG  39          2HB       ARG  39  -9.061  -8.147   2.836
  299   1HG   ARG  39          1HG       ARG  39 -10.280  -9.628   4.019
  300   2HG   ARG  39          2HG       ARG  39 -10.740  -8.368   5.165
  301   1HD   ARG  39          1HD       ARG  39 -12.413  -7.662   3.226
  302   2HD   ARG  39          2HD       ARG  39 -12.206  -9.356   2.737
  303    HE   ARG  39           HE       ARG  39 -13.374  -8.406   5.297
  304   1HH1  ARG  39          1HH2      ARG  39 -14.675 -10.422   3.471
  305   2HH1  ARG  39          2HH2      ARG  39 -14.360 -11.909   4.303
  306   1HH2  ARG  39          1HH1      ARG  39 -11.888 -10.559   6.329
  307   2HH2  ARG  39          2HH1      ARG  39 -12.781 -11.987   5.921
  308    H    ALA  40           H        ALA  40  -8.105  -4.434   4.953
  309    HA   ALA  40           HA       ALA  40  -6.349  -4.170   2.671
  310   1HB   ALA  40          1HB       ALA  40  -5.854  -2.858   5.323
  311   2HB   ALA  40          2HB       ALA  40  -7.350  -2.494   4.465
  312   3HB   ALA  40          3HB       ALA  40  -5.795  -2.158   3.705
  313    H    LYS  41           H        LYS  41  -4.066  -4.497   2.595
  314    HA   LYS  41           HA       LYS  41  -3.033  -6.485   4.569
  315   1HB   LYS  41          1HB       LYS  41  -2.068  -5.587   1.830
  316   2HB   LYS  41          2HB       LYS  41  -1.372  -6.907   2.770
  317   1HG   LYS  41          1HG       LYS  41  -3.616  -8.028   2.748
  318   2HG   LYS  41          2HG       LYS  41  -4.200  -6.752   1.679
  319   1HD   LYS  41          1HD       LYS  41  -3.544  -8.307   0.096
  320   2HD   LYS  41          2HD       LYS  41  -2.023  -7.435   0.289
  321   1HE   LYS  41          1HE       LYS  41  -1.001  -9.263   1.189
  322   2HE   LYS  41          2HE       LYS  41  -2.367  -9.577   2.277
  323   1HZ   LYS  41          1HZ       LYS  41  -2.077 -11.303   0.536
  324   2HZ   LYS  41          2HZ       LYS  41  -2.367 -10.123  -0.652
  325   3HZ   LYS  41          3HZ       LYS  41  -3.586 -10.536   0.457
  326    H    ARG  42           H        ARG  42  -0.298  -6.035   4.241
  327    HA   ARG  42           HA       ARG  42   0.083  -3.618   5.873
  328   1HB   ARG  42          1HB       ARG  42   2.230  -5.415   4.741
  329   2HB   ARG  42          2HB       ARG  42   2.227  -4.541   6.271
  330   1HG   ARG  42          1HG       ARG  42   0.196  -6.020   6.888
  331   2HG   ARG  42          2HG       ARG  42   0.685  -7.030   5.528
  332   1HD   ARG  42          1HD       ARG  42   3.070  -6.869   6.696
  333   2HD   ARG  42          2HD       ARG  42   2.086  -6.548   8.136
  334    HE   ARG  42           HE       ARG  42   1.747  -8.964   6.384
  335   1HH1  ARG  42          1HH2      ARG  42   0.011  -7.523   8.746
  336   2HH1  ARG  42          2HH2      ARG  42   0.143  -8.789   9.920
  337   1HH2  ARG  42          1HH1      ARG  42   2.594 -10.514   8.175
  338   2HH2  ARG  42          2HH1      ARG  42   1.608 -10.481   9.599
  339    H    ASN  43           H        ASN  43   0.137  -4.375   2.537
  340    HA   ASN  43           HA       ASN  43   2.049  -2.201   1.867
  341   1HB   ASN  43          1HB       ASN  43   1.678  -4.648   0.839
  342   2HB   ASN  43          2HB       ASN  43   0.514  -3.776  -0.158
  343   1HD2  ASN  43          1HD2      ASN  43   3.234  -4.951  -0.878
  344   2HD2  ASN  43          2HD2      ASN  43   4.098  -3.656  -1.551
  345    H    ASN  44           H        ASN  44  -0.081  -1.068   3.098
  346    HA   ASN  44           HA       ASN  44  -1.428   0.409   0.904
  347   1HB   ASN  44          1HB       ASN  44  -2.936  -1.431   1.267
  348   2HB   ASN  44          2HB       ASN  44  -2.771  -1.304   3.017
  349   1HD2  ASN  44          1HD2      ASN  44  -5.345  -1.245   2.143
  350   2HD2  ASN  44          2HD2      ASN  44  -5.989   0.337   2.192
  351    H    PHE  45           H        PHE  45  -0.047   2.123   1.839
  352    HA   PHE  45           HA       PHE  45  -0.710   2.971   4.616
  353   1HB   PHE  45          1HB       PHE  45   1.310   4.160   2.698
  354   2HB   PHE  45          2HB       PHE  45   1.325   4.212   4.462
  355    HD1  PHE  45           1HD      PHE  45   1.673   2.051   5.756
  356    HD2  PHE  45           2HD      PHE  45   2.256   2.328   1.507
  357    HE1  PHE  45           1HE      PHE  45   2.962  -0.072   5.793
  358    HE2  PHE  45           2HE      PHE  45   3.547   0.209   1.544
  359    HZ   PHE  45           HZ       PHE  45   3.895  -1.001   3.685
  360    H    LYS  46           H        LYS  46  -1.398   5.177   5.018
  361    HA   LYS  46           HA       LYS  46  -3.228   6.222   2.980
  362   1HB   LYS  46          1HB       LYS  46  -3.889   6.181   5.299
  363   2HB   LYS  46          2HB       LYS  46  -2.423   7.030   5.788
  364   1HG   LYS  46          1HG       LYS  46  -4.388   8.549   5.710
  365   2HG   LYS  46          2HG       LYS  46  -3.146   9.026   4.553
  366   1HD   LYS  46          1HD       LYS  46  -4.505   8.633   2.784
  367   2HD   LYS  46          2HD       LYS  46  -5.058   7.095   3.449
  368   1HE   LYS  46          1HE       LYS  46  -6.769   8.143   4.727
  369   2HE   LYS  46          2HE       LYS  46  -6.016   9.743   4.573
  370   1HZ   LYS  46          1HZ       LYS  46  -7.740   9.668   2.972
  371   2HZ   LYS  46          2HZ       LYS  46  -7.313   8.106   2.459
  372   3HZ   LYS  46          3HZ       LYS  46  -6.306   9.427   2.099
  373    H    SER  47           H        SER  47   0.036   6.858   3.973
  374    HA   SER  47           HA       SER  47   0.112   9.192   2.108
  375   1HB   SER  47          1HB       SER  47   1.323  10.488   3.789
  376   2HB   SER  47          2HB       SER  47  -0.210   9.951   4.465
  377    HG   SER  47           HG       SER  47   1.636   9.595   5.844
  378    H    ALA  48           H        ALA  48   2.256   9.604   1.276
  379    HA   ALA  48           HA       ALA  48   3.835   7.277   0.740
  380   1HB   ALA  48          1HB       ALA  48   3.874  10.192   0.261
  381   2HB   ALA  48          2HB       ALA  48   4.239   8.869  -0.847
  382   3HB   ALA  48          3HB       ALA  48   5.472   9.445   0.275
  383    H    GLU  49           H        GLU  49   3.944   9.706   3.272
  384    HA   GLU  49           HA       GLU  49   6.611   9.033   4.235
  385   1HB   GLU  49          1HB       GLU  49   4.552  10.967   4.667
  386   2HB   GLU  49          2HB       GLU  49   4.943  10.241   6.227
  387   1HG   GLU  49          1HG       GLU  49   7.341  10.694   5.828
  388   2HG   GLU  49          2HG       GLU  49   6.942  11.424   4.273
  389    H    ASP  50           H        ASP  50   3.385   7.808   4.717
  390    HA   ASP  50           HA       ASP  50   3.903   6.434   7.234
  391   1HB   ASP  50          1HB       ASP  50   1.660   7.150   6.332
  392   2HB   ASP  50          2HB       ASP  50   1.827   5.929   5.069
  393    H    CYS  51           H        CYS  51   4.117   5.708   3.800
  394    HA   CYS  51           HA       CYS  51   4.630   2.856   4.067
  395   1HB   CYS  51          1HB       CYS  51   3.880   3.543   1.956
  396   2HB   CYS  51          2HB       CYS  51   4.832   5.024   1.987
  397    H    MET  52           H        MET  52   6.682   5.738   3.503
  398    HA   MET  52           HA       MET  52   9.212   4.473   3.422
  399   1HB   MET  52          1HB       MET  52   8.249   7.174   4.409
  400   2HB   MET  52          2HB       MET  52   9.961   6.777   4.251
  401   1HG   MET  52          1HG       MET  52   8.486   6.026   1.862
  402   2HG   MET  52          2HG       MET  52   8.268   7.737   2.227
  403   1HE   MET  52          1HE       MET  52  11.869   5.459   0.798
  404   2HE   MET  52          2HE       MET  52  10.350   5.686  -0.065
  405   3HE   MET  52          3HE       MET  52  10.357   4.848   1.485
  406    H    ARG  53           H        ARG  53   7.704   6.061   6.276
  407    HA   ARG  53           HA       ARG  53   9.540   5.374   8.253
  408   1HB   ARG  53          1HB       ARG  53   6.517   5.515   8.215
  409   2HB   ARG  53          2HB       ARG  53   7.419   5.292   9.714
  410   1HG   ARG  53          1HG       ARG  53   8.689   7.405   8.319
  411   2HG   ARG  53          2HG       ARG  53   6.954   7.720   8.233
  412   1HD   ARG  53          1HD       ARG  53   7.441   6.846  10.880
  413   2HD   ARG  53          2HD       ARG  53   8.730   8.005  10.503
  414    HE   ARG  53           HE       ARG  53   6.001   8.782   9.667
  415   1HH1  ARG  53          1HH2      ARG  53   8.292  10.690  10.148
  416   2HH1  ARG  53          2HH2      ARG  53   7.845  11.398  11.664
  417   1HH2  ARG  53          1HH1      ARG  53   5.524   8.936  12.429
  418   2HH2  ARG  53          2HH1      ARG  53   6.278  10.404  12.957
  419    H    THR  54           H        THR  54   7.352   3.267   6.525
  420    HA   THR  54           HA       THR  54   7.855   1.019   8.414
  421    HB   THR  54           HB       THR  54   6.054   1.343   5.990
  422    HG1  THR  54           1HG      THR  54   5.708   1.634   8.772
  423   1HG2  THR  54          1HG2      THR  54   6.930  -1.009   7.125
  424   2HG2  THR  54          2HG2      THR  54   5.417  -0.815   6.239
  425   3HG2  THR  54          3HG2      THR  54   5.427  -0.705   7.999
  426    H    CYS  55           H        CYS  55   7.742   1.339   4.840
  427    HA   CYS  55           HA       CYS  55   9.885  -0.729   4.656
  428   1HB   CYS  55          1HB       CYS  55   7.992   0.421   2.577
  429   2HB   CYS  55          2HB       CYS  55   8.999  -1.017   2.396
  430    H    GLY  56           H        GLY  56  10.489   2.104   5.312
  431   1HA   GLY  56          1HA       GLY  56  11.620   3.212   2.825
  432   2HA   GLY  56          2HA       GLY  56  11.681   3.969   4.418
  433    H    GLY  57           H        GLY  57  12.715   0.707   3.391
  434   1HA   GLY  57          1HA       GLY  57  15.422   1.374   4.468
  435   2HA   GLY  57          2HA       GLY  57  14.735  -0.252   4.453
  436    H    ALA  58           H        ALA  58  15.009   2.280   1.933
  437    HA   ALA  58           HA       ALA  58  16.418   0.252   0.226
  438   1HB   ALA  58          1HB       ALA  58  13.985   0.865  -0.290
  439   2HB   ALA  58          2HB       ALA  58  15.125   1.069  -1.621
  440   3HB   ALA  58          3HB       ALA  58  14.582   2.474  -0.702
  Start of MODEL    2
    1   1H    ARG   1          1H        ARG   1  14.485  -5.412   6.166
    2   2H    ARG   1          2H        ARG   1  15.347  -4.005   5.760
    3   3H    ARG   1          3H        ARG   1  15.245  -5.290   4.654
    4    HA   ARG   1           HA       ARG   1  13.239  -3.264   5.342
    5   1HB   ARG   1          1HB       ARG   1  14.071  -2.783   3.274
    6   2HB   ARG   1          2HB       ARG   1  14.755  -4.392   3.084
    7   1HG   ARG   1          1HG       ARG   1  12.827  -5.248   2.108
    8   2HG   ARG   1          2HG       ARG   1  11.780  -4.063   2.889
    9   1HD   ARG   1          1HD       ARG   1  11.819  -3.007   0.856
   10   2HD   ARG   1          2HD       ARG   1  13.445  -2.477   1.334
   11    HE   ARG   1           HE       ARG   1  12.823  -4.846  -0.376
   12   1HH1  ARG   1          1HH2      ARG   1  14.506  -2.332  -1.059
   13   2HH1  ARG   1          2HH2      ARG   1  16.099  -3.009  -1.018
   14   1HH2  ARG   1          1HH1      ARG   1  15.112  -5.894   0.636
   15   2HH2  ARG   1          2HH1      ARG   1  16.443  -5.029  -0.057
   16    HA   PRO   2           HA       PRO   2  10.013  -6.210   5.833
   17   1HB   PRO   2          1HB       PRO   2   7.929  -4.842   4.698
   18   2HB   PRO   2          2HB       PRO   2   8.584  -4.466   6.299
   19   1HG   PRO   2          1HG       PRO   2   9.079  -3.150   3.664
   20   2HG   PRO   2          2HG       PRO   2   8.864  -2.413   5.260
   21   1HD   PRO   2          1HD       PRO   2  11.292  -2.747   4.074
   22   2HD   PRO   2          2HD       PRO   2  11.066  -2.757   5.837
   23    H    ASP   3           H        ASP   3   8.606  -7.630   4.623
   24    HA   ASP   3           HA       ASP   3   9.435  -7.940   1.780
   25   1HB   ASP   3          1HB       ASP   3   9.365  -9.695   3.815
   26   2HB   ASP   3          2HB       ASP   3   7.709  -9.895   3.239
   27    H    PHE   4           H        PHE   4   6.659  -7.167   3.821
   28    HA   PHE   4           HA       PHE   4   4.628  -7.710   1.835
   29   1HB   PHE   4          1HB       PHE   4   3.207  -6.341   3.318
   30   2HB   PHE   4          2HB       PHE   4   4.164  -7.498   4.234
   31    HD1  PHE   4           1HD      PHE   4   5.998  -6.781   5.668
   32    HD2  PHE   4           2HD      PHE   4   3.692  -3.924   3.427
   33    HE1  PHE   4           1HE      PHE   4   6.904  -4.941   7.064
   34    HE2  PHE   4           2HE      PHE   4   4.607  -2.103   4.824
   35    HZ   PHE   4           HZ       PHE   4   6.200  -2.603   6.633
   36    H    CYS   5           H        CYS   5   6.912  -5.129   2.226
   37    HA   CYS   5           HA       CYS   5   5.440  -3.157   0.649
   38   1HB   CYS   5          1HB       CYS   5   8.337  -3.464   1.502
   39   2HB   CYS   5          2HB       CYS   5   7.690  -2.024   0.714
   40    H    LEU   6           H        LEU   6   7.577  -5.841   0.018
   41    HA   LEU   6           HA       LEU   6   8.220  -5.019  -2.733
   42   1HB   LEU   6          1HB       LEU   6   8.552  -7.708  -1.374
   43   2HB   LEU   6          2HB       LEU   6   9.486  -7.070  -2.727
   44    HG   LEU   6           HG       LEU   6   9.464  -6.003   0.115
   45   1HD1  LEU   6          1HD1      LEU   6  11.969  -6.589  -0.195
   46   2HD1  LEU   6          2HD1      LEU   6  11.425  -7.573  -1.554
   47   3HD1  LEU   6          3HD1      LEU   6  10.844  -7.918   0.076
   48   1HD2  LEU   6          1HD2      LEU   6  10.977  -4.307  -0.620
   49   2HD2  LEU   6          2HD2      LEU   6   9.648  -4.284  -1.779
   50   3HD2  LEU   6          3HD2      LEU   6  11.173  -5.065  -2.200
   51    H    GLU   7           H        GLU   7   5.724  -6.755  -1.078
   52    HA   GLU   7           HA       GLU   7   4.834  -8.311  -3.401
   53   1HB   GLU   7          1HB       GLU   7   3.933  -7.769  -0.582
   54   2HB   GLU   7          2HB       GLU   7   2.828  -8.555  -1.710
   55   1HG   GLU   7          1HG       GLU   7   5.067 -10.001  -2.177
   56   2HG   GLU   7          2HG       GLU   7   5.340  -9.572  -0.488
   57    HA   PRO   8           HA       PRO   8   2.133  -5.350  -5.185
   58   1HB   PRO   8          1HB       PRO   8  -0.074  -6.870  -5.785
   59   2HB   PRO   8          2HB       PRO   8   1.452  -6.971  -6.687
   60   1HG   PRO   8          1HG       PRO   8   0.390  -8.736  -4.520
   61   2HG   PRO   8          2HG       PRO   8   1.224  -9.175  -6.021
   62   1HD   PRO   8          1HD       PRO   8   2.453  -9.106  -3.594
   63   2HD   PRO   8          2HD       PRO   8   3.305  -8.768  -5.118
   64    HA   PRO   9           HA       PRO   9  -0.617  -3.872  -2.093
   65   1HB   PRO   9          1HB       PRO   9  -2.415  -2.459  -3.613
   66   2HB   PRO   9          2HB       PRO   9  -0.767  -1.894  -3.277
   67   1HG   PRO   9          1HG       PRO   9  -1.880  -3.214  -5.707
   68   2HG   PRO   9          2HG       PRO   9  -0.698  -1.901  -5.577
   69   1HD   PRO   9          1HD       PRO   9  -0.038  -4.512  -6.085
   70   2HD   PRO   9          2HD       PRO   9   1.053  -3.355  -5.292
   71    H    TYR  10           H        TYR  10  -3.194  -3.657  -1.774
   72    HA   TYR  10           HA       TYR  10  -4.512  -6.133  -2.858
   73   1HB   TYR  10          1HB       TYR  10  -3.569  -6.468  -0.585
   74   2HB   TYR  10          2HB       TYR  10  -4.479  -5.070  -0.012
   75    HD1  TYR  10           1HD      TYR  10  -4.920  -8.390  -1.689
   76    HD2  TYR  10           2HD      TYR  10  -6.678  -5.324   0.754
   77    HE1  TYR  10           1HE      TYR  10  -6.907  -9.828  -1.313
   78    HE2  TYR  10           2HE      TYR  10  -8.663  -6.761   1.128
   79    HH   TYR  10           HH       TYR  10  -9.528  -8.804   0.862
   80    H    THR  11           H        THR  11  -5.787  -4.875  -4.278
   81    HA   THR  11           HA       THR  11  -7.275  -2.542  -3.505
   82    HB   THR  11           HB       THR  11  -7.319  -4.604  -5.699
   83    HG1  THR  11           1HG      THR  11  -6.068  -2.453  -5.383
   84   1HG2  THR  11          1HG2      THR  11  -9.217  -3.475  -6.765
   85   2HG2  THR  11          2HG2      THR  11  -9.375  -2.399  -5.376
   86   3HG2  THR  11          3HG2      THR  11  -9.701  -4.123  -5.197
   87    H    GLY  12           H        GLY  12  -7.691  -5.956  -3.035
   88   1HA   GLY  12          1HA       GLY  12  -9.364  -7.179  -1.919
   89   2HA   GLY  12          2HA       GLY  12  -9.782  -5.664  -1.117
   90    HA   PRO  13           HA       PRO  13 -13.080  -6.838  -4.202
   91   1HB   PRO  13          1HB       PRO  13 -15.025  -7.643  -2.455
   92   2HB   PRO  13          2HB       PRO  13 -13.817  -8.749  -3.136
   93   1HG   PRO  13          1HG       PRO  13 -13.986  -7.539  -0.438
   94   2HG   PRO  13          2HG       PRO  13 -13.324  -9.100  -0.937
   95   1HD   PRO  13          1HD       PRO  13 -11.859  -6.789  -0.336
   96   2HD   PRO  13          2HD       PRO  13 -11.244  -8.228  -1.176
   97    H    CYS  14           H        CYS  14 -14.997  -6.140  -1.374
   98    HA   CYS  14           HA       CYS  14 -16.435  -4.300  -0.968
   99   1HB   CYS  14          1HB       CYS  14 -13.593  -3.438  -1.208
  100   2HB   CYS  14          2HB       CYS  14 -14.803  -2.159  -1.113
  101    H    LYS  15           H        LYS  15 -16.568  -1.750  -1.952
  102    HA   LYS  15           HA       LYS  15 -16.654  -1.995  -4.931
  103   1HB   LYS  15          1HB       LYS  15 -18.846  -1.810  -2.975
  104   2HB   LYS  15          2HB       LYS  15 -18.961  -0.627  -4.278
  105   1HG   LYS  15          1HG       LYS  15 -18.559  -2.549  -5.895
  106   2HG   LYS  15          2HG       LYS  15 -18.771  -3.640  -4.524
  107   1HD   LYS  15          1HD       LYS  15 -21.027  -3.265  -4.413
  108   2HD   LYS  15          2HD       LYS  15 -20.870  -1.567  -4.865
  109   1HE   LYS  15          1HE       LYS  15 -21.991  -3.143  -6.592
  110   2HE   LYS  15          2HE       LYS  15 -20.678  -2.110  -7.195
  111   1HZ   LYS  15          1HZ       LYS  15 -19.900  -4.643  -5.982
  112   2HZ   LYS  15          2HZ       LYS  15 -19.270  -3.860  -7.353
  113   3HZ   LYS  15          3HZ       LYS  15 -20.703  -4.765  -7.472
  114    H    ALA  16           H        ALA  16 -15.276  -0.381  -2.542
  115    HA   ALA  16           HA       ALA  16 -15.843   2.369  -3.566
  116   1HB   ALA  16          1HB       ALA  16 -14.959   3.086  -1.457
  117   2HB   ALA  16          2HB       ALA  16 -14.204   1.518  -1.166
  118   3HB   ALA  16          3HB       ALA  16 -15.959   1.679  -1.100
  119    H    ARG  17           H        ARG  17 -13.875   3.784  -3.858
  120    HA   ARG  17           HA       ARG  17 -11.474   2.202  -4.712
  121   1HB   ARG  17          1HB       ARG  17 -12.846   4.545  -6.071
  122   2HB   ARG  17          2HB       ARG  17 -11.346   3.802  -6.625
  123   1HG   ARG  17          1HG       ARG  17 -12.454   2.082  -7.587
  124   2HG   ARG  17          2HG       ARG  17 -13.439   1.824  -6.146
  125   1HD   ARG  17          1HD       ARG  17 -14.995   3.564  -6.830
  126   2HD   ARG  17          2HD       ARG  17 -13.945   4.027  -8.183
  127    HE   ARG  17           HE       ARG  17 -15.227   1.319  -7.948
  128   1HH1  ARG  17          1HH1      ARG  17 -16.514   3.473  -9.650
  129   2HH1  ARG  17          2HH1      ARG  17 -15.896   3.085 -11.221
  130   1HH2  ARG  17          1HH2      ARG  17 -13.363   1.048 -10.013
  131   2HH2  ARG  17          2HH2      ARG  17 -14.109   1.718 -11.425
  132    H    ILE  18           H        ILE  18 -10.911   2.959  -2.383
  133    HA   ILE  18           HA       ILE  18 -10.307   5.790  -1.994
  134    HB   ILE  18           HB       ILE  18  -9.447   3.294  -0.489
  135   1HG1  ILE  18          1HG1      ILE  18 -11.812   5.119   0.033
  136   2HG1  ILE  18          2HG1      ILE  18 -11.937   3.584  -0.827
  137   1HG2  ILE  18          1HG2      ILE  18  -9.855   6.036   0.682
  138   2HG2  ILE  18          2HG2      ILE  18  -8.324   5.627  -0.091
  139   3HG2  ILE  18          3HG2      ILE  18  -8.885   4.700   1.301
  140   1HD1  ILE  18          1HD1      ILE  18 -11.294   4.094   2.063
  141   2HD1  ILE  18          2HD1      ILE  18 -10.682   2.634   1.284
  142   3HD1  ILE  18          3HD1      ILE  18 -12.419   2.930   1.361
  143    H    ILE  19           H        ILE  19  -8.151   6.689  -1.910
  144    HA   ILE  19           HA       ILE  19  -6.225   5.300  -3.691
  145    HB   ILE  19           HB       ILE  19  -6.434   8.110  -2.566
  146   1HG1  ILE  19          1HG1      ILE  19  -8.153   7.322  -4.261
  147   2HG1  ILE  19          2HG1      ILE  19  -7.192   8.711  -4.773
  148   1HG2  ILE  19          1HG2      ILE  19  -4.115   7.736  -2.981
  149   2HG2  ILE  19          2HG2      ILE  19  -4.717   8.566  -4.417
  150   3HG2  ILE  19          3HG2      ILE  19  -4.450   6.823  -4.452
  151   1HD1  ILE  19          1HD1      ILE  19  -7.535   6.491  -6.300
  152   2HD1  ILE  19          2HD1      ILE  19  -6.067   6.045  -5.430
  153   3HD1  ILE  19          3HD1      ILE  19  -6.104   7.519  -6.397
  154    H    ARG  20           H        ARG  20  -5.391   3.745  -2.146
  155    HA   ARG  20           HA       ARG  20  -4.111   4.755   0.323
  156   1HB   ARG  20          1HB       ARG  20  -4.688   2.096  -0.958
  157   2HB   ARG  20          2HB       ARG  20  -3.540   2.194   0.377
  158   1HG   ARG  20          1HG       ARG  20  -6.407   3.192   0.437
  159   2HG   ARG  20          2HG       ARG  20  -5.819   1.715   1.202
  160   1HD   ARG  20          1HD       ARG  20  -5.186   2.916   3.021
  161   2HD   ARG  20          2HD       ARG  20  -4.136   3.919   1.999
  162    HE   ARG  20           HE       ARG  20  -6.458   5.061   1.402
  163   1HH1  ARG  20          1HH2      ARG  20  -6.703   3.203   4.148
  164   2HH1  ARG  20          2HH2      ARG  20  -7.140   4.495   5.216
  165   1HH2  ARG  20          1HH1      ARG  20  -6.496   6.987   2.894
  166   2HH2  ARG  20          2HH1      ARG  20  -7.025   6.635   4.505
  167    H    TYR  21           H        TYR  21  -1.811   3.828   0.718
  168    HA   TYR  21           HA       TYR  21  -0.160   4.287  -1.744
  169   1HB   TYR  21          1HB       TYR  21  -0.015   5.065   1.131
  170   2HB   TYR  21          2HB       TYR  21   1.517   4.732   0.324
  171    HD1  TYR  21           1HD      TYR  21  -1.257   7.045   0.673
  172    HD2  TYR  21           2HD      TYR  21   2.121   6.001  -1.767
  173    HE1  TYR  21           1HE      TYR  21  -1.324   9.289  -0.381
  174    HE2  TYR  21           2HE      TYR  21   2.051   8.244  -2.824
  175    HH   TYR  21           HH       TYR  21   1.229  10.448  -2.391
  176    H    PHE  22           H        PHE  22   1.508   2.811  -2.186
  177    HA   PHE  22           HA       PHE  22   2.027   0.619  -0.246
  178   1HB   PHE  22          1HB       PHE  22   1.377  -1.079  -1.737
  179   2HB   PHE  22          2HB       PHE  22   0.144   0.144  -1.976
  180    HD1  PHE  22           1HD      PHE  22   0.184   1.611  -3.986
  181    HD2  PHE  22           2HD      PHE  22   2.993  -1.594  -3.451
  182    HE1  PHE  22           1HE      PHE  22   0.788   1.739  -6.389
  183    HE2  PHE  22           2HE      PHE  22   3.597  -1.466  -5.854
  184    HZ   PHE  22           HZ       PHE  22   2.495   0.202  -7.321
  185    H    TYR  23           H        TYR  23   4.060  -0.439  -0.661
  186    HA   TYR  23           HA       TYR  23   6.051   1.333  -1.919
  187   1HB   TYR  23          1HB       TYR  23   6.388   0.159   0.243
  188   2HB   TYR  23          2HB       TYR  23   6.301  -1.391  -0.594
  189    HD1  TYR  23           1HD      TYR  23   8.299  -2.364  -1.315
  190    HD2  TYR  23           2HD      TYR  23   8.099   1.897  -0.827
  191    HE1  TYR  23           1HE      TYR  23  10.701  -2.183  -1.902
  192    HE2  TYR  23           2HE      TYR  23  10.501   2.079  -1.413
  193    HH   TYR  23           HH       TYR  23  12.432  -0.823  -2.169
  194    H    ASN  24           H        ASN  24   6.303   1.199  -4.136
  195    HA   ASN  24           HA       ASN  24   5.732  -1.299  -5.592
  196   1HB   ASN  24          1HB       ASN  24   5.171   1.031  -6.374
  197   2HB   ASN  24          2HB       ASN  24   6.897   1.345  -6.527
  198   1HD2  ASN  24          1HD2      ASN  24   5.658   1.601  -8.897
  199   2HD2  ASN  24          2HD2      ASN  24   5.847   0.234  -9.884
  200    H    ALA  25           H        ALA  25   7.464  -2.652  -4.647
  201    HA   ALA  25           HA       ALA  25  10.186  -2.119  -4.472
  202   1HB   ALA  25          1HB       ALA  25  10.124  -4.331  -4.000
  203   2HB   ALA  25          2HB       ALA  25   9.747  -4.708  -5.682
  204   3HB   ALA  25          3HB       ALA  25   8.446  -4.355  -4.544
  205    H    LYS  26           H        LYS  26   8.251  -2.469  -7.364
  206    HA   LYS  26           HA       LYS  26  10.488  -2.843  -9.197
  207   1HB   LYS  26          1HB       LYS  26   7.566  -2.609  -9.216
  208   2HB   LYS  26          2HB       LYS  26   8.313  -1.806 -10.599
  209   1HG   LYS  26          1HG       LYS  26   8.336  -3.888 -11.517
  210   2HG   LYS  26          2HG       LYS  26   9.739  -4.149 -10.480
  211   1HD   LYS  26          1HD       LYS  26   7.340  -4.541  -8.940
  212   2HD   LYS  26          2HD       LYS  26   7.249  -5.515 -10.408
  213   1HE   LYS  26          1HE       LYS  26   9.512  -6.440  -9.900
  214   2HE   LYS  26          2HE       LYS  26   9.529  -5.506  -8.391
  215   1HZ   LYS  26          1HZ       LYS  26   7.320  -7.345  -9.147
  216   2HZ   LYS  26          2HZ       LYS  26   7.616  -6.644  -7.628
  217   3HZ   LYS  26          3HZ       LYS  26   8.649  -7.854  -8.223
  218    H    ALA  27           H        ALA  27   8.833  -0.124  -7.727
  219    HA   ALA  27           HA       ALA  27  10.109   1.818  -9.580
  220   1HB   ALA  27          1HB       ALA  27   8.549   3.330  -8.665
  221   2HB   ALA  27          2HB       ALA  27   8.437   2.436  -7.148
  222   3HB   ALA  27          3HB       ALA  27   7.683   1.795  -8.606
  223    H    GLY  28           H        GLY  28  10.451   0.524  -6.338
  224   1HA   GLY  28          1HA       GLY  28  12.457   0.697  -5.029
  225   2HA   GLY  28          2HA       GLY  28  12.959   2.065  -6.025
  226    H    LEU  29           H        LEU  29   9.817   2.702  -5.393
  227    HA   LEU  29           HA       LEU  29  10.322   3.939  -2.725
  228   1HB   LEU  29          1HB       LEU  29   9.399   6.049  -3.634
  229   2HB   LEU  29          2HB       LEU  29  10.824   5.547  -4.544
  230    HG   LEU  29           HG       LEU  29   8.259   4.467  -5.543
  231   1HD1  LEU  29          1HD1      LEU  29   7.961   6.981  -4.753
  232   2HD1  LEU  29          2HD1      LEU  29   7.313   6.447  -6.303
  233   3HD1  LEU  29          3HD1      LEU  29   8.843   7.322  -6.242
  234   1HD2  LEU  29          1HD2      LEU  29  10.922   5.111  -6.465
  235   2HD2  LEU  29          2HD2      LEU  29   9.727   5.882  -7.507
  236   3HD2  LEU  29          3HD2      LEU  29   9.686   4.136  -7.260
  237    H    CYS  30           H        CYS  30   7.721   5.400  -3.144
  238    HA   CYS  30           HA       CYS  30   5.889   3.050  -2.791
  239   1HB   CYS  30          1HB       CYS  30   6.023   5.771  -1.470
  240   2HB   CYS  30          2HB       CYS  30   4.668   4.661  -1.256
  241    H    GLN  31           H        GLN  31   3.776   3.244  -3.640
  242    HA   GLN  31           HA       GLN  31   3.163   5.639  -5.317
  243   1HB   GLN  31          1HB       GLN  31   3.386   2.739  -6.127
  244   2HB   GLN  31          2HB       GLN  31   2.366   3.851  -7.038
  245   1HG   GLN  31          1HG       GLN  31   4.545   5.370  -6.957
  246   2HG   GLN  31          2HG       GLN  31   5.346   3.813  -6.738
  247   1HE2  GLN  31          1HE2      GLN  31   6.282   3.783  -8.891
  248   2HE2  GLN  31          2HE2      GLN  31   5.328   3.611 -10.285
  249    H    THR  32           H        THR  32   0.807   5.739  -5.821
  250    HA   THR  32           HA       THR  32  -0.798   4.667  -3.583
  251    HB   THR  32           HB       THR  32  -2.503   6.130  -5.071
  252    HG1  THR  32           1HG      THR  32  -1.228   7.798  -6.038
  253   1HG2  THR  32          1HG2      THR  32  -2.180   7.756  -3.483
  254   2HG2  THR  32          2HG2      THR  32  -0.426   7.734  -3.669
  255   3HG2  THR  32          3HG2      THR  32  -1.228   6.475  -2.730
  256    H    PHE  33           H        PHE  33  -2.573   3.267  -3.860
  257    HA   PHE  33           HA       PHE  33  -3.042   2.164  -6.599
  258   1HB   PHE  33          1HB       PHE  33  -2.753  -0.067  -5.800
  259   2HB   PHE  33          2HB       PHE  33  -1.393   0.840  -5.151
  260    HD1  PHE  33           1HD      PHE  33  -1.487   1.669  -2.748
  261    HD2  PHE  33           2HD      PHE  33  -4.353  -1.090  -4.369
  262    HE1  PHE  33           1HE      PHE  33  -2.167   1.035  -0.458
  263    HE2  PHE  33           2HE      PHE  33  -5.033  -1.730  -2.071
  264    HZ   PHE  33           HZ       PHE  33  -3.940  -0.669  -0.114
  265    H    VAL  34           H        VAL  34  -5.127   0.972  -6.714
  266    HA   VAL  34           HA       VAL  34  -7.249   2.406  -5.340
  267    HB   VAL  34           HB       VAL  34  -7.188  -0.051  -7.121
  268   1HG1  VAL  34          1HG1      VAL  34  -9.382  -0.270  -6.669
  269   2HG1  VAL  34          2HG1      VAL  34  -9.646   1.350  -7.314
  270   3HG1  VAL  34          3HG1      VAL  34  -9.329   1.126  -5.594
  271   1HG2  VAL  34          1HG2      VAL  34  -6.503   2.519  -7.752
  272   2HG2  VAL  34          2HG2      VAL  34  -8.235   2.545  -8.081
  273   3HG2  VAL  34          3HG2      VAL  34  -7.200   1.377  -8.901
  274    H    TYR  35           H        TYR  35  -7.467   1.965  -3.148
  275    HA   TYR  35           HA       TYR  35  -7.135  -0.785  -2.122
  276   1HB   TYR  35          1HB       TYR  35  -6.248   1.129  -0.898
  277   2HB   TYR  35          2HB       TYR  35  -7.834   1.892  -0.872
  278    HD1  TYR  35           1HD      TYR  35  -7.082  -1.719  -0.370
  279    HD2  TYR  35           2HD      TYR  35  -8.275   1.979   1.464
  280    HE1  TYR  35           1HE      TYR  35  -7.620  -2.931   1.725
  281    HE2  TYR  35           2HE      TYR  35  -8.816   0.764   3.559
  282    HH   TYR  35           HH       TYR  35  -8.967  -1.216   4.546
  283    H    GLY  36           H        GLY  36  -8.871  -1.995  -1.188
  284   1HA   GLY  36          1HA       GLY  36 -11.528  -1.344  -2.275
  285   2HA   GLY  36          2HA       GLY  36 -11.081  -2.842  -1.461
  286    H    ALA  37           H        ALA  37  -9.890  -0.453   0.463
  287    HA   ALA  37           HA       ALA  37 -10.700   0.705   2.375
  288   1HB   ALA  37          1HB       ALA  37 -12.946   1.372   2.363
  289   2HB   ALA  37          2HB       ALA  37 -13.489  -0.139   1.633
  290   3HB   ALA  37          3HB       ALA  37 -12.651   1.063   0.652
  291    H    CYS  38           H        CYS  38 -11.128  -2.578   1.686
  292    HA   CYS  38           HA       CYS  38 -11.602  -3.151   4.582
  293   1HB   CYS  38          1HB       CYS  38 -12.989  -5.125   3.680
  294   2HB   CYS  38          2HB       CYS  38 -13.712  -3.524   3.529
  295    H    ARG  39           H        ARG  39 -10.866  -5.427   5.124
  296    HA   ARG  39           HA       ARG  39  -9.038  -6.939   5.185
  297   1HB   ARG  39          1HB       ARG  39 -10.188  -6.865   2.415
  298   2HB   ARG  39          2HB       ARG  39  -8.754  -7.851   2.705
  299   1HG   ARG  39          1HG       ARG  39  -9.947  -9.412   3.830
  300   2HG   ARG  39          2HG       ARG  39 -10.776  -8.187   4.792
  301   1HD   ARG  39          1HD       ARG  39 -12.501  -7.937   3.199
  302   2HD   ARG  39          2HD       ARG  39 -11.516  -8.625   1.893
  303    HE   ARG  39           HE       ARG  39 -11.673 -10.651   3.801
  304   1HH1  ARG  39          1HH2      ARG  39 -13.653  -8.988   1.553
  305   2HH1  ARG  39          2HH2      ARG  39 -15.004 -10.055   1.734
  306   1HH2  ARG  39          1HH1      ARG  39 -13.529 -11.926   4.254
  307   2HH2  ARG  39          2HH1      ARG  39 -14.932 -11.721   3.261
  308    H    ALA  40           H        ALA  40  -8.018  -4.406   5.315
  309    HA   ALA  40           HA       ALA  40  -6.202  -3.735   3.154
  310   1HB   ALA  40          1HB       ALA  40  -5.310  -2.555   5.529
  311   2HB   ALA  40          2HB       ALA  40  -7.042  -2.772   5.775
  312   3HB   ALA  40          3HB       ALA  40  -6.457  -1.854   4.388
  313    H    LYS  41           H        LYS  41  -3.850  -3.870   3.261
  314    HA   LYS  41           HA       LYS  41  -2.857  -6.123   4.982
  315   1HB   LYS  41          1HB       LYS  41  -1.932  -5.232   2.232
  316   2HB   LYS  41          2HB       LYS  41  -1.442  -6.698   3.083
  317   1HG   LYS  41          1HG       LYS  41  -4.064  -7.124   3.143
  318   2HG   LYS  41          2HG       LYS  41  -4.043  -6.052   1.743
  319   1HD   LYS  41          1HD       LYS  41  -3.738  -8.133   0.733
  320   2HD   LYS  41          2HD       LYS  41  -2.067  -7.611   0.955
  321   1HE   LYS  41          1HE       LYS  41  -1.757  -9.038   2.825
  322   2HE   LYS  41          2HE       LYS  41  -3.503  -9.237   3.067
  323   1HZ   LYS  41          1HZ       LYS  41  -3.238 -10.025   0.534
  324   2HZ   LYS  41          2HZ       LYS  41  -3.147 -11.098   1.849
  325   3HZ   LYS  41          3HZ       LYS  41  -1.725 -10.504   1.133
  326    H    ARG  42           H        ARG  42  -0.112  -5.779   4.417
  327    HA   ARG  42           HA       ARG  42   0.499  -3.459   6.109
  328   1HB   ARG  42          1HB       ARG  42   2.409  -5.316   4.663
  329   2HB   ARG  42          2HB       ARG  42   2.712  -4.395   6.132
  330   1HG   ARG  42          1HG       ARG  42   1.188  -5.755   7.399
  331   2HG   ARG  42          2HG       ARG  42   0.587  -6.546   5.941
  332   1HD   ARG  42          1HD       ARG  42   3.516  -6.740   6.298
  333   2HD   ARG  42          2HD       ARG  42   2.563  -7.585   7.535
  334    HE   ARG  42           HE       ARG  42   1.403  -8.099   4.975
  335   1HH1  ARG  42          1HH2      ARG  42   4.137  -8.828   6.954
  336   2HH1  ARG  42          2HH2      ARG  42   4.505 -10.304   6.126
  337   1HH2  ARG  42          1HH1      ARG  42   1.924  -9.982   3.835
  338   2HH2  ARG  42          2HH1      ARG  42   3.257 -10.954   4.360
  339    H    ASN  43           H        ASN  43   0.587  -4.245   2.691
  340    HA   ASN  43           HA       ASN  43   2.202  -1.829   2.070
  341   1HB   ASN  43          1HB       ASN  43   2.166  -4.288   0.990
  342   2HB   ASN  43          2HB       ASN  43   0.911  -3.552  -0.008
  343   1HD2  ASN  43          1HD2      ASN  43   3.072  -4.171  -1.486
  344   2HD2  ASN  43          2HD2      ASN  43   4.057  -2.824  -1.791
  345    H    ASN  44           H        ASN  44  -0.041  -1.020   3.294
  346    HA   ASN  44           HA       ASN  44  -1.628   0.244   1.114
  347   1HB   ASN  44          1HB       ASN  44  -2.795  -1.823   1.786
  348   2HB   ASN  44          2HB       ASN  44  -2.703  -1.341   3.478
  349   1HD2  ASN  44          1HD2      ASN  44  -5.224  -1.840   2.311
  350   2HD2  ASN  44          2HD2      ASN  44  -6.077  -0.369   2.162
  351    H    PHE  45           H        PHE  45  -0.097   1.970   2.027
  352    HA   PHE  45           HA       PHE  45  -0.778   2.972   4.732
  353   1HB   PHE  45          1HB       PHE  45   1.130   4.161   2.711
  354   2HB   PHE  45          2HB       PHE  45   1.208   4.255   4.469
  355    HD1  PHE  45           1HD      PHE  45   1.971   2.247   1.515
  356    HD2  PHE  45           2HD      PHE  45   1.830   2.229   5.807
  357    HE1  PHE  45           1HE      PHE  45   3.365   0.197   1.549
  358    HE2  PHE  45           2HE      PHE  45   3.226   0.178   5.842
  359    HZ   PHE  45           HZ       PHE  45   3.992  -0.843   3.711
  360    H    LYS  46           H        LYS  46  -1.275   5.325   4.982
  361    HA   LYS  46           HA       LYS  46  -3.275   6.174   2.968
  362   1HB   LYS  46          1HB       LYS  46  -2.467   7.390   5.630
  363   2HB   LYS  46          2HB       LYS  46  -3.959   7.698   4.739
  364   1HG   LYS  46          1HG       LYS  46  -4.901   5.706   5.374
  365   2HG   LYS  46          2HG       LYS  46  -3.357   4.854   5.360
  366   1HD   LYS  46          1HD       LYS  46  -3.015   5.243   7.562
  367   2HD   LYS  46          2HD       LYS  46  -3.473   6.939   7.412
  368   1HE   LYS  46          1HE       LYS  46  -5.723   6.499   7.865
  369   2HE   LYS  46          2HE       LYS  46  -5.618   4.830   7.265
  370   1HZ   LYS  46          1HZ       LYS  46  -5.550   5.407   9.844
  371   2HZ   LYS  46          2HZ       LYS  46  -3.895   5.587   9.508
  372   3HZ   LYS  46          3HZ       LYS  46  -4.671   4.109   9.193
  373    H    SER  47           H        SER  47  -0.011   6.814   3.806
  374    HA   SER  47           HA       SER  47   0.034   9.106   1.901
  375   1HB   SER  47          1HB       SER  47   1.165  10.512   3.506
  376   2HB   SER  47          2HB       SER  47  -0.281   9.885   4.290
  377    HG   SER  47           HG       SER  47   2.395   9.220   4.711
  378    H    ALA  48           H        ALA  48   2.251   9.571   1.160
  379    HA   ALA  48           HA       ALA  48   3.801   7.186   0.676
  380   1HB   ALA  48          1HB       ALA  48   3.562   9.825  -0.278
  381   2HB   ALA  48          2HB       ALA  48   4.624   8.570  -0.917
  382   3HB   ALA  48          3HB       ALA  48   5.223   9.694   0.303
  383    H    GLU  49           H        GLU  49   3.821   9.607   3.178
  384    HA   GLU  49           HA       GLU  49   6.558   9.180   4.075
  385   1HB   GLU  49          1HB       GLU  49   4.126  10.281   5.520
  386   2HB   GLU  49          2HB       GLU  49   5.815  10.571   5.943
  387   1HG   GLU  49          1HG       GLU  49   6.131  12.048   4.207
  388   2HG   GLU  49          2HG       GLU  49   4.997  11.208   3.150
  389    H    ASP  50           H        ASP  50   3.463   7.648   4.674
  390    HA   ASP  50           HA       ASP  50   4.372   6.205   7.070
  391   1HB   ASP  50          1HB       ASP  50   1.929   6.182   5.283
  392   2HB   ASP  50          2HB       ASP  50   2.111   5.050   6.624
  393    H    CYS  51           H        CYS  51   4.083   5.661   3.609
  394    HA   CYS  51           HA       CYS  51   4.516   2.786   3.698
  395   1HB   CYS  51          1HB       CYS  51   3.381   3.802   1.831
  396   2HB   CYS  51          2HB       CYS  51   4.701   4.941   1.571
  397    H    MET  52           H        MET  52   6.575   5.630   3.040
  398    HA   MET  52           HA       MET  52   8.990   4.163   2.516
  399   1HB   MET  52          1HB       MET  52   8.219   6.669   2.160
  400   2HB   MET  52          2HB       MET  52   8.942   6.898   3.751
  401   1HG   MET  52          1HG       MET  52  10.922   7.089   2.673
  402   2HG   MET  52          2HG       MET  52  10.816   5.353   2.383
  403   1HE   MET  52          1HE       MET  52  12.057   5.147   0.226
  404   2HE   MET  52          2HE       MET  52  12.559   6.808   0.532
  405   3HE   MET  52          3HE       MET  52  12.004   6.344  -1.074
  406    H    ARG  53           H        ARG  53   8.032   5.990   5.463
  407    HA   ARG  53           HA       ARG  53  10.153   5.242   7.136
  408   1HB   ARG  53          1HB       ARG  53   8.684   5.904   8.906
  409   2HB   ARG  53          2HB       ARG  53   8.184   6.844   7.500
  410   1HG   ARG  53          1HG       ARG  53   6.107   6.030   7.865
  411   2HG   ARG  53          2HG       ARG  53   6.720   4.485   7.274
  412   1HD   ARG  53          1HD       ARG  53   6.130   3.699   9.343
  413   2HD   ARG  53          2HD       ARG  53   7.596   4.524   9.910
  414    HE   ARG  53           HE       ARG  53   4.819   5.580  10.080
  415   1HH1  ARG  53          1HH2      ARG  53   6.584   7.831   9.346
  416   2HH1  ARG  53          2HH2      ARG  53   7.156   8.391  10.882
  417   1HH2  ARG  53          1HH1      ARG  53   6.257   5.500  12.570
  418   2HH2  ARG  53          2HH1      ARG  53   6.970   7.074  12.707
  419    H    THR  54           H        THR  54   7.542   3.274   5.941
  420    HA   THR  54           HA       THR  54   8.126   1.126   7.927
  421    HB   THR  54           HB       THR  54   5.918   1.784   5.982
  422    HG1  THR  54           1HG      THR  54   4.842   1.157   8.114
  423   1HG2  THR  54          1HG2      THR  54   6.414  -0.604   5.658
  424   2HG2  THR  54          2HG2      THR  54   4.881  -0.393   6.504
  425   3HG2  THR  54          3HG2      THR  54   6.324  -0.864   7.401
  426    H    CYS  55           H        CYS  55   8.069   1.763   4.422
  427    HA   CYS  55           HA       CYS  55   9.267  -0.902   3.880
  428   1HB   CYS  55          1HB       CYS  55   8.337   1.350   2.069
  429   2HB   CYS  55          2HB       CYS  55   8.777  -0.274   1.543
  430    H    GLY  56           H        GLY  56   9.957   2.565   3.313
  431   1HA   GLY  56          1HA       GLY  56  12.471   2.273   2.058
  432   2HA   GLY  56          2HA       GLY  56  12.008   3.670   3.031
  433    H    GLY  57           H        GLY  57  13.996   0.899   2.886
  434   1HA   GLY  57          1HA       GLY  57  15.661   1.514   5.012
  435   2HA   GLY  57          2HA       GLY  57  14.380   0.548   5.747
  436    H    ALA  58           H        ALA  58  16.470   0.456   2.835
  437    HA   ALA  58           HA       ALA  58  16.763  -2.497   3.291
  438   1HB   ALA  58          1HB       ALA  58  16.912  -0.901   0.712
  439   2HB   ALA  58          2HB       ALA  58  15.470  -1.746   1.276
  440   3HB   ALA  58          3HB       ALA  58  16.921  -2.658   0.858
  Start of MODEL    3
    1   1H    ARG   1          1H        ARG   1  14.097  -6.303   4.815
    2   2H    ARG   1          2H        ARG   1  14.106  -6.300   6.514
    3   3H    ARG   1          3H        ARG   1  14.565  -4.907   5.657
    4    HA   ARG   1           HA       ARG   1  12.282  -4.773   6.608
    5   1HB   ARG   1          1HB       ARG   1  11.487  -3.726   4.566
    6   2HB   ARG   1          2HB       ARG   1  13.236  -3.533   4.617
    7   1HG   ARG   1          1HG       ARG   1  13.583  -5.228   3.000
    8   2HG   ARG   1          2HG       ARG   1  11.955  -5.875   3.205
    9   1HD   ARG   1          1HD       ARG   1  11.099  -4.411   1.681
   10   2HD   ARG   1          2HD       ARG   1  11.961  -3.042   2.412
   11    HE   ARG   1           HE       ARG   1  12.878  -4.606   0.146
   12   1HH1  ARG   1          1HH2      ARG   1  13.619  -2.189   2.396
   13   2HH1  ARG   1          2HH2      ARG   1  15.325  -2.206   2.097
   14   1HH2  ARG   1          1HH1      ARG   1  15.201  -4.972   0.009
   15   2HH2  ARG   1          2HH1      ARG   1  16.220  -3.781   0.745
   16    HA   PRO   2           HA       PRO   2   9.530  -8.155   6.111
   17   1HB   PRO   2          1HB       PRO   2   7.160  -6.917   5.484
   18   2HB   PRO   2          2HB       PRO   2   7.851  -6.944   7.115
   19   1HG   PRO   2          1HG       PRO   2   7.994  -4.814   5.013
   20   2HG   PRO   2          2HG       PRO   2   7.672  -4.653   6.748
   21   1HD   PRO   2          1HD       PRO   2  10.091  -4.131   5.689
   22   2HD   PRO   2          2HD       PRO   2   9.921  -4.869   7.297
   23    H    ASP   3           H        ASP   3   8.283  -9.377   4.519
   24    HA   ASP   3           HA       ASP   3   9.222  -8.888   1.775
   25   1HB   ASP   3          1HB       ASP   3   8.128 -11.064   3.430
   26   2HB   ASP   3          2HB       ASP   3   7.562 -11.094   1.760
   27    H    PHE   4           H        PHE   4   6.305  -8.372   3.641
   28    HA   PHE   4           HA       PHE   4   4.435  -8.444   1.447
   29   1HB   PHE   4          1HB       PHE   4   2.935  -7.360   2.997
   30   2HB   PHE   4          2HB       PHE   4   3.908  -8.516   3.900
   31    HD1  PHE   4           1HD      PHE   4   4.842  -7.826   5.890
   32    HD2  PHE   4           2HD      PHE   4   4.028  -4.870   2.874
   33    HE1  PHE   4           1HE      PHE   4   5.595  -6.036   7.430
   34    HE2  PHE   4           2HE      PHE   4   4.785  -3.100   4.415
   35    HZ   PHE   4           HZ       PHE   4   5.562  -3.671   6.686
   36    H    CYS   5           H        CYS   5   6.834  -6.148   2.379
   37    HA   CYS   5           HA       CYS   5   5.652  -3.798   1.166
   38   1HB   CYS   5          1HB       CYS   5   8.325  -4.723   2.159
   39   2HB   CYS   5          2HB       CYS   5   8.255  -3.253   1.190
   40    H    LEU   6           H        LEU   6   7.629  -6.482   0.005
   41    HA   LEU   6           HA       LEU   6   8.225  -5.240  -2.581
   42   1HB   LEU   6          1HB       LEU   6   8.405  -8.149  -1.748
   43   2HB   LEU   6          2HB       LEU   6   9.348  -7.330  -2.995
   44    HG   LEU   6           HG       LEU   6   9.441  -6.691  -0.030
   45   1HD1  LEU   6          1HD1      LEU   6  11.886  -7.560  -0.506
   46   2HD1  LEU   6          2HD1      LEU   6  11.102  -8.418  -1.832
   47   3HD1  LEU   6          3HD1      LEU   6  10.591  -8.708  -0.169
   48   1HD2  LEU   6          1HD2      LEU   6  10.027  -4.699  -1.121
   49   2HD2  LEU   6          2HD2      LEU   6  10.762  -5.547  -2.481
   50   3HD2  LEU   6          3HD2      LEU   6  11.592  -5.489  -0.927
   51    H    GLU   7           H        GLU   7   5.584  -6.988  -1.224
   52    HA   GLU   7           HA       GLU   7   4.616  -8.142  -3.738
   53   1HB   GLU   7          1HB       GLU   7   3.688  -7.850  -0.896
   54   2HB   GLU   7          2HB       GLU   7   2.528  -8.346  -2.129
   55   1HG   GLU   7          1HG       GLU   7   3.686 -10.331  -2.594
   56   2HG   GLU   7          2HG       GLU   7   5.206  -9.710  -1.949
   57    HA   PRO   8           HA       PRO   8   2.336  -4.704  -5.223
   58   1HB   PRO   8          1HB       PRO   8   0.068  -5.906  -6.192
   59   2HB   PRO   8          2HB       PRO   8   1.647  -6.017  -6.995
   60   1HG   PRO   8          1HG       PRO   8   0.262  -7.978  -5.220
   61   2HG   PRO   8          2HG       PRO   8   1.204  -8.262  -6.692
   62   1HD   PRO   8          1HD       PRO   8   2.179  -8.649  -4.169
   63   2HD   PRO   8          2HD       PRO   8   3.202  -8.219  -5.559
   64    HA   PRO   9           HA       PRO   9  -0.646  -3.397  -2.288
   65   1HB   PRO   9          1HB       PRO   9  -2.427  -1.971  -3.808
   66   2HB   PRO   9          2HB       PRO   9  -0.805  -1.384  -3.396
   67   1HG   PRO   9          1HG       PRO   9  -1.819  -2.599  -5.918
   68   2HG   PRO   9          2HG       PRO   9  -0.638  -1.301  -5.683
   69   1HD   PRO   9          1HD       PRO   9   0.010  -3.905  -6.282
   70   2HD   PRO   9          2HD       PRO   9   1.096  -2.768  -5.454
   71    H    TYR  10           H        TYR  10  -3.102  -3.433  -1.791
   72    HA   TYR  10           HA       TYR  10  -4.439  -5.766  -3.142
   73   1HB   TYR  10          1HB       TYR  10  -3.267  -6.211  -0.917
   74   2HB   TYR  10          2HB       TYR  10  -4.450  -5.131  -0.180
   75    HD1  TYR  10           1HD      TYR  10  -4.632  -7.813  -2.810
   76    HD2  TYR  10           2HD      TYR  10  -6.107  -6.320   0.939
   77    HE1  TYR  10           1HE      TYR  10  -6.268  -9.676  -2.709
   78    HE2  TYR  10           2HE      TYR  10  -7.742  -8.181   1.039
   79    HH   TYR  10           HH       TYR  10  -8.688  -9.858  -0.120
   80    H    THR  11           H        THR  11  -5.878  -4.397  -4.293
   81    HA   THR  11           HA       THR  11  -7.324  -2.186  -3.318
   82    HB   THR  11           HB       THR  11  -7.796  -4.382  -5.326
   83    HG1  THR  11           1HG      THR  11  -6.504  -2.273  -5.460
   84   1HG2  THR  11          1HG2      THR  11  -9.820  -2.812  -6.001
   85   2HG2  THR  11          2HG2      THR  11  -9.820  -2.436  -4.279
   86   3HG2  THR  11          3HG2      THR  11 -10.043  -4.100  -4.818
   87    H    GLY  12           H        GLY  12  -7.554  -5.572  -2.575
   88   1HA   GLY  12          1HA       GLY  12  -8.786  -6.655  -0.881
   89   2HA   GLY  12          2HA       GLY  12  -9.352  -5.070  -0.352
   90    HA   PRO  13           HA       PRO  13 -12.525  -7.442  -3.005
   91   1HB   PRO  13          1HB       PRO  13 -13.836  -8.910  -1.100
   92   2HB   PRO  13          2HB       PRO  13 -12.473  -9.542  -2.045
   93   1HG   PRO  13          1HG       PRO  13 -12.547  -8.493   0.743
   94   2HG   PRO  13          2HG       PRO  13 -11.618  -9.841   0.070
   95   1HD   PRO  13          1HD       PRO  13 -10.591  -7.341   0.587
   96   2HD   PRO  13          2HD       PRO  13  -9.916  -8.472  -0.608
   97    H    CYS  14           H        CYS  14 -13.418  -5.292  -3.082
   98    HA   CYS  14           HA       CYS  14 -15.693  -4.864  -1.237
   99   1HB   CYS  14          1HB       CYS  14 -13.136  -3.310  -1.316
  100   2HB   CYS  14          2HB       CYS  14 -14.632  -2.416  -1.044
  101    H    LYS  15           H        LYS  15 -16.254  -2.225  -1.981
  102    HA   LYS  15           HA       LYS  15 -16.459  -2.378  -4.970
  103   1HB   LYS  15          1HB       LYS  15 -18.726  -1.065  -4.278
  104   2HB   LYS  15          2HB       LYS  15 -18.654  -2.816  -4.443
  105   1HG   LYS  15          1HG       LYS  15 -17.975  -1.565  -1.798
  106   2HG   LYS  15          2HG       LYS  15 -19.667  -1.748  -2.261
  107   1HD   LYS  15          1HD       LYS  15 -19.007  -4.201  -2.831
  108   2HD   LYS  15          2HD       LYS  15 -17.587  -3.888  -1.833
  109   1HE   LYS  15          1HE       LYS  15 -19.966  -2.926  -0.488
  110   2HE   LYS  15          2HE       LYS  15 -20.152  -4.637  -0.924
  111   1HZ   LYS  15          1HZ       LYS  15 -17.902  -3.363   0.548
  112   2HZ   LYS  15          2HZ       LYS  15 -17.832  -4.943  -0.072
  113   3HZ   LYS  15          3HZ       LYS  15 -18.968  -4.548   1.129
  114    H    ALA  16           H        ALA  16 -15.407  -0.595  -2.302
  115    HA   ALA  16           HA       ALA  16 -15.878   2.081  -3.424
  116   1HB   ALA  16          1HB       ALA  16 -14.606   0.831  -1.020
  117   2HB   ALA  16          2HB       ALA  16 -15.817   2.110  -1.104
  118   3HB   ALA  16          3HB       ALA  16 -14.125   2.475  -1.441
  119    H    ARG  17           H        ARG  17 -13.621   3.464  -3.346
  120    HA   ARG  17           HA       ARG  17 -11.383   1.952  -4.550
  121   1HB   ARG  17          1HB       ARG  17 -13.328   3.690  -6.004
  122   2HB   ARG  17          2HB       ARG  17 -11.634   3.788  -6.488
  123   1HG   ARG  17          1HG       ARG  17 -11.773   1.162  -6.465
  124   2HG   ARG  17          2HG       ARG  17 -13.509   1.441  -6.603
  125   1HD   ARG  17          1HD       ARG  17 -11.407   2.583  -8.485
  126   2HD   ARG  17          2HD       ARG  17 -12.474   1.210  -8.846
  127    HE   ARG  17           HE       ARG  17 -14.361   2.943  -8.264
  128   1HH1  ARG  17          1HH2      ARG  17 -13.564   3.065 -11.099
  129   2HH1  ARG  17          2HH2      ARG  17 -13.127   4.727 -11.311
  130   1HH2  ARG  17          1HH1      ARG  17 -12.823   5.359  -7.916
  131   2HH2  ARG  17          2HH1      ARG  17 -12.708   6.026  -9.509
  132    H    ILE  18           H        ILE  18 -10.549   2.944  -2.440
  133    HA   ILE  18           HA       ILE  18 -10.088   5.868  -2.523
  134    HB   ILE  18           HB       ILE  18  -9.506   3.625  -0.570
  135   1HG1  ILE  18          1HG1      ILE  18 -11.348   6.037  -0.553
  136   2HG1  ILE  18          2HG1      ILE  18 -11.832   4.345  -0.662
  137   1HG2  ILE  18          1HG2      ILE  18  -8.903   5.632   0.961
  138   2HG2  ILE  18          2HG2      ILE  18  -8.659   6.522  -0.541
  139   3HG2  ILE  18          3HG2      ILE  18  -7.688   5.090  -0.197
  140   1HD1  ILE  18          1HD1      ILE  18 -11.045   3.903   1.574
  141   2HD1  ILE  18          2HD1      ILE  18 -12.037   5.359   1.651
  142   3HD1  ILE  18          3HD1      ILE  18 -10.278   5.488   1.675
  143    H    ILE  19           H        ILE  19  -7.789   6.638  -2.194
  144    HA   ILE  19           HA       ILE  19  -5.936   5.011  -3.875
  145    HB   ILE  19           HB       ILE  19  -5.977   7.946  -3.107
  146   1HG1  ILE  19          1HG1      ILE  19  -7.856   7.424  -4.538
  147   2HG1  ILE  19          2HG1      ILE  19  -6.627   8.201  -5.537
  148   1HG2  ILE  19          1HG2      ILE  19  -4.455   6.942  -5.453
  149   2HG2  ILE  19          2HG2      ILE  19  -3.786   6.556  -3.868
  150   3HG2  ILE  19          3HG2      ILE  19  -4.058   8.237  -4.324
  151   1HD1  ILE  19          1HD1      ILE  19  -7.495   5.332  -5.476
  152   2HD1  ILE  19          2HD1      ILE  19  -5.823   5.698  -5.903
  153   3HD1  ILE  19          3HD1      ILE  19  -7.145   6.365  -6.863
  154    H    ARG  20           H        ARG  20  -5.071   3.648  -2.208
  155    HA   ARG  20           HA       ARG  20  -3.784   4.958   0.134
  156   1HB   ARG  20          1HB       ARG  20  -4.366   2.119  -0.731
  157   2HB   ARG  20          2HB       ARG  20  -3.367   2.474   0.677
  158   1HG   ARG  20          1HG       ARG  20  -6.125   3.660   0.325
  159   2HG   ARG  20          2HG       ARG  20  -5.869   2.102   1.108
  160   1HD   ARG  20          1HD       ARG  20  -5.224   3.121   3.029
  161   2HD   ARG  20          2HD       ARG  20  -4.032   4.107   2.156
  162    HE   ARG  20           HE       ARG  20  -6.925   4.833   1.990
  163   1HH1  ARG  20          1HH2      ARG  20  -4.686   6.559   0.917
  164   2HH1  ARG  20          2HH2      ARG  20  -4.535   7.749   2.166
  165   1HH2  ARG  20          1HH1      ARG  20  -6.313   5.905   4.504
  166   2HH2  ARG  20          2HH1      ARG  20  -5.455   7.379   4.198
  167    H    TYR  21           H        TYR  21  -1.509   3.830   0.638
  168    HA   TYR  21           HA       TYR  21   0.101   3.995  -1.891
  169   1HB   TYR  21          1HB       TYR  21   0.607   4.758   0.988
  170   2HB   TYR  21          2HB       TYR  21   1.917   4.638  -0.187
  171    HD1  TYR  21           1HD      TYR  21   2.205   6.279  -1.918
  172    HD2  TYR  21           2HD      TYR  21  -1.222   6.391   0.665
  173    HE1  TYR  21           1HE      TYR  21   1.654   8.551  -2.753
  174    HE2  TYR  21           2HE      TYR  21  -1.777   8.665  -0.169
  175    HH   TYR  21           HH       TYR  21  -0.444   9.980  -2.937
  176    H    PHE  22           H        PHE  22   1.836   2.523  -2.142
  177    HA   PHE  22           HA       PHE  22   2.132   0.331  -0.152
  178   1HB   PHE  22          1HB       PHE  22   1.640  -1.353  -1.767
  179   2HB   PHE  22          2HB       PHE  22   0.373  -0.156  -1.954
  180    HD1  PHE  22           1HD      PHE  22   0.504   1.527  -3.827
  181    HD2  PHE  22           2HD      PHE  22   3.199  -1.807  -3.517
  182    HE1  PHE  22           1HE      PHE  22   1.139   1.818  -6.207
  183    HE2  PHE  22           2HE      PHE  22   3.835  -1.514  -5.897
  184    HZ   PHE  22           HZ       PHE  22   2.804   0.298  -7.243
  185    H    TYR  23           H        TYR  23   4.188  -0.751  -0.402
  186    HA   TYR  23           HA       TYR  23   6.302   0.991  -1.408
  187   1HB   TYR  23          1HB       TYR  23   6.549  -0.391   0.607
  188   2HB   TYR  23          2HB       TYR  23   6.318  -1.859  -0.350
  189    HD1  TYR  23           1HD      TYR  23   8.306   1.286  -0.857
  190    HD2  TYR  23           2HD      TYR  23   8.368  -2.991  -0.619
  191    HE1  TYR  23           1HE      TYR  23  10.718   1.292  -1.427
  192    HE2  TYR  23           2HE      TYR  23  10.777  -2.991  -1.182
  193    HH   TYR  23           HH       TYR  23  12.503   0.056  -1.848
  194    H    ASN  24           H        ASN  24   6.280   1.110  -3.719
  195    HA   ASN  24           HA       ASN  24   5.961  -1.275  -5.370
  196   1HB   ASN  24          1HB       ASN  24   5.352   1.025  -6.087
  197   2HB   ASN  24          2HB       ASN  24   7.044   1.498  -5.985
  198   1HD2  ASN  24          1HD2      ASN  24   5.391   1.486  -8.441
  199   2HD2  ASN  24          2HD2      ASN  24   6.124   0.393  -9.512
  200    H    ALA  25           H        ALA  25   7.752  -2.415  -4.015
  201    HA   ALA  25           HA       ALA  25  10.454  -1.730  -4.003
  202   1HB   ALA  25          1HB       ALA  25   9.620  -3.684  -2.883
  203   2HB   ALA  25          2HB       ALA  25  10.767  -4.260  -4.095
  204   3HB   ALA  25          3HB       ALA  25   9.032  -4.374  -4.396
  205    H    LYS  26           H        LYS  26   8.452  -2.652  -6.700
  206    HA   LYS  26           HA       LYS  26  10.584  -3.304  -8.554
  207   1HB   LYS  26          1HB       LYS  26   7.710  -3.112  -8.448
  208   2HB   LYS  26          2HB       LYS  26   8.286  -2.248  -9.874
  209   1HG   LYS  26          1HG       LYS  26   9.624  -4.250 -10.506
  210   2HG   LYS  26          2HG       LYS  26   8.966  -5.106  -9.111
  211   1HD   LYS  26          1HD       LYS  26   7.616  -5.748 -10.984
  212   2HD   LYS  26          2HD       LYS  26   6.652  -4.596 -10.060
  213   1HE   LYS  26          1HE       LYS  26   6.512  -3.980 -12.417
  214   2HE   LYS  26          2HE       LYS  26   7.537  -2.777 -11.609
  215   1HZ   LYS  26          1HZ       LYS  26   8.680  -5.257 -12.746
  216   2HZ   LYS  26          2HZ       LYS  26   9.463  -3.790 -12.399
  217   3HZ   LYS  26          3HZ       LYS  26   8.419  -3.904 -13.735
  218    H    ALA  27           H        ALA  27   8.961  -0.355  -7.488
  219    HA   ALA  27           HA       ALA  27  10.360   1.299  -9.518
  220   1HB   ALA  27          1HB       ALA  27   8.009   1.733  -8.984
  221   2HB   ALA  27          2HB       ALA  27   8.983   3.091  -8.419
  222   3HB   ALA  27          3HB       ALA  27   8.399   1.885  -7.271
  223    H    GLY  28           H        GLY  28  10.653   0.299  -6.195
  224   1HA   GLY  28          1HA       GLY  28  12.687   0.545  -4.927
  225   2HA   GLY  28          2HA       GLY  28  13.133   1.905  -5.953
  226    H    LEU  29           H        LEU  29   9.904   2.225  -5.105
  227    HA   LEU  29           HA       LEU  29  10.434   3.566  -2.518
  228   1HB   LEU  29          1HB       LEU  29   9.589   5.707  -3.401
  229   2HB   LEU  29          2HB       LEU  29  10.998   5.181  -4.321
  230    HG   LEU  29           HG       LEU  29   8.549   4.079  -5.434
  231   1HD1  LEU  29          1HD1      LEU  29   8.254   6.678  -4.385
  232   2HD1  LEU  29          2HD1      LEU  29   7.186   5.871  -5.535
  233   3HD1  LEU  29          3HD1      LEU  29   8.499   6.894  -6.118
  234   1HD2  LEU  29          1HD2      LEU  29   9.875   4.259  -7.249
  235   2HD2  LEU  29          2HD2      LEU  29  11.094   5.043  -6.244
  236   3HD2  LEU  29          3HD2      LEU  29   9.893   6.015  -7.094
  237    H    CYS  30           H        CYS  30   7.869   5.089  -3.049
  238    HA   CYS  30           HA       CYS  30   5.964   2.785  -2.798
  239   1HB   CYS  30          1HB       CYS  30   6.109   5.415  -1.294
  240   2HB   CYS  30          2HB       CYS  30   4.793   4.255  -1.134
  241    H    GLN  31           H        GLN  31   3.921   3.095  -3.741
  242    HA   GLN  31           HA       GLN  31   3.475   5.646  -5.238
  243   1HB   GLN  31          1HB       GLN  31   3.604   2.798  -6.197
  244   2HB   GLN  31          2HB       GLN  31   2.548   3.940  -7.030
  245   1HG   GLN  31          1HG       GLN  31   4.616   5.495  -7.096
  246   2HG   GLN  31          2HG       GLN  31   5.548   4.053  -6.694
  247   1HE2  GLN  31          1HE2      GLN  31   6.523   3.495  -8.676
  248   2HE2  GLN  31          2HE2      GLN  31   5.675   3.266 -10.128
  249    H    THR  32           H        THR  32   1.050   5.477  -6.145
  250    HA   THR  32           HA       THR  32  -0.605   4.669  -3.801
  251    HB   THR  32           HB       THR  32  -2.259   6.158  -5.215
  252    HG1  THR  32           1HG      THR  32  -0.696   7.731  -6.295
  253   1HG2  THR  32          1HG2      THR  32  -0.894   6.661  -3.043
  254   2HG2  THR  32          2HG2      THR  32  -1.575   8.008  -3.956
  255   3HG2  THR  32          3HG2      THR  32   0.135   7.608  -4.119
  256    H    PHE  33           H        PHE  33  -2.345   3.274  -4.036
  257    HA   PHE  33           HA       PHE  33  -2.829   2.112  -6.752
  258   1HB   PHE  33          1HB       PHE  33  -2.685  -0.090  -5.850
  259   2HB   PHE  33          2HB       PHE  33  -1.308   0.769  -5.177
  260    HD1  PHE  33           1HD      PHE  33  -4.620  -0.661  -4.470
  261    HD2  PHE  33           2HD      PHE  33  -1.230   1.394  -2.808
  262    HE1  PHE  33           1HE      PHE  33  -5.425  -1.177  -2.182
  263    HE2  PHE  33           2HE      PHE  33  -2.044   0.890  -0.527
  264    HZ   PHE  33           HZ       PHE  33  -4.137  -0.401  -0.211
  265    H    VAL  34           H        VAL  34  -4.991   1.035  -6.855
  266    HA   VAL  34           HA       VAL  34  -7.018   2.713  -5.624
  267    HB   VAL  34           HB       VAL  34  -7.156   0.168  -7.272
  268   1HG1  VAL  34          1HG1      VAL  34  -9.408   1.902  -7.604
  269   2HG1  VAL  34          2HG1      VAL  34  -9.192   1.607  -5.879
  270   3HG1  VAL  34          3HG1      VAL  34  -9.386   0.249  -6.988
  271   1HG2  VAL  34          1HG2      VAL  34  -6.997   1.487  -9.145
  272   2HG2  VAL  34          2HG2      VAL  34  -6.108   2.543  -8.045
  273   3HG2  VAL  34          3HG2      VAL  34  -7.812   2.850  -8.378
  274    H    TYR  35           H        TYR  35  -7.056   2.379  -3.368
  275    HA   TYR  35           HA       TYR  35  -7.158  -0.314  -2.220
  276   1HB   TYR  35          1HB       TYR  35  -6.106   1.550  -1.047
  277   2HB   TYR  35          2HB       TYR  35  -7.596   2.487  -1.129
  278    HD1  TYR  35           1HD      TYR  35  -7.212  -1.151  -0.407
  279    HD2  TYR  35           2HD      TYR  35  -8.191   2.730   1.157
  280    HE1  TYR  35           1HE      TYR  35  -7.994  -2.198   1.704
  281    HE2  TYR  35           2HE      TYR  35  -8.970   1.684   3.266
  282    HH   TYR  35           HH       TYR  35  -9.830  -1.295   3.630
  283    H    GLY  36           H        GLY  36  -9.053  -1.321  -1.387
  284   1HA   GLY  36          1HA       GLY  36 -11.580  -0.410  -2.572
  285   2HA   GLY  36          2HA       GLY  36 -11.340  -1.903  -1.665
  286    H    ALA  37           H        ALA  37  -9.950   0.507   0.125
  287    HA   ALA  37           HA       ALA  37 -10.690   1.907   1.899
  288   1HB   ALA  37          1HB       ALA  37 -12.787   2.782   1.690
  289   2HB   ALA  37          2HB       ALA  37 -13.541   1.192   1.580
  290   3HB   ALA  37          3HB       ALA  37 -12.793   1.914   0.156
  291    H    CYS  38           H        CYS  38 -11.924  -1.363   1.469
  292    HA   CYS  38           HA       CYS  38 -11.820  -1.714   4.439
  293   1HB   CYS  38          1HB       CYS  38 -13.584  -3.635   3.597
  294   2HB   CYS  38          2HB       CYS  38 -14.069  -2.053   4.190
  295    H    ARG  39           H        ARG  39 -11.504  -4.119   4.982
  296    HA   ARG  39           HA       ARG  39 -10.152  -6.047   4.820
  297   1HB   ARG  39          1HB       ARG  39 -10.928  -5.478   1.950
  298   2HB   ARG  39          2HB       ARG  39 -10.045  -6.929   2.422
  299   1HG   ARG  39          1HG       ARG  39 -12.518  -6.232   3.952
  300   2HG   ARG  39          2HG       ARG  39 -12.712  -6.898   2.330
  301   1HD   ARG  39          1HD       ARG  39 -11.634  -8.928   2.917
  302   2HD   ARG  39          2HD       ARG  39 -10.892  -8.213   4.362
  303    HE   ARG  39           HE       ARG  39 -13.796  -8.053   4.426
  304   1HH1  ARG  39          1HH2      ARG  39 -11.912  -8.654   6.744
  305   2HH1  ARG  39          2HH2      ARG  39 -12.332 -10.297   7.100
  306   1HH2  ARG  39          1HH1      ARG  39 -13.986 -10.803   4.095
  307   2HH2  ARG  39          2HH1      ARG  39 -13.506 -11.514   5.600
  308    H    ALA  40           H        ALA  40  -8.849  -3.383   4.803
  309    HA   ALA  40           HA       ALA  40  -6.690  -3.352   2.877
  310   1HB   ALA  40          1HB       ALA  40  -5.919  -1.968   5.195
  311   2HB   ALA  40          2HB       ALA  40  -7.679  -1.864   5.172
  312   3HB   ALA  40          3HB       ALA  40  -6.744  -1.284   3.794
  313    H    LYS  41           H        LYS  41  -4.377  -3.715   3.454
  314    HA   LYS  41           HA       LYS  41  -3.980  -5.647   5.706
  315   1HB   LYS  41          1HB       LYS  41  -3.039  -5.924   2.832
  316   2HB   LYS  41          2HB       LYS  41  -2.675  -7.053   4.137
  317   1HG   LYS  41          1HG       LYS  41  -5.056  -7.548   4.411
  318   2HG   LYS  41          2HG       LYS  41  -5.468  -6.351   3.184
  319   1HD   LYS  41          1HD       LYS  41  -5.498  -8.453   2.056
  320   2HD   LYS  41          2HD       LYS  41  -3.973  -7.695   1.593
  321   1HE   LYS  41          1HE       LYS  41  -3.139  -9.004   3.803
  322   2HE   LYS  41          2HE       LYS  41  -4.458 -10.084   3.310
  323   1HZ   LYS  41          1HZ       LYS  41  -2.041 -10.202   2.233
  324   2HZ   LYS  41          2HZ       LYS  41  -2.721  -9.030   1.210
  325   3HZ   LYS  41          3HZ       LYS  41  -3.442 -10.561   1.347
  326    H    ARG  42           H        ARG  42  -1.266  -6.157   5.151
  327    HA   ARG  42           HA       ARG  42   0.014  -3.845   6.275
  328   1HB   ARG  42          1HB       ARG  42   1.986  -5.213   6.105
  329   2HB   ARG  42          2HB       ARG  42   0.656  -6.287   6.490
  330   1HG   ARG  42          1HG       ARG  42   0.480  -6.393   3.828
  331   2HG   ARG  42          2HG       ARG  42   2.192  -6.006   3.960
  332   1HD   ARG  42          1HD       ARG  42   1.860  -8.469   3.974
  333   2HD   ARG  42          2HD       ARG  42   2.441  -7.936   5.563
  334    HE   ARG  42           HE       ARG  42  -0.485  -7.977   5.183
  335   1HH1  ARG  42          1HH2      ARG  42   2.075  -8.671   7.229
  336   2HH1  ARG  42          2HH2      ARG  42   1.367 -10.088   7.928
  337   1HH2  ARG  42          1HH1      ARG  42  -1.289 -10.188   5.701
  338   2HH2  ARG  42          2HH1      ARG  42  -0.538 -10.945   7.066
  339    H    ASN  43           H        ASN  43  -0.304  -4.986   2.912
  340    HA   ASN  43           HA       ASN  43   1.591  -2.903   1.989
  341   1HB   ASN  43          1HB       ASN  43   1.193  -5.371   1.118
  342   2HB   ASN  43          2HB       ASN  43  -0.097  -4.609   0.185
  343   1HD2  ASN  43          1HD2      ASN  43   3.430  -4.294   0.876
  344   2HD2  ASN  43          2HD2      ASN  43   3.820  -3.603  -0.625
  345    H    ASN  44           H        ASN  44  -0.209  -1.457   3.143
  346    HA   ASN  44           HA       ASN  44  -1.668  -0.091   0.993
  347   1HB   ASN  44          1HB       ASN  44  -3.216  -1.895   1.557
  348   2HB   ASN  44          2HB       ASN  44  -3.043  -1.555   3.277
  349   1HD2  ASN  44          1HD2      ASN  44  -5.618  -1.497   2.157
  350   2HD2  ASN  44          2HD2      ASN  44  -6.184   0.114   2.096
  351    H    PHE  45           H        PHE  45   0.053   1.403   1.944
  352    HA   PHE  45           HA       PHE  45  -0.414   2.395   4.671
  353   1HB   PHE  45          1HB       PHE  45   1.416   3.464   2.501
  354   2HB   PHE  45          2HB       PHE  45   1.617   3.615   4.248
  355    HD1  PHE  45           1HD      PHE  45   2.217   1.552   1.331
  356    HD2  PHE  45           2HD      PHE  45   2.022   1.497   5.623
  357    HE1  PHE  45           1HE      PHE  45   3.456  -0.599   1.357
  358    HE2  PHE  45           2HE      PHE  45   3.261  -0.655   5.651
  359    HZ   PHE  45           HZ       PHE  45   3.976  -1.717   3.517
  360    H    LYS  46           H        LYS  46  -1.569   4.224   5.171
  361    HA   LYS  46           HA       LYS  46  -3.342   5.436   3.276
  362   1HB   LYS  46          1HB       LYS  46  -2.376   6.527   5.934
  363   2HB   LYS  46          2HB       LYS  46  -3.936   6.823   5.164
  364   1HG   LYS  46          1HG       LYS  46  -4.109   4.180   5.246
  365   2HG   LYS  46          2HG       LYS  46  -2.937   4.358   6.553
  366   1HD   LYS  46          1HD       LYS  46  -4.431   5.783   7.795
  367   2HD   LYS  46          2HD       LYS  46  -5.538   5.909   6.427
  368   1HE   LYS  46          1HE       LYS  46  -6.213   3.619   6.646
  369   2HE   LYS  46          2HE       LYS  46  -4.874   3.260   7.753
  370   1HZ   LYS  46          1HZ       LYS  46  -5.811   4.629   9.402
  371   2HZ   LYS  46          2HZ       LYS  46  -7.129   3.745   8.796
  372   3HZ   LYS  46          3HZ       LYS  46  -6.893   5.359   8.320
  373    H    SER  47           H        SER  47  -0.021   6.046   4.001
  374    HA   SER  47           HA       SER  47  -0.061   8.377   2.160
  375   1HB   SER  47          1HB       SER  47   1.090   9.772   3.806
  376   2HB   SER  47          2HB       SER  47  -0.418   9.182   4.497
  377    HG   SER  47           HG       SER  47   1.146   7.331   5.152
  378    H    ALA  48           H        ALA  48   2.133   8.908   1.399
  379    HA   ALA  48           HA       ALA  48   3.771   6.610   0.870
  380   1HB   ALA  48          1HB       ALA  48   5.181   8.234  -0.230
  381   2HB   ALA  48          2HB       ALA  48   4.539   9.543   0.762
  382   3HB   ALA  48          3HB       ALA  48   3.514   8.769  -0.447
  383    H    GLU  49           H        GLU  49   3.657   8.843   3.529
  384    HA   GLU  49           HA       GLU  49   6.387   8.519   4.455
  385   1HB   GLU  49          1HB       GLU  49   3.995   9.960   5.088
  386   2HB   GLU  49          2HB       GLU  49   4.549   9.154   6.556
  387   1HG   GLU  49          1HG       GLU  49   6.458  10.411   6.675
  388   2HG   GLU  49          2HG       GLU  49   6.655  10.462   4.923
  389    H    ASP  50           H        ASP  50   3.343   6.810   5.001
  390    HA   ASP  50           HA       ASP  50   4.350   5.212   7.227
  391   1HB   ASP  50          1HB       ASP  50   1.907   5.466   5.541
  392   2HB   ASP  50          2HB       ASP  50   2.158   3.909   6.330
  393    H    CYS  51           H        CYS  51   4.049   4.856   3.725
  394    HA   CYS  51           HA       CYS  51   4.757   2.032   3.634
  395   1HB   CYS  51          1HB       CYS  51   3.525   3.097   1.834
  396   2HB   CYS  51          2HB       CYS  51   4.777   4.324   1.639
  397    H    MET  52           H        MET  52   6.514   5.100   3.133
  398    HA   MET  52           HA       MET  52   9.084   3.873   2.613
  399   1HB   MET  52          1HB       MET  52   8.195   6.225   2.064
  400   2HB   MET  52          2HB       MET  52   8.521   6.624   3.752
  401   1HG   MET  52          1HG       MET  52  10.425   7.244   2.300
  402   2HG   MET  52          2HG       MET  52  10.884   5.986   3.447
  403   1HE   MET  52          1HE       MET  52   9.042   6.611   0.406
  404   2HE   MET  52          2HE       MET  52   9.198   5.183  -0.616
  405   3HE   MET  52          3HE       MET  52  10.385   6.479  -0.738
  406    H    ARG  53           H        ARG  53   7.571   5.306   5.516
  407    HA   ARG  53           HA       ARG  53   9.760   4.967   7.310
  408   1HB   ARG  53          1HB       ARG  53   7.831   6.337   7.832
  409   2HB   ARG  53          2HB       ARG  53   6.746   4.957   7.658
  410   1HG   ARG  53          1HG       ARG  53   7.597   3.919   9.631
  411   2HG   ARG  53          2HG       ARG  53   8.983   5.007   9.694
  412   1HD   ARG  53          1HD       ARG  53   7.643   6.094  11.240
  413   2HD   ARG  53          2HD       ARG  53   6.952   6.821   9.776
  414    HE   ARG  53           HE       ARG  53   5.543   4.477   9.986
  415   1HH1  ARG  53          1HH2      ARG  53   4.167   7.016  10.633
  416   2HH1  ARG  53          2HH2      ARG  53   3.700   6.791  12.285
  417   1HH2  ARG  53          1HH1      ARG  53   5.883   4.149  12.819
  418   2HH2  ARG  53          2HH1      ARG  53   4.673   5.168  13.523
  419    H    THR  54           H        THR  54   7.467   2.695   5.976
  420    HA   THR  54           HA       THR  54   8.021   0.605   7.976
  421    HB   THR  54           HB       THR  54   6.413   0.843   5.423
  422    HG1  THR  54           1HG      THR  54   4.896   0.081   7.283
  423   1HG2  THR  54          1HG2      THR  54   5.726  -1.557   6.716
  424   2HG2  THR  54          2HG2      THR  54   7.488  -1.558   6.632
  425   3HG2  THR  54          3HG2      THR  54   6.535  -1.385   5.157
  426    H    CYS  55           H        CYS  55   8.592   1.028   4.455
  427    HA   CYS  55           HA       CYS  55  10.999  -0.740   4.753
  428   1HB   CYS  55          1HB       CYS  55   8.844  -0.775   2.616
  429   2HB   CYS  55          2HB       CYS  55  10.317  -1.747   2.569
  430    H    GLY  56           H        GLY  56  11.180   2.058   4.762
  431   1HA   GLY  56          1HA       GLY  56  11.979   2.768   1.979
  432   2HA   GLY  56          2HA       GLY  56  11.693   3.928   3.277
  433    H    GLY  57           H        GLY  57  13.910   4.697   2.569
  434   1HA   GLY  57          1HA       GLY  57  16.002   4.835   3.946
  435   2HA   GLY  57          2HA       GLY  57  16.026   3.071   3.926
  436    H    ALA  58           H        ALA  58  15.156   4.978   1.103
  437    HA   ALA  58           HA       ALA  58  17.764   4.184  -0.154
  438   1HB   ALA  58          1HB       ALA  58  14.971   3.636  -0.811
  439   2HB   ALA  58          2HB       ALA  58  16.433   2.883  -1.447
  440   3HB   ALA  58          3HB       ALA  58  15.828   4.378  -2.162
  Start of MODEL    4
    1   1H    ARG   1          1H        ARG   1  14.427  -4.811   7.749
    2   2H    ARG   1          2H        ARG   1  14.349  -5.272   6.116
    3   3H    ARG   1          3H        ARG   1  13.851  -6.351   7.329
    4    HA   ARG   1           HA       ARG   1  12.246  -4.278   7.861
    5   1HB   ARG   1          1HB       ARG   1  11.768  -3.083   5.900
    6   2HB   ARG   1          2HB       ARG   1  13.502  -3.348   5.738
    7   1HG   ARG   1          1HG       ARG   1  12.991  -5.403   4.383
    8   2HG   ARG   1          2HG       ARG   1  11.286  -4.960   4.439
    9   1HD   ARG   1          1HD       ARG   1  11.576  -3.166   2.994
   10   2HD   ARG   1          2HD       ARG   1  13.245  -2.878   3.530
   11    HE   ARG   1           HE       ARG   1  12.363  -4.957   1.589
   12   1HH1  ARG   1          1HH1      ARG   1  14.497  -5.996   3.457
   13   2HH1  ARG   1          2HH1      ARG   1  15.943  -5.594   2.594
   14   1HH2  ARG   1          1HH2      ARG   1  14.371  -3.345   0.473
   15   2HH2  ARG   1          2HH2      ARG   1  15.873  -4.093   0.904
   16    HA   PRO   2           HA       PRO   2   9.326  -7.497   7.276
   17   1HB   PRO   2          1HB       PRO   2   7.079  -6.146   6.492
   18   2HB   PRO   2          2HB       PRO   2   7.687  -6.143   8.155
   19   1HG   PRO   2          1HG       PRO   2   8.012  -4.104   5.992
   20   2HG   PRO   2          2HG       PRO   2   7.681  -3.868   7.716
   21   1HD   PRO   2          1HD       PRO   2  10.145  -3.547   6.625
   22   2HD   PRO   2          2HD       PRO   2   9.902  -4.110   8.293
   23    H    ASP   3           H        ASP   3   8.046  -8.668   5.657
   24    HA   ASP   3           HA       ASP   3   9.121  -8.283   2.934
   25   1HB   ASP   3          1HB       ASP   3   8.254 -10.519   2.600
   26   2HB   ASP   3          2HB       ASP   3   9.007 -10.478   4.195
   27    H    PHE   4           H        PHE   4   6.164  -7.697   4.713
   28    HA   PHE   4           HA       PHE   4   4.344  -7.756   2.474
   29   1HB   PHE   4          1HB       PHE   4   2.837  -6.624   3.973
   30   2HB   PHE   4          2HB       PHE   4   3.772  -7.765   4.931
   31    HD1  PHE   4           1HD      PHE   4   3.847  -4.150   3.831
   32    HD2  PHE   4           2HD      PHE   4   4.829  -7.044   6.860
   33    HE1  PHE   4           1HE      PHE   4   4.597  -2.339   5.333
   34    HE2  PHE   4           2HE      PHE   4   5.578  -5.215   8.355
   35    HZ   PHE   4           HZ       PHE   4   5.456  -2.861   7.585
   36    H    CYS   5           H        CYS   5   6.869  -5.622   3.300
   37    HA   CYS   5           HA       CYS   5   5.761  -3.218   2.070
   38   1HB   CYS   5          1HB       CYS   5   8.304  -4.172   3.298
   39   2HB   CYS   5          2HB       CYS   5   8.404  -2.773   2.226
   40    H    LEU   6           H        LEU   6   7.491  -6.049   0.939
   41    HA   LEU   6           HA       LEU   6   8.233  -4.724  -1.617
   42   1HB   LEU   6          1HB       LEU   6   8.532  -7.627  -0.798
   43   2HB   LEU   6          2HB       LEU   6   9.482  -6.738  -1.989
   44    HG   LEU   6           HG       LEU   6   9.411  -6.080   0.970
   45   1HD1  LEU   6          1HD1      LEU   6  11.953  -6.954   0.374
   46   2HD1  LEU   6          2HD1      LEU   6  10.952  -8.051  -0.577
   47   3HD1  LEU   6          3HD1      LEU   6  10.713  -7.928   1.165
   48   1HD2  LEU   6          1HD2      LEU   6  10.195  -4.560  -1.241
   49   2HD2  LEU   6          2HD2      LEU   6  11.708  -5.224  -0.619
   50   3HD2  LEU   6          3HD2      LEU   6  10.662  -4.271   0.435
   51    H    GLU   7           H        GLU   7   5.596  -6.378  -0.263
   52    HA   GLU   7           HA       GLU   7   4.663  -7.782  -2.642
   53   1HB   GLU   7          1HB       GLU   7   3.886  -7.267   0.147
   54   2HB   GLU   7          2HB       GLU   7   2.509  -7.367  -0.950
   55   1HG   GLU   7          1HG       GLU   7   2.785  -9.598  -1.248
   56   2HG   GLU   7          2HG       GLU   7   4.531  -9.437  -1.442
   57    HA   PRO   8           HA       PRO   8   2.671  -4.401  -4.633
   58   1HB   PRO   8          1HB       PRO   8   0.586  -5.704  -5.842
   59   2HB   PRO   8          2HB       PRO   8   2.266  -5.835  -6.401
   60   1HG   PRO   8          1HG       PRO   8   0.644  -7.719  -4.758
   61   2HG   PRO   8          2HG       PRO   8   1.829  -8.063  -6.025
   62   1HD   PRO   8          1HD       PRO   8   2.334  -8.256  -3.330
   63   2HD   PRO   8          2HD       PRO   8   3.584  -7.972  -4.561
   64    HA   PRO   9           HA       PRO   9  -0.775  -3.034  -2.270
   65   1HB   PRO   9          1HB       PRO   9  -2.426  -1.868  -4.118
   66   2HB   PRO   9          2HB       PRO   9  -0.893  -1.145  -3.594
   67   1HG   PRO   9          1HG       PRO   9  -1.538  -2.683  -6.066
   68   2HG   PRO   9          2HG       PRO   9  -0.490  -1.272  -5.856
   69   1HD   PRO   9          1HD       PRO   9   0.420  -3.852  -6.090
   70   2HD   PRO   9          2HD       PRO   9   1.308  -2.557  -5.256
   71    H    TYR  10           H        TYR  10  -3.394  -3.058  -2.354
   72    HA   TYR  10           HA       TYR  10  -4.474  -5.452  -3.729
   73   1HB   TYR  10          1HB       TYR  10  -3.228  -6.092  -1.574
   74   2HB   TYR  10          2HB       TYR  10  -4.511  -5.243  -0.712
   75    HD1  TYR  10           1HD      TYR  10  -6.069  -6.716   0.187
   76    HD2  TYR  10           2HD      TYR  10  -4.416  -7.530  -3.694
   77    HE1  TYR  10           1HE      TYR  10  -7.530  -8.708  -0.017
   78    HE2  TYR  10           2HE      TYR  10  -5.878  -9.524  -3.898
   79    HH   TYR  10           HH       TYR  10  -7.101 -11.057  -2.494
   80    H    THR  11           H        THR  11  -6.012  -4.021  -4.664
   81    HA   THR  11           HA       THR  11  -7.572  -2.071  -3.343
   82    HB   THR  11           HB       THR  11  -7.927  -3.934  -5.686
   83    HG1  THR  11           1HG      THR  11  -8.134  -1.751  -6.645
   84   1HG2  THR  11          1HG2      THR  11 -10.051  -2.487  -6.143
   85   2HG2  THR  11          2HG2      THR  11 -10.044  -2.225  -4.399
   86   3HG2  THR  11          3HG2      THR  11 -10.184  -3.861  -5.045
   87    H    GLY  12           H        GLY  12  -7.593  -5.541  -3.175
   88   1HA   GLY  12          1HA       GLY  12  -8.746  -6.956  -1.677
   89   2HA   GLY  12          2HA       GLY  12  -9.429  -5.516  -0.919
   90    HA   PRO  13           HA       PRO  13 -12.414  -7.672  -3.953
   91   1HB   PRO  13          1HB       PRO  13 -13.673  -9.440  -2.284
   92   2HB   PRO  13          2HB       PRO  13 -12.262  -9.875  -3.268
   93   1HG   PRO  13          1HG       PRO  13 -12.436  -9.177  -0.374
   94   2HG   PRO  13          2HG       PRO  13 -11.444 -10.402  -1.180
   95   1HD   PRO  13          1HD       PRO  13 -10.508  -7.961  -0.351
   96   2HD   PRO  13          2HD       PRO  13  -9.796  -8.891  -1.690
   97    H    CYS  14           H        CYS  14 -12.746  -5.231  -2.957
   98    HA   CYS  14           HA       CYS  14 -15.330  -5.306  -1.427
   99   1HB   CYS  14          1HB       CYS  14 -12.877  -3.567  -1.298
  100   2HB   CYS  14          2HB       CYS  14 -14.432  -2.927  -0.766
  101    H    LYS  15           H        LYS  15 -16.025  -2.638  -1.750
  102    HA   LYS  15           HA       LYS  15 -16.288  -2.350  -4.729
  103   1HB   LYS  15          1HB       LYS  15 -18.212  -2.208  -2.435
  104   2HB   LYS  15          2HB       LYS  15 -18.514  -1.185  -3.839
  105   1HG   LYS  15          1HG       LYS  15 -18.525  -3.116  -5.309
  106   2HG   LYS  15          2HG       LYS  15 -18.029  -4.175  -3.987
  107   1HD   LYS  15          1HD       LYS  15 -20.171  -3.375  -2.792
  108   2HD   LYS  15          2HD       LYS  15 -20.670  -2.758  -4.367
  109   1HE   LYS  15          1HE       LYS  15 -19.659  -5.565  -4.307
  110   2HE   LYS  15          2HE       LYS  15 -21.246  -5.272  -3.569
  111   1HZ   LYS  15          1HZ       LYS  15 -20.396  -5.001  -6.342
  112   2HZ   LYS  15          2HZ       LYS  15 -21.395  -3.754  -5.763
  113   3HZ   LYS  15          3HZ       LYS  15 -21.928  -5.367  -5.713
  114    H    ALA  16           H        ALA  16 -14.915  -1.009  -2.019
  115    HA   ALA  16           HA       ALA  16 -15.531   1.809  -2.469
  116   1HB   ALA  16          1HB       ALA  16 -13.157   0.721  -0.970
  117   2HB   ALA  16          2HB       ALA  16 -14.786   0.476  -0.339
  118   3HB   ALA  16          3HB       ALA  16 -14.169   2.110  -0.577
  119    H    ARG  17           H        ARG  17 -13.599   3.349  -2.845
  120    HA   ARG  17           HA       ARG  17 -11.490   2.239  -4.617
  121   1HB   ARG  17          1HB       ARG  17 -13.527   2.745  -5.991
  122   2HB   ARG  17          2HB       ARG  17 -13.428   4.423  -5.454
  123   1HG   ARG  17          1HG       ARG  17 -10.925   4.187  -6.325
  124   2HG   ARG  17          2HG       ARG  17 -11.633   2.911  -7.315
  125   1HD   ARG  17          1HD       ARG  17 -12.907   4.402  -8.550
  126   2HD   ARG  17          2HD       ARG  17 -13.075   5.536  -7.195
  127    HE   ARG  17           HE       ARG  17 -10.738   5.320  -9.015
  128   1HH1  ARG  17          1HH2      ARG  17 -12.403   7.788  -8.090
  129   2HH1  ARG  17          2HH2      ARG  17 -11.223   8.594  -7.109
  130   1HH2  ARG  17          1HH1      ARG  17  -9.113   5.849  -6.926
  131   2HH2  ARG  17          2HH1      ARG  17  -9.363   7.495  -6.450
  132    H    ILE  18           H        ILE  18 -10.522   3.055  -2.424
  133    HA   ILE  18           HA       ILE  18 -10.173   6.006  -2.337
  134    HB   ILE  18           HB       ILE  18  -9.064   3.871  -0.494
  135   1HG1  ILE  18          1HG1      ILE  18 -11.785   5.216  -0.448
  136   2HG1  ILE  18          2HG1      ILE  18 -11.475   3.501  -0.726
  137   1HG2  ILE  18          1HG2      ILE  18  -8.114   5.984   0.009
  138   2HG2  ILE  18          2HG2      ILE  18  -9.450   5.824   1.148
  139   3HG2  ILE  18          3HG2      ILE  18  -9.632   6.831  -0.290
  140   1HD1  ILE  18          1HD1      ILE  18 -11.843   4.817   1.764
  141   2HD1  ILE  18          2HD1      ILE  18 -10.150   4.324   1.693
  142   3HD1  ILE  18          3HD1      ILE  18 -11.428   3.125   1.492
  143    H    ILE  19           H        ILE  19  -7.899   6.828  -2.069
  144    HA   ILE  19           HA       ILE  19  -6.036   5.316  -3.853
  145    HB   ILE  19           HB       ILE  19  -6.269   8.220  -3.004
  146   1HG1  ILE  19          1HG1      ILE  19  -7.949   7.645  -4.622
  147   2HG1  ILE  19          2HG1      ILE  19  -6.665   8.463  -5.514
  148   1HG2  ILE  19          1HG2      ILE  19  -4.492   7.624  -5.245
  149   2HG2  ILE  19          2HG2      ILE  19  -3.936   6.888  -3.741
  150   3HG2  ILE  19          3HG2      ILE  19  -4.202   8.629  -3.825
  151   1HD1  ILE  19          1HD1      ILE  19  -7.255   5.500  -5.376
  152   2HD1  ILE  19          2HD1      ILE  19  -5.703   6.116  -5.944
  153   3HD1  ILE  19          3HD1      ILE  19  -7.185   6.530  -6.806
  154    H    ARG  20           H        ARG  20  -5.264   3.903  -2.106
  155    HA   ARG  20           HA       ARG  20  -3.930   5.173   0.208
  156   1HB   ARG  20          1HB       ARG  20  -4.532   2.378  -0.745
  157   2HB   ARG  20          2HB       ARG  20  -3.426   2.646   0.601
  158   1HG   ARG  20          1HG       ARG  20  -6.251   3.742   0.457
  159   2HG   ARG  20          2HG       ARG  20  -5.798   2.276   1.328
  160   1HD   ARG  20          1HD       ARG  20  -5.069   3.505   3.095
  161   2HD   ARG  20          2HD       ARG  20  -4.040   4.489   2.037
  162    HE   ARG  20           HE       ARG  20  -6.658   5.326   1.507
  163   1HH1  ARG  20          1HH1      ARG  20  -7.328   4.788   4.321
  164   2HH1  ARG  20          2HH1      ARG  20  -6.847   6.246   5.125
  165   1HH2  ARG  20          1HH2      ARG  20  -4.841   7.338   2.516
  166   2HH2  ARG  20          2HH2      ARG  20  -5.443   7.689   4.102
  167    H    TYR  21           H        TYR  21  -1.635   4.020   0.658
  168    HA   TYR  21           HA       TYR  21  -0.037   4.356  -1.856
  169   1HB   TYR  21          1HB       TYR  21   0.369   5.060   1.039
  170   2HB   TYR  21          2HB       TYR  21   1.764   4.864  -0.018
  171    HD1  TYR  21           1HD      TYR  21  -1.150   6.922   0.792
  172    HD2  TYR  21           2HD      TYR  21   2.086   6.345  -1.973
  173    HE1  TYR  21           1HE      TYR  21  -1.503   9.209  -0.097
  174    HE2  TYR  21           2HE      TYR  21   1.730   8.631  -2.865
  175    HH   TYR  21           HH       TYR  21  -1.023  10.580  -1.878
  176    H    PHE  22           H        PHE  22   1.665   2.878  -2.241
  177    HA   PHE  22           HA       PHE  22   2.007   0.618  -0.340
  178   1HB   PHE  22          1HB       PHE  22   1.378  -0.998  -1.941
  179   2HB   PHE  22          2HB       PHE  22   0.182   0.274  -2.155
  180    HD1  PHE  22           1HD      PHE  22   3.062  -1.448  -3.628
  181    HD2  PHE  22           2HD      PHE  22   0.299   1.811  -4.084
  182    HE1  PHE  22           1HE      PHE  22   3.711  -1.232  -6.014
  183    HE2  PHE  22           2HE      PHE  22   0.947   2.030  -6.468
  184    HZ   PHE  22           HZ       PHE  22   2.653   0.506  -7.435
  185    H    TYR  23           H        TYR  23   3.826  -0.902  -1.483
  186    HA   TYR  23           HA       TYR  23   6.090   0.953  -2.043
  187   1HB   TYR  23          1HB       TYR  23   6.027  -0.909  -0.292
  188   2HB   TYR  23          2HB       TYR  23   6.092  -2.043  -1.641
  189    HD1  TYR  23           1HD      TYR  23   8.164  -1.770   0.566
  190    HD2  TYR  23           2HD      TYR  23   7.926   0.035  -3.323
  191    HE1  TYR  23           1HE      TYR  23  10.626  -1.492   0.538
  192    HE2  TYR  23           2HE      TYR  23  10.377   0.277  -3.368
  193    HH   TYR  23           HH       TYR  23  12.308  -0.094  -0.592
  194    H    ASN  24           H        ASN  24   5.907   1.439  -4.292
  195    HA   ASN  24           HA       ASN  24   5.537  -0.735  -6.242
  196   1HB   ASN  24          1HB       ASN  24   4.753   1.672  -6.502
  197   2HB   ASN  24          2HB       ASN  24   6.443   2.133  -6.668
  198   1HD2  ASN  24          1HD2      ASN  24   4.222   2.214  -8.729
  199   2HD2  ASN  24          2HD2      ASN  24   4.793   1.285 -10.030
  200    H    ALA  25           H        ALA  25   7.538  -1.724  -4.934
  201    HA   ALA  25           HA       ALA  25  10.152  -0.788  -5.158
  202   1HB   ALA  25          1HB       ALA  25   9.126  -3.614  -5.609
  203   2HB   ALA  25          2HB       ALA  25   9.411  -2.876  -4.030
  204   3HB   ALA  25          3HB       ALA  25  10.765  -3.183  -5.119
  205    H    LYS  26           H        LYS  26   8.009  -1.966  -7.643
  206    HA   LYS  26           HA       LYS  26   9.941  -2.398  -9.733
  207   1HB   LYS  26          1HB       LYS  26   7.153  -2.532  -9.304
  208   2HB   LYS  26          2HB       LYS  26   7.370  -1.372 -10.615
  209   1HG   LYS  26          1HG       LYS  26   9.112  -3.288 -11.401
  210   2HG   LYS  26          2HG       LYS  26   7.939  -4.287 -10.542
  211   1HD   LYS  26          1HD       LYS  26   6.190  -2.847 -11.907
  212   2HD   LYS  26          2HD       LYS  26   7.562  -2.586 -12.985
  213   1HE   LYS  26          1HE       LYS  26   7.105  -4.612 -13.907
  214   2HE   LYS  26          2HE       LYS  26   7.570  -5.354 -12.362
  215   1HZ   LYS  26          1HZ       LYS  26   5.375  -5.982 -12.504
  216   2HZ   LYS  26          2HZ       LYS  26   4.905  -4.588 -13.353
  217   3HZ   LYS  26          3HZ       LYS  26   5.200  -4.509 -11.681
  218    H    ALA  27           H        ALA  27   8.186   0.429  -8.497
  219    HA   ALA  27           HA       ALA  27   9.334   2.205 -10.571
  220   1HB   ALA  27          1HB       ALA  27   7.004   2.431  -9.727
  221   2HB   ALA  27          2HB       ALA  27   7.949   3.882  -9.391
  222   3HB   ALA  27          3HB       ALA  27   7.633   2.719  -8.105
  223    H    GLY  28           H        GLY  28  10.063   1.035  -7.409
  224   1HA   GLY  28          1HA       GLY  28  12.173   1.334  -6.317
  225   2HA   GLY  28          2HA       GLY  28  12.459   2.761  -7.306
  226    H    LEU  29           H        LEU  29   9.322   2.751  -5.991
  227    HA   LEU  29           HA       LEU  29   9.999   3.920  -3.425
  228   1HB   LEU  29          1HB       LEU  29   9.581   6.168  -3.960
  229   2HB   LEU  29          2HB       LEU  29  10.476   5.601  -5.368
  230    HG   LEU  29           HG       LEU  29   7.462   5.844  -5.133
  231   1HD1  LEU  29          1HD1      LEU  29   8.668   7.245  -7.329
  232   2HD1  LEU  29          2HD1      LEU  29   9.495   7.694  -5.837
  233   3HD1  LEU  29          3HD1      LEU  29   7.750   7.906  -5.976
  234   1HD2  LEU  29          1HD2      LEU  29   7.738   4.008  -6.556
  235   2HD2  LEU  29          2HD2      LEU  29   9.280   4.596  -7.178
  236   3HD2  LEU  29          3HD2      LEU  29   7.773   5.348  -7.701
  237    H    CYS  30           H        CYS  30   7.816   5.037  -2.661
  238    HA   CYS  30           HA       CYS  30   5.727   2.995  -2.899
  239   1HB   CYS  30          1HB       CYS  30   6.003   5.594  -1.363
  240   2HB   CYS  30          2HB       CYS  30   4.627   4.506  -1.193
  241    H    GLN  31           H        GLN  31   3.612   3.393  -3.718
  242    HA   GLN  31           HA       GLN  31   3.192   5.951  -5.205
  243   1HB   GLN  31          1HB       GLN  31   3.161   3.108  -6.234
  244   2HB   GLN  31          2HB       GLN  31   2.312   4.402  -7.079
  245   1HG   GLN  31          1HG       GLN  31   4.873   5.427  -6.491
  246   2HG   GLN  31          2HG       GLN  31   5.140   3.783  -7.069
  247   1HE2  GLN  31          1HE2      GLN  31   6.073   4.854  -9.064
  248   2HE2  GLN  31          2HE2      GLN  31   5.013   5.416 -10.266
  249    H    THR  32           H        THR  32   0.819   6.065  -5.938
  250    HA   THR  32           HA       THR  32  -0.889   5.164  -3.708
  251    HB   THR  32           HB       THR  32  -2.547   6.627  -5.002
  252    HG1  THR  32           1HG      THR  32  -1.825   6.727  -7.010
  253   1HG2  THR  32          1HG2      THR  32   0.125   7.760  -4.135
  254   2HG2  THR  32          2HG2      THR  32  -1.308   7.547  -3.131
  255   3HG2  THR  32          3HG2      THR  32  -1.314   8.735  -4.433
  256    H    PHE  33           H        PHE  33  -2.615   3.724  -3.944
  257    HA   PHE  33           HA       PHE  33  -3.056   2.513  -6.639
  258   1HB   PHE  33          1HB       PHE  33  -2.629   0.333  -5.827
  259   2HB   PHE  33          2HB       PHE  33  -1.354   1.303  -5.100
  260    HD1  PHE  33           1HD      PHE  33  -1.409   1.879  -2.695
  261    HD2  PHE  33           2HD      PHE  33  -4.449  -0.573  -4.491
  262    HE1  PHE  33           1HE      PHE  33  -2.159   1.176  -0.453
  263    HE2  PHE  33           2HE      PHE  33  -5.201  -1.282  -2.236
  264    HZ   PHE  33           HZ       PHE  33  -4.057  -0.409  -0.216
  265    H    VAL  34           H        VAL  34  -5.088   1.176  -6.643
  266    HA   VAL  34           HA       VAL  34  -7.254   2.615  -5.344
  267    HB   VAL  34           HB       VAL  34  -7.246  -0.017  -6.856
  268   1HG1  VAL  34          1HG1      VAL  34  -9.451   0.076  -6.365
  269   2HG1  VAL  34          2HG1      VAL  34  -9.530   1.454  -7.464
  270   3HG1  VAL  34          3HG1      VAL  34  -9.314   1.717  -5.733
  271   1HG2  VAL  34          1HG2      VAL  34  -6.647   1.155  -8.684
  272   2HG2  VAL  34          2HG2      VAL  34  -6.514   2.622  -7.711
  273   3HG2  VAL  34          3HG2      VAL  34  -8.053   2.198  -8.463
  274    H    TYR  35           H        TYR  35  -8.032   2.196  -3.324
  275    HA   TYR  35           HA       TYR  35  -7.353  -0.431  -2.044
  276   1HB   TYR  35          1HB       TYR  35  -6.453   1.589  -0.995
  277   2HB   TYR  35          2HB       TYR  35  -8.058   2.317  -0.959
  278    HD1  TYR  35           1HD      TYR  35  -7.394  -1.261  -0.293
  279    HD2  TYR  35           2HD      TYR  35  -8.216   2.584   1.435
  280    HE1  TYR  35           1HE      TYR  35  -7.817  -2.336   1.899
  281    HE2  TYR  35           2HE      TYR  35  -8.638   1.507   3.630
  282    HH   TYR  35           HH       TYR  35  -9.429  -1.024   4.311
  283    H    GLY  36           H        GLY  36  -9.068  -1.618  -1.028
  284   1HA   GLY  36          1HA       GLY  36 -11.780  -0.917  -1.989
  285   2HA   GLY  36          2HA       GLY  36 -11.299  -2.474  -1.318
  286    H    ALA  37           H        ALA  37  -9.982  -0.261   0.734
  287    HA   ALA  37           HA       ALA  37 -10.679   0.702   2.792
  288   1HB   ALA  37          1HB       ALA  37 -12.692   1.220   1.112
  289   2HB   ALA  37          2HB       ALA  37 -12.834   1.547   2.840
  290   3HB   ALA  37          3HB       ALA  37 -13.533   0.076   2.159
  291    H    CYS  38           H        CYS  38 -11.109  -2.462   1.834
  292    HA   CYS  38           HA       CYS  38 -11.344  -3.364   4.631
  293   1HB   CYS  38          1HB       CYS  38 -13.232  -5.003   3.542
  294   2HB   CYS  38          2HB       CYS  38 -13.616  -3.520   4.405
  295    H    ARG  39           H        ARG  39 -10.641  -5.567   4.878
  296    HA   ARG  39           HA       ARG  39  -9.386  -7.485   4.289
  297   1HB   ARG  39          1HB       ARG  39 -11.210  -6.858   2.131
  298   2HB   ARG  39          2HB       ARG  39  -9.721  -7.541   1.480
  299   1HG   ARG  39          1HG       ARG  39 -10.515  -9.573   2.057
  300   2HG   ARG  39          2HG       ARG  39 -10.301  -9.097   3.742
  301   1HD   ARG  39          1HD       ARG  39 -12.644  -7.911   3.386
  302   2HD   ARG  39          2HD       ARG  39 -12.800  -9.095   2.073
  303    HE   ARG  39           HE       ARG  39 -11.938 -10.690   4.082
  304   1HH1  ARG  39          1HH1      ARG  39 -14.776  -9.029   3.407
  305   2HH1  ARG  39          2HH1      ARG  39 -15.508  -9.299   4.952
  306   1HH2  ARG  39          1HH2      ARG  39 -12.657 -10.670   6.367
  307   2HH2  ARG  39          2HH2      ARG  39 -14.311 -10.229   6.626
  308    H    ALA  40           H        ALA  40  -8.258  -4.710   4.186
  309    HA   ALA  40           HA       ALA  40  -6.417  -4.561   1.939
  310   1HB   ALA  40          1HB       ALA  40  -5.709  -3.099   4.371
  311   2HB   ALA  40          2HB       ALA  40  -7.414  -2.917   3.957
  312   3HB   ALA  40          3HB       ALA  40  -6.170  -2.475   2.788
  313    H    LYS  41           H        LYS  41  -3.973  -4.326   2.526
  314    HA   LYS  41           HA       LYS  41  -3.180  -6.593   4.332
  315   1HB   LYS  41          1HB       LYS  41  -1.720  -5.616   1.866
  316   2HB   LYS  41          2HB       LYS  41  -1.532  -7.162   2.691
  317   1HG   LYS  41          1HG       LYS  41  -4.002  -7.582   2.105
  318   2HG   LYS  41          2HG       LYS  41  -3.853  -6.214   1.002
  319   1HD   LYS  41          1HD       LYS  41  -3.274  -7.948  -0.424
  320   2HD   LYS  41          2HD       LYS  41  -1.682  -7.531   0.214
  321   1HE   LYS  41          1HE       LYS  41  -1.719  -9.368   1.753
  322   2HE   LYS  41          2HE       LYS  41  -3.452  -9.643   1.488
  323   1HZ   LYS  41          1HZ       LYS  41  -3.072 -10.616  -0.506
  324   2HZ   LYS  41          2HZ       LYS  41  -1.539 -10.936   0.150
  325   3HZ   LYS  41          3HZ       LYS  41  -1.763  -9.606  -0.884
  326    H    ARG  42           H        ARG  42  -0.538  -6.224   4.597
  327    HA   ARG  42           HA       ARG  42  -0.292  -3.830   6.211
  328   1HB   ARG  42          1HB       ARG  42   1.969  -5.524   5.140
  329   2HB   ARG  42          2HB       ARG  42   1.873  -4.693   6.688
  330   1HG   ARG  42          1HG       ARG  42  -0.303  -6.321   6.862
  331   2HG   ARG  42          2HG       ARG  42   0.769  -7.320   5.879
  332   1HD   ARG  42          1HD       ARG  42   2.465  -6.323   7.854
  333   2HD   ARG  42          2HD       ARG  42   0.956  -6.649   8.727
  334    HE   ARG  42           HE       ARG  42   2.584  -8.648   7.250
  335   1HH1  ARG  42          1HH1      ARG  42  -0.666  -8.329   7.475
  336   2HH1  ARG  42          2HH1      ARG  42  -0.953  -9.721   8.466
  337   1HH2  ARG  42          1HH2      ARG  42   2.401 -10.225   9.192
  338   2HH2  ARG  42          2HH2      ARG  42   0.784 -10.790   9.443
  339    H    ASN  43           H        ASN  43   0.121  -4.509   2.857
  340    HA   ASN  43           HA       ASN  43   1.924  -2.196   2.401
  341   1HB   ASN  43          1HB       ASN  43   1.855  -4.605   1.281
  342   2HB   ASN  43          2HB       ASN  43   0.650  -3.842   0.241
  343   1HD2  ASN  43          1HD2      ASN  43   3.981  -3.280   1.506
  344   2HD2  ASN  43          2HD2      ASN  43   4.527  -2.468   0.117
  345    H    ASN  44           H        ASN  44  -0.140  -1.014   3.415
  346    HA   ASN  44           HA       ASN  44  -1.532   0.292   1.150
  347   1HB   ASN  44          1HB       ASN  44  -2.973  -1.592   1.625
  348   2HB   ASN  44          2HB       ASN  44  -2.844  -1.330   3.362
  349   1HD2  ASN  44          1HD2      ASN  44  -5.295  -1.343   1.613
  350   2HD2  ASN  44          2HD2      ASN  44  -6.049   0.161   1.900
  351    H    PHE  45           H        PHE  45  -0.064   1.982   2.076
  352    HA   PHE  45           HA       PHE  45  -0.766   2.997   4.777
  353   1HB   PHE  45          1HB       PHE  45   1.280   4.002   2.783
  354   2HB   PHE  45          2HB       PHE  45   1.276   4.243   4.530
  355    HD1  PHE  45           1HD      PHE  45   1.992   2.484   6.047
  356    HD2  PHE  45           2HD      PHE  45   1.791   1.784   1.812
  357    HE1  PHE  45           1HE      PHE  45   3.262   0.372   6.335
  358    HE2  PHE  45           2HE      PHE  45   3.063  -0.327   2.101
  359    HZ   PHE  45           HZ       PHE  45   3.802  -1.038   4.364
  360    H    LYS  46           H        LYS  46  -1.396   5.236   5.068
  361    HA   LYS  46           HA       LYS  46  -3.254   6.210   3.042
  362   1HB   LYS  46          1HB       LYS  46  -2.231   7.474   5.603
  363   2HB   LYS  46          2HB       LYS  46  -3.720   7.889   4.756
  364   1HG   LYS  46          1HG       LYS  46  -4.810   5.983   5.465
  365   2HG   LYS  46          2HG       LYS  46  -3.325   5.032   5.529
  366   1HD   LYS  46          1HD       LYS  46  -3.303   7.260   7.424
  367   2HD   LYS  46          2HD       LYS  46  -4.642   6.146   7.713
  368   1HE   LYS  46          1HE       LYS  46  -3.236   4.491   8.424
  369   2HE   LYS  46          2HE       LYS  46  -2.066   4.814   7.129
  370   1HZ   LYS  46          1HZ       LYS  46  -2.401   6.182   9.731
  371   2HZ   LYS  46          2HZ       LYS  46  -1.677   6.991   8.423
  372   3HZ   LYS  46          3HZ       LYS  46  -0.983   5.565   9.033
  373    H    SER  47           H        SER  47   0.061   6.851   3.918
  374    HA   SER  47           HA       SER  47   0.133   9.031   1.860
  375   1HB   SER  47          1HB       SER  47   1.597  10.284   3.373
  376   2HB   SER  47          2HB       SER  47   0.090   9.897   4.197
  377    HG   SER  47           HG       SER  47   1.308   7.924   4.890
  378    H    ALA  48           H        ALA  48   2.257   9.285   0.865
  379    HA   ALA  48           HA       ALA  48   3.631   6.765   0.399
  380   1HB   ALA  48          1HB       ALA  48   5.184   8.759  -0.678
  381   2HB   ALA  48          2HB       ALA  48   3.619   9.562  -0.555
  382   3HB   ALA  48          3HB       ALA  48   3.773   8.066  -1.476
  383    H    GLU  49           H        GLU  49   4.072   9.499   2.519
  384    HA   GLU  49           HA       GLU  49   6.885   9.051   3.113
  385   1HB   GLU  49          1HB       GLU  49   4.897  10.978   3.556
  386   2HB   GLU  49          2HB       GLU  49   5.306  10.384   5.166
  387   1HG   GLU  49          1HG       GLU  49   7.183  11.550   3.092
  388   2HG   GLU  49          2HG       GLU  49   6.817  12.196   4.692
  389    H    ASP  50           H        ASP  50   3.925   7.597   4.115
  390    HA   ASP  50           HA       ASP  50   5.074   6.525   6.633
  391   1HB   ASP  50          1HB       ASP  50   2.638   7.418   6.082
  392   2HB   ASP  50          2HB       ASP  50   2.404   5.778   5.479
  393    H    CYS  51           H        CYS  51   4.228   5.566   3.359
  394    HA   CYS  51           HA       CYS  51   4.421   2.711   3.722
  395   1HB   CYS  51          1HB       CYS  51   3.337   3.515   1.776
  396   2HB   CYS  51          2HB       CYS  51   4.616   4.679   1.438
  397    H    MET  52           H        MET  52   6.731   5.128   2.441
  398    HA   MET  52           HA       MET  52   8.971   3.321   2.254
  399   1HB   MET  52          1HB       MET  52   8.349   5.851   1.436
  400   2HB   MET  52          2HB       MET  52   9.434   6.209   2.781
  401   1HG   MET  52          1HG       MET  52  10.712   6.003   0.693
  402   2HG   MET  52          2HG       MET  52  11.126   4.685   1.787
  403   1HE   MET  52          1HE       MET  52  11.402   2.095   0.057
  404   2HE   MET  52          2HE       MET  52  12.196   3.652   0.283
  405   3HE   MET  52          3HE       MET  52  11.731   3.136  -1.336
  406    H    ARG  53           H        ARG  53   8.097   5.783   4.723
  407    HA   ARG  53           HA       ARG  53  10.163   5.599   6.538
  408   1HB   ARG  53          1HB       ARG  53   8.215   6.998   6.883
  409   2HB   ARG  53          2HB       ARG  53   7.160   5.588   6.979
  410   1HG   ARG  53          1HG       ARG  53   9.245   5.251   8.902
  411   2HG   ARG  53          2HG       ARG  53   8.590   6.878   9.096
  412   1HD   ARG  53          1HD       ARG  53   6.494   4.863   8.674
  413   2HD   ARG  53          2HD       ARG  53   7.451   4.573  10.139
  414    HE   ARG  53           HE       ARG  53   6.312   7.281   9.537
  415   1HH1  ARG  53          1HH2      ARG  53   4.616   5.178  11.004
  416   2HH1  ARG  53          2HH2      ARG  53   4.891   5.636  12.652
  417   1HH2  ARG  53          1HH1      ARG  53   7.632   7.629  11.918
  418   2HH2  ARG  53          2HH1      ARG  53   6.597   7.026  13.169
  419    H    THR  54           H        THR  54   7.521   3.268   6.104
  420    HA   THR  54           HA       THR  54   8.696   1.411   8.097
  421    HB   THR  54           HB       THR  54   6.197   1.517   6.378
  422    HG1  THR  54           1HG      THR  54   5.321   2.160   8.176
  423   1HG2  THR  54          1HG2      THR  54   6.148  -0.589   8.344
  424   2HG2  THR  54          2HG2      THR  54   7.505  -0.826   7.246
  425   3HG2  THR  54          3HG2      THR  54   5.870  -0.684   6.606
  426    H    CYS  55           H        CYS  55   7.886   1.542   4.646
  427    HA   CYS  55           HA       CYS  55   9.225  -1.006   4.067
  428   1HB   CYS  55          1HB       CYS  55   7.913   1.128   2.355
  429   2HB   CYS  55          2HB       CYS  55   8.424  -0.449   1.784
  430    H    GLY  56           H        GLY  56  10.869   1.363   5.043
  431   1HA   GLY  56          1HA       GLY  56  12.684   1.483   2.666
  432   2HA   GLY  56          2HA       GLY  56  12.459   2.872   3.734
  433    H    GLY  57           H        GLY  57  14.726   0.740   3.047
  434   1HA   GLY  57          1HA       GLY  57  16.424   1.040   5.152
  435   2HA   GLY  57          2HA       GLY  57  15.365  -0.241   5.743
  436    H    ALA  58           H        ALA  58  16.529   0.328   2.420
  437    HA   ALA  58           HA       ALA  58  17.771  -2.402   2.513
  438   1HB   ALA  58          1HB       ALA  58  16.993  -2.698   0.326
  439   2HB   ALA  58          2HB       ALA  58  16.960  -0.965   0.001
  440   3HB   ALA  58          3HB       ALA  58  15.715  -1.696   1.013
  Start of MODEL    5
    1   1H    ARG   1          1H        ARG   1  16.138  -3.816   4.817
    2   2H    ARG   1          2H        ARG   1  15.647  -4.941   3.643
    3   3H    ARG   1          3H        ARG   1  15.638  -5.367   5.288
    4    HA   ARG   1           HA       ARG   1  13.968  -3.481   5.601
    5   1HB   ARG   1          1HB       ARG   1  12.993  -2.628   3.606
    6   2HB   ARG   1          2HB       ARG   1  14.719  -2.677   3.259
    7   1HG   ARG   1          1HG       ARG   1  14.316  -4.989   2.255
    8   2HG   ARG   1          2HG       ARG   1  12.592  -4.634   2.364
    9   1HD   ARG   1          1HD       ARG   1  12.678  -3.122   0.631
   10   2HD   ARG   1          2HD       ARG   1  14.273  -2.515   1.118
   11    HE   ARG   1           HE       ARG   1  13.800  -5.069  -0.378
   12   1HH1  ARG   1          1HH2      ARG   1  15.104  -2.469  -1.455
   13   2HH1  ARG   1          2HH2      ARG   1  16.772  -2.935  -1.445
   14   1HH2  ARG   1          1HH1      ARG   1  16.264  -5.704   0.578
   15   2HH2  ARG   1          2HH1      ARG   1  17.429  -4.765  -0.295
   16    HA   PRO   2           HA       PRO   2  11.198  -6.862   5.958
   17   1HB   PRO   2          1HB       PRO   2   8.749  -5.707   5.476
   18   2HB   PRO   2          2HB       PRO   2   9.652  -5.500   6.985
   19   1HG   PRO   2          1HG       PRO   2   9.472  -3.699   4.601
   20   2HG   PRO   2          2HG       PRO   2   9.413  -3.287   6.323
   21   1HD   PRO   2          1HD       PRO   2  11.642  -2.962   4.830
   22   2HD   PRO   2          2HD       PRO   2  11.716  -3.410   6.549
   23    H    ASP   3           H        ASP   3   9.761  -8.288   4.733
   24    HA   ASP   3           HA       ASP   3  10.160  -8.007   1.792
   25   1HB   ASP   3          1HB       ASP   3  10.053 -10.145   3.800
   26   2HB   ASP   3          2HB       ASP   3   9.111 -10.514   2.355
   27    H    PHE   4           H        PHE   4   7.696  -7.798   4.228
   28    HA   PHE   4           HA       PHE   4   5.444  -8.668   2.663
   29   1HB   PHE   4          1HB       PHE   4   4.147  -7.631   4.407
   30   2HB   PHE   4          2HB       PHE   4   5.585  -8.317   5.157
   31    HD1  PHE   4           1HD      PHE   4   4.418  -5.072   3.609
   32    HD2  PHE   4           2HD      PHE   4   6.790  -7.005   6.630
   33    HE1  PHE   4           1HE      PHE   4   4.905  -2.919   4.584
   34    HE2  PHE   4           2HE      PHE   4   7.303  -4.790   7.617
   35    HZ   PHE   4           HZ       PHE   4   6.363  -2.737   6.596
   36    H    CYS   5           H        CYS   5   7.382  -5.820   2.489
   37    HA   CYS   5           HA       CYS   5   5.300  -4.172   1.226
   38   1HB   CYS   5          1HB       CYS   5   8.035  -3.930   2.265
   39   2HB   CYS   5          2HB       CYS   5   7.745  -2.965   0.817
   40    H    LEU   6           H        LEU   6   7.564  -6.558   0.180
   41    HA   LEU   6           HA       LEU   6   8.019  -5.510  -2.501
   42   1HB   LEU   6          1HB       LEU   6   8.221  -8.346  -1.445
   43   2HB   LEU   6          2HB       LEU   6   9.057  -7.679  -2.848
   44    HG   LEU   6           HG       LEU   6   9.415  -6.726   0.008
   45   1HD1  LEU   6          1HD1      LEU   6  11.674  -7.943  -1.446
   46   2HD1  LEU   6          2HD1      LEU   6  10.365  -9.065  -1.072
   47   3HD1  LEU   6          3HD1      LEU   6  11.159  -8.172   0.224
   48   1HD2  LEU   6          1HD2      LEU   6   9.797  -4.961  -1.654
   49   2HD2  LEU   6          2HD2      LEU   6  10.846  -6.034  -2.581
   50   3HD2  LEU   6          3HD2      LEU   6  11.340  -5.484  -0.980
   51    H    GLU   7           H        GLU   7   5.585  -7.523  -0.972
   52    HA   GLU   7           HA       GLU   7   4.465  -8.726  -3.324
   53   1HB   GLU   7          1HB       GLU   7   4.001  -8.550  -0.513
   54   2HB   GLU   7          2HB       GLU   7   2.481  -8.172  -1.327
   55   1HG   GLU   7          1HG       GLU   7   2.211 -10.313  -2.001
   56   2HG   GLU   7          2HG       GLU   7   3.876 -10.418  -2.573
   57    HA   PRO   8           HA       PRO   8   2.154  -5.460  -5.119
   58   1HB   PRO   8          1HB       PRO   8  -0.161  -6.730  -5.852
   59   2HB   PRO   8          2HB       PRO   8   1.389  -6.983  -6.680
   60   1HG   PRO   8          1HG       PRO   8  -0.005  -8.677  -4.667
   61   2HG   PRO   8          2HG       PRO   8   0.956  -9.155  -6.075
   62   1HD   PRO   8          1HD       PRO   8   1.859  -9.180  -3.471
   63   2HD   PRO   8          2HD       PRO   8   2.911  -9.080  -4.900
   64    HA   PRO   9           HA       PRO   9  -0.695  -3.734  -2.256
   65   1HB   PRO   9          1HB       PRO   9  -2.474  -2.422  -3.881
   66   2HB   PRO   9          2HB       PRO   9  -0.821  -1.851  -3.576
   67   1HG   PRO   9          1HG       PRO   9  -1.939  -3.313  -5.921
   68   2HG   PRO   9          2HG       PRO   9  -0.728  -2.022  -5.864
   69   1HD   PRO   9          1HD       PRO   9  -0.134  -4.682  -6.186
   70   2HD   PRO   9          2HD       PRO   9   0.986  -3.489  -5.495
   71    H    TYR  10           H        TYR  10  -3.376  -3.376  -2.194
   72    HA   TYR  10           HA       TYR  10  -4.696  -5.921  -3.045
   73   1HB   TYR  10          1HB       TYR  10  -3.565  -6.085  -0.767
   74   2HB   TYR  10          2HB       TYR  10  -4.700  -4.859  -0.206
   75    HD1  TYR  10           1HD      TYR  10  -4.660  -8.136  -2.033
   76    HD2  TYR  10           2HD      TYR  10  -6.745  -5.543   0.684
   77    HE1  TYR  10           1HE      TYR  10  -6.376  -9.890  -1.677
   78    HE2  TYR  10           2HE      TYR  10  -8.463  -7.298   1.039
   79    HH   TYR  10           HH       TYR  10  -9.240  -9.281   0.330
   80    H    THR  11           H        THR  11  -6.046  -4.654  -4.407
   81    HA   THR  11           HA       THR  11  -7.487  -2.317  -3.557
   82    HB   THR  11           HB       THR  11  -7.703  -4.393  -5.736
   83    HG1  THR  11           1HG      THR  11  -7.317  -2.533  -6.983
   84   1HG2  THR  11          1HG2      THR  11  -9.632  -3.202  -6.679
   85   2HG2  THR  11          2HG2      THR  11  -9.661  -2.123  -5.284
   86   3HG2  THR  11          3HG2      THR  11 -10.032  -3.835  -5.082
   87    H    GLY  12           H        GLY  12  -7.860  -5.729  -3.044
   88   1HA   GLY  12          1HA       GLY  12  -9.446  -6.954  -1.810
   89   2HA   GLY  12          2HA       GLY  12  -9.827  -5.434  -1.000
   90    HA   PRO  13           HA       PRO  13 -13.157  -6.750  -4.113
   91   1HB   PRO  13          1HB       PRO  13 -14.855  -8.152  -2.491
   92   2HB   PRO  13          2HB       PRO  13 -13.554  -8.919  -3.423
   93   1HG   PRO  13          1HG       PRO  13 -13.678  -8.214  -0.536
   94   2HG   PRO  13          2HG       PRO  13 -12.931  -9.610  -1.325
   95   1HD   PRO  13          1HD       PRO  13 -11.568  -7.387  -0.411
   96   2HD   PRO  13          2HD       PRO  13 -10.968  -8.498  -1.661
   97    H    CYS  14           H        CYS  14 -13.353  -4.347  -3.685
   98    HA   CYS  14           HA       CYS  14 -15.823  -3.793  -2.122
   99   1HB   CYS  14          1HB       CYS  14 -13.045  -2.926  -1.525
  100   2HB   CYS  14          2HB       CYS  14 -14.282  -1.675  -1.392
  101    H    LYS  15           H        LYS  15 -16.604  -1.506  -2.610
  102    HA   LYS  15           HA       LYS  15 -15.969  -0.828  -5.456
  103   1HB   LYS  15          1HB       LYS  15 -18.369  -0.741  -3.670
  104   2HB   LYS  15          2HB       LYS  15 -18.273   0.436  -4.981
  105   1HG   LYS  15          1HG       LYS  15 -17.814  -1.490  -6.552
  106   2HG   LYS  15          2HG       LYS  15 -18.167  -2.585  -5.214
  107   1HD   LYS  15          1HD       LYS  15 -20.425  -1.930  -5.118
  108   2HD   LYS  15          2HD       LYS  15 -20.121  -0.422  -5.980
  109   1HE   LYS  15          1HE       LYS  15 -20.368  -1.430  -8.014
  110   2HE   LYS  15          2HE       LYS  15 -19.402  -2.835  -7.522
  111   1HZ   LYS  15          1HZ       LYS  15 -21.748  -3.419  -7.829
  112   2HZ   LYS  15          2HZ       LYS  15 -22.202  -2.254  -6.679
  113   3HZ   LYS  15          3HZ       LYS  15 -21.286  -3.605  -6.209
  114    H    ALA  16           H        ALA  16 -14.787   0.116  -2.660
  115    HA   ALA  16           HA       ALA  16 -15.306   3.014  -2.753
  116   1HB   ALA  16          1HB       ALA  16 -14.166   3.008  -0.704
  117   2HB   ALA  16          2HB       ALA  16 -13.140   1.651  -1.172
  118   3HB   ALA  16          3HB       ALA  16 -14.830   1.374  -0.747
  119    H    ARG  17           H        ARG  17 -13.651   4.583  -3.260
  120    HA   ARG  17           HA       ARG  17 -11.353   3.481  -4.847
  121   1HB   ARG  17          1HB       ARG  17 -13.526   5.350  -5.462
  122   2HB   ARG  17          2HB       ARG  17 -11.933   6.009  -5.842
  123   1HG   ARG  17          1HG       ARG  17 -12.642   3.199  -6.658
  124   2HG   ARG  17          2HG       ARG  17 -13.169   4.565  -7.642
  125   1HD   ARG  17          1HD       ARG  17 -10.466   5.098  -7.071
  126   2HD   ARG  17          2HD       ARG  17 -10.525   3.365  -7.452
  127    HE   ARG  17           HE       ARG  17 -12.155   4.514  -9.373
  128   1HH1  ARG  17          1HH1      ARG  17  -9.667   6.407  -8.309
  129   2HH1  ARG  17          2HH1      ARG  17  -8.765   6.405  -9.787
  130   1HH2  ARG  17          1HH2      ARG  17 -10.682   3.922 -11.265
  131   2HH2  ARG  17          2HH2      ARG  17  -9.339   4.998 -11.460
  132    H    ILE  18           H        ILE  18 -10.197   3.715  -2.691
  133    HA   ILE  18           HA       ILE  18  -9.594   6.552  -1.973
  134    HB   ILE  18           HB       ILE  18  -9.224   3.865  -0.621
  135   1HG1  ILE  18          1HG1      ILE  18 -10.736   6.344   0.251
  136   2HG1  ILE  18          2HG1      ILE  18 -11.483   5.011  -0.628
  137   1HG2  ILE  18          1HG2      ILE  18  -7.264   5.336  -0.190
  138   2HG2  ILE  18          2HG2      ILE  18  -8.231   5.080   1.263
  139   3HG2  ILE  18          3HG2      ILE  18  -8.359   6.598   0.374
  140   1HD1  ILE  18          1HD1      ILE  18  -9.913   4.484   1.887
  141   2HD1  ILE  18          2HD1      ILE  18 -11.190   3.510   1.156
  142   3HD1  ILE  18          3HD1      ILE  18 -11.592   5.016   1.983
  143    H    ILE  19           H        ILE  19  -7.519   7.365  -2.296
  144    HA   ILE  19           HA       ILE  19  -5.669   5.740  -3.919
  145    HB   ILE  19           HB       ILE  19  -5.624   8.593  -2.880
  146   1HG1  ILE  19          1HG1      ILE  19  -7.438   8.057  -4.499
  147   2HG1  ILE  19          2HG1      ILE  19  -6.250   9.166  -5.186
  148   1HG2  ILE  19          1HG2      ILE  19  -4.007   8.289  -5.178
  149   2HG2  ILE  19          2HG2      ILE  19  -3.570   6.967  -4.096
  150   3HG2  ILE  19          3HG2      ILE  19  -3.469   8.636  -3.534
  151   1HD1  ILE  19          1HD1      ILE  19  -6.686   7.480  -6.851
  152   2HD1  ILE  19          2HD1      ILE  19  -6.483   6.183  -5.672
  153   3HD1  ILE  19          3HD1      ILE  19  -5.091   7.138  -6.178
  154    H    ARG  20           H        ARG  20  -5.161   4.177  -2.131
  155    HA   ARG  20           HA       ARG  20  -3.676   5.214   0.199
  156   1HB   ARG  20          1HB       ARG  20  -4.529   2.507  -0.845
  157   2HB   ARG  20          2HB       ARG  20  -3.489   2.666   0.574
  158   1HG   ARG  20          1HG       ARG  20  -5.816   4.449   0.651
  159   2HG   ARG  20          2HG       ARG  20  -6.263   2.745   0.590
  160   1HD   ARG  20          1HD       ARG  20  -5.316   2.295   2.657
  161   2HD   ARG  20          2HD       ARG  20  -4.070   3.545   2.471
  162    HE   ARG  20           HE       ARG  20  -6.064   5.189   2.702
  163   1HH1  ARG  20          1HH2      ARG  20  -5.327   2.495   4.622
  164   2HH1  ARG  20          2HH2      ARG  20  -6.711   2.650   5.653
  165   1HH2  ARG  20          1HH1      ARG  20  -8.147   5.197   3.793
  166   2HH2  ARG  20          2HH1      ARG  20  -8.305   4.178   5.185
  167    H    TYR  21           H        TYR  21  -1.487   4.010   0.648
  168    HA   TYR  21           HA       TYR  21   0.119   4.068  -1.886
  169   1HB   TYR  21          1HB       TYR  21   0.774   4.694   1.005
  170   2HB   TYR  21          2HB       TYR  21   1.972   4.676  -0.289
  171    HD1  TYR  21           1HD      TYR  21   2.245   6.539  -1.718
  172    HD2  TYR  21           2HD      TYR  21  -1.233   6.248   0.785
  173    HE1  TYR  21           1HE      TYR  21   1.617   8.860  -2.321
  174    HE2  TYR  21           2HE      TYR  21  -1.862   8.571   0.183
  175    HH   TYR  21           HH       TYR  21   0.192  10.741  -1.148
  176    H    PHE  22           H        PHE  22   1.820   2.526  -2.101
  177    HA   PHE  22           HA       PHE  22   2.043   0.342  -0.120
  178   1HB   PHE  22          1HB       PHE  22   1.255  -1.343  -1.555
  179   2HB   PHE  22          2HB       PHE  22   0.142  -0.027  -1.862
  180    HD1  PHE  22           1HD      PHE  22   0.246   1.270  -3.952
  181    HD2  PHE  22           2HD      PHE  22   2.920  -2.009  -3.200
  182    HE1  PHE  22           1HE      PHE  22   0.862   1.220  -6.355
  183    HE2  PHE  22           2HE      PHE  22   3.538  -2.056  -5.601
  184    HZ   PHE  22           HZ       PHE  22   2.510  -0.441  -7.180
  185    H    TYR  23           H        TYR  23   3.972  -0.959  -0.546
  186    HA   TYR  23           HA       TYR  23   6.111   0.653  -1.762
  187   1HB   TYR  23          1HB       TYR  23   6.288  -0.621   0.390
  188   2HB   TYR  23          2HB       TYR  23   6.189  -2.123  -0.535
  189    HD1  TYR  23           1HD      TYR  23   8.213  -3.114  -1.158
  190    HD2  TYR  23           2HD      TYR  23   8.041   1.148  -0.636
  191    HE1  TYR  23           1HE      TYR  23  10.633  -2.951  -1.685
  192    HE2  TYR  23           2HE      TYR  23  10.458   1.311  -1.166
  193    HH   TYR  23           HH       TYR  23  12.417  -1.602  -1.729
  194    H    ASN  24           H        ASN  24   6.475   0.526  -3.943
  195    HA   ASN  24           HA       ASN  24   5.759  -1.932  -5.445
  196   1HB   ASN  24          1HB       ASN  24   5.162   0.327  -6.270
  197   2HB   ASN  24          2HB       ASN  24   6.866   0.773  -6.284
  198   1HD2  ASN  24          1HD2      ASN  24   5.630   0.967  -8.722
  199   2HD2  ASN  24          2HD2      ASN  24   6.057  -0.324  -9.735
  200    H    ALA  25           H        ALA  25   7.484  -3.330  -4.585
  201    HA   ALA  25           HA       ALA  25  10.203  -2.825  -4.375
  202   1HB   ALA  25          1HB       ALA  25   9.921  -5.342  -5.655
  203   2HB   ALA  25          2HB       ALA  25   8.432  -5.073  -4.749
  204   3HB   ALA  25          3HB       ALA  25   9.987  -5.029  -3.920
  205    H    LYS  26           H        LYS  26   8.287  -3.008  -7.293
  206    HA   LYS  26           HA       LYS  26  10.535  -3.288  -9.131
  207   1HB   LYS  26          1HB       LYS  26   7.786  -3.570  -9.193
  208   2HB   LYS  26          2HB       LYS  26   8.032  -2.079 -10.102
  209   1HG   LYS  26          1HG       LYS  26  10.015  -4.038 -10.861
  210   2HG   LYS  26          2HG       LYS  26   8.400  -4.729 -11.020
  211   1HD   LYS  26          1HD       LYS  26   9.305  -2.080 -12.193
  212   2HD   LYS  26          2HD       LYS  26   9.091  -3.578 -13.097
  213   1HE   LYS  26          1HE       LYS  26   6.659  -3.523 -12.088
  214   2HE   LYS  26          2HE       LYS  26   7.002  -1.796 -11.859
  215   1HZ   LYS  26          1HZ       LYS  26   6.117  -2.760 -14.153
  216   2HZ   LYS  26          2HZ       LYS  26   7.775  -3.027 -14.403
  217   3HZ   LYS  26          3HZ       LYS  26   7.201  -1.458 -14.093
  218    H    ALA  27           H        ALA  27   8.910  -0.639  -7.513
  219    HA   ALA  27           HA       ALA  27  10.148   1.383  -9.309
  220   1HB   ALA  27          1HB       ALA  27   7.727   1.243  -8.200
  221   2HB   ALA  27          2HB       ALA  27   8.526   2.798  -8.436
  222   3HB   ALA  27          3HB       ALA  27   8.558   2.022  -6.853
  223    H    GLY  28           H        GLY  28  10.368   0.159  -5.987
  224   1HA   GLY  28          1HA       GLY  28  12.484   0.239  -4.771
  225   2HA   GLY  28          2HA       GLY  28  12.915   1.683  -5.688
  226    H    LEU  29           H        LEU  29   9.856   2.333  -5.089
  227    HA   LEU  29           HA       LEU  29  10.249   3.326  -2.295
  228   1HB   LEU  29          1HB       LEU  29   9.143   4.850  -4.683
  229   2HB   LEU  29          2HB       LEU  29   9.341   5.488  -3.052
  230    HG   LEU  29           HG       LEU  29  11.833   4.354  -3.962
  231   1HD1  LEU  29          1HD1      LEU  29  10.272   5.916  -5.926
  232   2HD1  LEU  29          2HD1      LEU  29  11.648   4.843  -6.180
  233   3HD1  LEU  29          3HD1      LEU  29  11.914   6.506  -5.655
  234   1HD2  LEU  29          1HD2      LEU  29  10.901   6.462  -2.399
  235   2HD2  LEU  29          2HD2      LEU  29  11.642   7.271  -3.781
  236   3HD2  LEU  29          3HD2      LEU  29  12.590   6.150  -2.801
  237    H    CYS  30           H        CYS  30   7.649   4.789  -2.732
  238    HA   CYS  30           HA       CYS  30   5.821   2.413  -2.687
  239   1HB   CYS  30          1HB       CYS  30   5.891   4.969  -1.076
  240   2HB   CYS  30          2HB       CYS  30   4.489   3.906  -1.101
  241    H    GLN  31           H        GLN  31   3.867   2.656  -3.780
  242    HA   GLN  31           HA       GLN  31   3.464   5.218  -5.279
  243   1HB   GLN  31          1HB       GLN  31   3.157   2.352  -6.242
  244   2HB   GLN  31          2HB       GLN  31   2.812   3.790  -7.205
  245   1HG   GLN  31          1HG       GLN  31   5.426   4.062  -6.055
  246   2HG   GLN  31          2HG       GLN  31   5.323   2.483  -6.834
  247   1HE2  GLN  31          1HE2      GLN  31   7.021   4.143  -8.123
  248   2HE2  GLN  31          2HE2      GLN  31   6.324   4.818  -9.517
  249    H    THR  32           H        THR  32   1.152   5.536  -5.895
  250    HA   THR  32           HA       THR  32  -0.609   4.626  -3.725
  251    HB   THR  32           HB       THR  32  -2.174   6.219  -5.055
  252    HG1  THR  32           1HG      THR  32  -0.639   7.658  -6.304
  253   1HG2  THR  32          1HG2      THR  32  -0.761   8.219  -4.279
  254   2HG2  THR  32          2HG2      THR  32   0.428   7.026  -3.758
  255   3HG2  THR  32          3HG2      THR  32  -1.188   7.027  -3.052
  256    H    PHE  33           H        PHE  33  -2.427   3.317  -3.988
  257    HA   PHE  33           HA       PHE  33  -3.015   2.245  -6.712
  258   1HB   PHE  33          1HB       PHE  33  -2.796  -0.008  -5.962
  259   2HB   PHE  33          2HB       PHE  33  -1.381   0.822  -5.327
  260    HD1  PHE  33           1HD      PHE  33  -1.316   1.526  -2.911
  261    HD2  PHE  33           2HD      PHE  33  -4.480  -0.904  -4.511
  262    HE1  PHE  33           1HE      PHE  33  -1.979   0.882  -0.618
  263    HE2  PHE  33           2HE      PHE  33  -5.140  -1.552  -2.209
  264    HZ   PHE  33           HZ       PHE  33  -3.889  -0.660  -0.262
  265    H    VAL  34           H        VAL  34  -5.167   1.166  -6.766
  266    HA   VAL  34           HA       VAL  34  -7.150   2.677  -5.271
  267    HB   VAL  34           HB       VAL  34  -7.355   0.240  -7.067
  268   1HG1  VAL  34          1HG1      VAL  34  -9.396   2.176  -5.957
  269   2HG1  VAL  34          2HG1      VAL  34  -9.402   0.414  -5.864
  270   3HG1  VAL  34          3HG1      VAL  34  -9.707   1.216  -7.405
  271   1HG2  VAL  34          1HG2      VAL  34  -7.214   1.642  -8.852
  272   2HG2  VAL  34          2HG2      VAL  34  -6.450   2.758  -7.719
  273   3HG2  VAL  34          3HG2      VAL  34  -8.176   2.890  -8.058
  274    H    TYR  35           H        TYR  35  -7.468   2.211  -3.134
  275    HA   TYR  35           HA       TYR  35  -7.167  -0.562  -2.129
  276   1HB   TYR  35          1HB       TYR  35  -6.150   1.273  -0.910
  277   2HB   TYR  35          2HB       TYR  35  -7.672   2.162  -0.884
  278    HD1  TYR  35           1HD      TYR  35  -7.307  -1.497  -0.327
  279    HD2  TYR  35           2HD      TYR  35  -7.975   2.345   1.470
  280    HE1  TYR  35           1HE      TYR  35  -7.936  -2.601   1.806
  281    HE2  TYR  35           2HE      TYR  35  -8.601   1.244   3.596
  282    HH   TYR  35           HH       TYR  35  -8.232  -0.882   4.739
  283    H    GLY  36           H        GLY  36  -8.940  -1.725  -1.195
  284   1HA   GLY  36          1HA       GLY  36 -11.591  -0.951  -2.209
  285   2HA   GLY  36          2HA       GLY  36 -11.189  -2.472  -1.411
  286    H    ALA  37           H        ALA  37  -9.878  -0.228   0.573
  287    HA   ALA  37           HA       ALA  37 -10.610   0.825   2.573
  288   1HB   ALA  37          1HB       ALA  37 -12.657   1.902   2.426
  289   2HB   ALA  37          2HB       ALA  37 -13.452   0.504   1.703
  290   3HB   ALA  37          3HB       ALA  37 -12.402   1.528   0.723
  291    H    CYS  38           H        CYS  38 -10.919  -2.277   1.818
  292    HA   CYS  38           HA       CYS  38 -12.045  -2.985   4.483
  293   1HB   CYS  38          1HB       CYS  38 -13.446  -4.733   3.297
  294   2HB   CYS  38          2HB       CYS  38 -13.941  -3.069   2.985
  295    H    ARG  39           H        ARG  39 -11.188  -4.947   5.292
  296    HA   ARG  39           HA       ARG  39  -9.543  -6.630   5.518
  297   1HB   ARG  39          1HB       ARG  39 -10.008  -6.880   2.533
  298   2HB   ARG  39          2HB       ARG  39  -9.539  -8.160   3.653
  299   1HG   ARG  39          1HG       ARG  39 -11.677  -8.189   4.682
  300   2HG   ARG  39          2HG       ARG  39 -12.122  -6.629   3.993
  301   1HD   ARG  39          1HD       ARG  39 -13.260  -8.055   2.538
  302   2HD   ARG  39          2HD       ARG  39 -11.699  -7.958   1.697
  303    HE   ARG  39           HE       ARG  39 -11.112 -10.117   2.672
  304   1HH1  ARG  39          1HH1      ARG  39 -12.755  -9.753   5.206
  305   2HH1  ARG  39          2HH1      ARG  39 -14.003 -10.932   4.971
  306   1HH2  ARG  39          1HH2      ARG  39 -13.376 -11.308   1.581
  307   2HH2  ARG  39          2HH2      ARG  39 -14.354 -11.811   2.920
  308    H    ALA  40           H        ALA  40  -8.449  -4.035   5.210
  309    HA   ALA  40           HA       ALA  40  -6.487  -3.845   3.112
  310   1HB   ALA  40          1HB       ALA  40  -7.369  -2.435   5.490
  311   2HB   ALA  40          2HB       ALA  40  -6.597  -1.789   4.042
  312   3HB   ALA  40          3HB       ALA  40  -5.611  -2.408   5.366
  313    H    LYS  41           H        LYS  41  -4.275  -4.394   3.143
  314    HA   LYS  41           HA       LYS  41  -3.443  -6.283   5.317
  315   1HB   LYS  41          1HB       LYS  41  -2.332  -5.923   2.517
  316   2HB   LYS  41          2HB       LYS  41  -2.034  -7.272   3.612
  317   1HG   LYS  41          1HG       LYS  41  -4.355  -7.966   3.472
  318   2HG   LYS  41          2HG       LYS  41  -4.769  -6.531   2.534
  319   1HD   LYS  41          1HD       LYS  41  -3.668  -7.310   0.623
  320   2HD   LYS  41          2HD       LYS  41  -2.628  -8.395   1.544
  321   1HE   LYS  41          1HE       LYS  41  -5.618  -8.829   1.484
  322   2HE   LYS  41          2HE       LYS  41  -4.579  -9.462   0.191
  323   1HZ   LYS  41          1HZ       LYS  41  -4.529 -10.054   3.087
  324   2HZ   LYS  41          2HZ       LYS  41  -3.125 -10.250   2.150
  325   3HZ   LYS  41          3HZ       LYS  41  -4.526 -11.139   1.783
  326    H    ARG  42           H        ARG  42  -0.661  -6.186   4.733
  327    HA   ARG  42           HA       ARG  42   0.063  -3.692   6.089
  328   1HB   ARG  42          1HB       ARG  42   1.962  -4.869   6.597
  329   2HB   ARG  42          2HB       ARG  42   1.000  -6.237   6.124
  330   1HG   ARG  42          1HG       ARG  42   2.809  -4.719   4.288
  331   2HG   ARG  42          2HG       ARG  42   3.239  -6.218   5.109
  332   1HD   ARG  42          1HD       ARG  42   0.730  -6.222   3.526
  333   2HD   ARG  42          2HD       ARG  42   2.262  -6.214   2.639
  334    HE   ARG  42           HE       ARG  42   2.411  -8.107   4.790
  335   1HH1  ARG  42          1HH2      ARG  42   3.136  -8.685   1.917
  336   2HH1  ARG  42          2HH2      ARG  42   1.950  -9.874   1.488
  337   1HH2  ARG  42          1HH1      ARG  42  -0.120  -9.169   4.178
  338   2HH2  ARG  42          2HH1      ARG  42   0.110 -10.148   2.767
  339    H    ASN  43           H        ASN  43   0.008  -4.869   2.842
  340    HA   ASN  43           HA       ASN  43   1.880  -2.812   1.838
  341   1HB   ASN  43          1HB       ASN  43   1.651  -5.268   1.070
  342   2HB   ASN  43          2HB       ASN  43   0.165  -4.755   0.269
  343   1HD2  ASN  43          1HD2      ASN  43   3.698  -4.313   0.299
  344   2HD2  ASN  43          2HD2      ASN  43   3.790  -3.592  -1.234
  345    H    ASN  44           H        ASN  44  -0.161  -1.545   3.042
  346    HA   ASN  44           HA       ASN  44  -1.531  -0.155   0.843
  347   1HB   ASN  44          1HB       ASN  44  -3.052  -1.987   1.156
  348   2HB   ASN  44          2HB       ASN  44  -2.897  -1.904   2.909
  349   1HD2  ASN  44          1HD2      ASN  44  -5.455  -1.834   2.178
  350   2HD2  ASN  44          2HD2      ASN  44  -6.101  -0.255   2.195
  351    H    PHE  45           H        PHE  45   0.051   1.355   1.971
  352    HA   PHE  45           HA       PHE  45  -0.620   2.219   4.696
  353   1HB   PHE  45          1HB       PHE  45   1.286   3.431   2.673
  354   2HB   PHE  45          2HB       PHE  45   1.374   3.546   4.431
  355    HD1  PHE  45           1HD      PHE  45   2.020   1.555   5.790
  356    HD2  PHE  45           2HD      PHE  45   2.008   1.432   1.494
  357    HE1  PHE  45           1HE      PHE  45   3.355  -0.538   5.846
  358    HE2  PHE  45           2HE      PHE  45   3.344  -0.661   1.548
  359    HZ   PHE  45           HZ       PHE  45   4.020  -1.665   3.724
  360    H    LYS  46           H        LYS  46  -1.878   3.958   5.208
  361    HA   LYS  46           HA       LYS  46  -3.664   5.162   3.361
  362   1HB   LYS  46          1HB       LYS  46  -4.179   5.077   5.687
  363   2HB   LYS  46          2HB       LYS  46  -2.659   5.860   6.125
  364   1HG   LYS  46          1HG       LYS  46  -4.515   7.463   6.286
  365   2HG   LYS  46          2HG       LYS  46  -3.423   7.930   4.981
  366   1HD   LYS  46          1HD       LYS  46  -4.957   6.677   3.396
  367   2HD   LYS  46          2HD       LYS  46  -6.092   6.515   4.736
  368   1HE   LYS  46          1HE       LYS  46  -5.035   9.156   3.655
  369   2HE   LYS  46          2HE       LYS  46  -6.653   8.493   3.351
  370   1HZ   LYS  46          1HZ       LYS  46  -6.655  10.001   5.260
  371   2HZ   LYS  46          2HZ       LYS  46  -5.465   9.058   6.025
  372   3HZ   LYS  46          3HZ       LYS  46  -7.014   8.417   5.748
  373    H    SER  47           H        SER  47  -0.365   5.996   4.143
  374    HA   SER  47           HA       SER  47  -0.583   8.344   2.305
  375   1HB   SER  47          1HB       SER  47   0.607   9.718   3.939
  376   2HB   SER  47          2HB       SER  47  -0.842   9.051   4.683
  377    HG   SER  47           HG       SER  47   0.407   8.184   6.096
  378    H    ALA  48           H        ALA  48   1.570   9.047   1.519
  379    HA   ALA  48           HA       ALA  48   3.255   6.839   0.764
  380   1HB   ALA  48          1HB       ALA  48   3.058   8.801  -0.625
  381   2HB   ALA  48          2HB       ALA  48   4.716   8.782  -0.026
  382   3HB   ALA  48          3HB       ALA  48   3.527   9.861   0.703
  383    H    GLU  49           H        GLU  49   3.245   9.103   3.432
  384    HA   GLU  49           HA       GLU  49   5.991   8.628   4.287
  385   1HB   GLU  49          1HB       GLU  49   3.503   9.807   5.555
  386   2HB   GLU  49          2HB       GLU  49   5.068   9.777   6.369
  387   1HG   GLU  49          1HG       GLU  49   6.042  10.988   4.396
  388   2HG   GLU  49          2HG       GLU  49   4.413  11.127   3.731
  389    H    ASP  50           H        ASP  50   2.869   7.127   4.864
  390    HA   ASP  50           HA       ASP  50   3.705   5.598   7.203
  391   1HB   ASP  50          1HB       ASP  50   1.387   5.607   5.268
  392   2HB   ASP  50          2HB       ASP  50   1.527   4.353   6.502
  393    H    CYS  51           H        CYS  51   3.663   5.133   3.715
  394    HA   CYS  51           HA       CYS  51   4.319   2.275   3.845
  395   1HB   CYS  51          1HB       CYS  51   3.024   3.311   2.007
  396   2HB   CYS  51          2HB       CYS  51   4.409   4.326   1.604
  397    H    MET  52           H        MET  52   6.039   5.317   3.092
  398    HA   MET  52           HA       MET  52   8.602   4.039   2.631
  399   1HB   MET  52          1HB       MET  52   7.429   6.749   2.813
  400   2HB   MET  52          2HB       MET  52   9.137   6.655   3.245
  401   1HG   MET  52          1HG       MET  52   8.796   5.034   0.945
  402   2HG   MET  52          2HG       MET  52   7.929   6.537   0.631
  403   1HE   MET  52          1HE       MET  52  12.122   5.845  -0.147
  404   2HE   MET  52          2HE       MET  52  10.595   5.063  -0.545
  405   3HE   MET  52          3HE       MET  52  11.342   4.774   1.024
  406    H    ARG  53           H        ARG  53   7.214   5.816   5.431
  407    HA   ARG  53           HA       ARG  53   9.507   5.591   7.121
  408   1HB   ARG  53          1HB       ARG  53   7.992   6.273   8.829
  409   2HB   ARG  53          2HB       ARG  53   7.327   6.964   7.351
  410   1HG   ARG  53          1HG       ARG  53   5.423   5.974   8.238
  411   2HG   ARG  53          2HG       ARG  53   6.032   4.642   7.256
  412   1HD   ARG  53          1HD       ARG  53   6.823   3.466   9.126
  413   2HD   ARG  53          2HD       ARG  53   6.954   4.936  10.113
  414    HE   ARG  53           HE       ARG  53   4.219   4.384   9.248
  415   1HH1  ARG  53          1HH1      ARG  53   6.102   5.038  11.885
  416   2HH1  ARG  53          2HH1      ARG  53   5.266   4.002  12.992
  417   1HH2  ARG  53          1HH2      ARG  53   3.377   2.454  10.537
  418   2HH2  ARG  53          2HH2      ARG  53   3.726   2.542  12.231
  419    H    THR  54           H        THR  54   7.305   3.233   5.967
  420    HA   THR  54           HA       THR  54   7.829   1.334   8.184
  421    HB   THR  54           HB       THR  54   6.135   1.221   5.657
  422    HG1  THR  54           1HG      THR  54   4.676   2.091   6.874
  423   1HG2  THR  54          1HG2      THR  54   7.013  -0.988   6.578
  424   2HG2  THR  54          2HG2      THR  54   5.261  -0.837   6.448
  425   3HG2  THR  54          3HG2      THR  54   6.048  -0.659   8.016
  426    H    CYS  55           H        CYS  55   8.092   1.344   4.609
  427    HA   CYS  55           HA       CYS  55  10.295  -0.678   4.854
  428   1HB   CYS  55          1HB       CYS  55   8.415  -0.046   2.559
  429   2HB   CYS  55          2HB       CYS  55   9.540  -1.403   2.639
  430    H    GLY  56           H        GLY  56  10.441   2.388   4.884
  431   1HA   GLY  56          1HA       GLY  56  11.632   3.128   2.333
  432   2HA   GLY  56          2HA       GLY  56  11.656   4.101   3.807
  433    H    GLY  57           H        GLY  57  13.974   4.367   2.847
  434   1HA   GLY  57          1HA       GLY  57  16.106   3.896   4.122
  435   2HA   GLY  57          2HA       GLY  57  15.705   2.186   3.950
  436    H    ALA  58           H        ALA  58  14.658   3.257   1.135
  437    HA   ALA  58           HA       ALA  58  16.640   2.176  -0.510
  438   1HB   ALA  58          1HB       ALA  58  14.378   4.063  -0.723
  439   2HB   ALA  58          2HB       ALA  58  14.755   2.650  -1.708
  440   3HB   ALA  58          3HB       ALA  58  15.557   4.188  -2.028
  Start of MODEL    6
    1   1H    ARG   1          1H        ARG   1  14.101  -6.387   6.019
    2   2H    ARG   1          2H        ARG   1  14.884  -5.420   4.862
    3   3H    ARG   1          3H        ARG   1  14.325  -6.969   4.441
    4    HA   ARG   1           HA       ARG   1  12.579  -4.695   5.241
    5   1HB   ARG   1          1HB       ARG   1  13.440  -4.071   3.179
    6   2HB   ARG   1          2HB       ARG   1  13.718  -5.735   2.670
    7   1HG   ARG   1          1HG       ARG   1  11.278  -6.045   2.389
    8   2HG   ARG   1          2HG       ARG   1  11.012  -4.375   2.888
    9   1HD   ARG   1          1HD       ARG   1  12.388  -5.377   0.379
   10   2HD   ARG   1          2HD       ARG   1  11.019  -4.255   0.506
   11    HE   ARG   1           HE       ARG   1  12.596  -2.585   1.440
   12   1HH1  ARG   1          1HH2      ARG   1  13.658  -4.479  -1.039
   13   2HH1  ARG   1          2HH2      ARG   1  15.353  -4.265  -0.752
   14   1HH2  ARG   1          1HH1      ARG   1  14.907  -2.724   2.323
   15   2HH2  ARG   1          2HH1      ARG   1  16.059  -3.272   1.152
   16    HA   PRO   2           HA       PRO   2   9.606  -7.860   5.929
   17   1HB   PRO   2          1HB       PRO   2   7.356  -6.365   5.463
   18   2HB   PRO   2          2HB       PRO   2   8.308  -6.261   6.952
   19   1HG   PRO   2          1HG       PRO   2   8.348  -4.511   4.526
   20   2HG   PRO   2          2HG       PRO   2   8.387  -4.050   6.235
   21   1HD   PRO   2          1HD       PRO   2  10.610  -4.095   4.687
   22   2HD   PRO   2          2HD       PRO   2  10.651  -4.503   6.420
   23    H    ASP   3           H        ASP   3   8.095  -9.165   4.768
   24    HA   ASP   3           HA       ASP   3   8.522  -9.238   1.887
   25   1HB   ASP   3          1HB       ASP   3   6.856 -11.160   2.138
   26   2HB   ASP   3          2HB       ASP   3   8.320 -11.298   3.111
   27    H    PHE   4           H        PHE   4   5.987  -8.060   4.065
   28    HA   PHE   4           HA       PHE   4   3.925  -7.826   2.043
   29   1HB   PHE   4          1HB       PHE   4   2.751  -6.602   3.723
   30   2HB   PHE   4          2HB       PHE   4   3.724  -7.778   4.601
   31    HD1  PHE   4           1HD      PHE   4   3.854  -4.230   3.340
   32    HD2  PHE   4           2HD      PHE   4   5.140  -7.064   6.310
   33    HE1  PHE   4           1HE      PHE   4   4.930  -2.415   4.618
   34    HE2  PHE   4           2HE      PHE   4   6.218  -5.230   7.583
   35    HZ   PHE   4           HZ       PHE   4   6.106  -2.903   6.731
   36    H    CYS   5           H        CYS   5   6.788  -6.077   2.669
   37    HA   CYS   5           HA       CYS   5   5.947  -3.532   1.522
   38   1HB   CYS   5          1HB       CYS   5   7.683  -3.524   3.140
   39   2HB   CYS   5          2HB       CYS   5   8.527  -4.862   2.365
   40    H    LEU   6           H        LEU   6   7.405  -6.523   0.372
   41    HA   LEU   6           HA       LEU   6   7.914  -5.345  -2.317
   42   1HB   LEU   6          1HB       LEU   6   8.374  -8.157  -1.280
   43   2HB   LEU   6          2HB       LEU   6   9.133  -7.398  -2.682
   44    HG   LEU   6           HG       LEU   6   9.418  -6.383   0.157
   45   1HD1  LEU   6          1HD1      LEU   6  10.499  -8.526   0.092
   46   2HD1  LEU   6          2HD1      LEU   6  11.776  -7.325  -0.105
   47   3HD1  LEU   6          3HD1      LEU   6  11.172  -8.209  -1.506
   48   1HD2  LEU   6          1HD2      LEU   6  10.313  -5.516  -2.532
   49   2HD2  LEU   6          2HD2      LEU   6  11.557  -5.479  -1.283
   50   3HD2  LEU   6          3HD2      LEU   6  10.065  -4.563  -1.070
   51    H    GLU   7           H        GLU   7   5.455  -6.920  -0.612
   52    HA   GLU   7           HA       GLU   7   4.360  -8.555  -2.756
   53   1HB   GLU   7          1HB       GLU   7   3.620  -7.612  -0.022
   54   2HB   GLU   7          2HB       GLU   7   2.312  -8.187  -1.055
   55   1HG   GLU   7          1HG       GLU   7   4.859  -9.749  -0.556
   56   2HG   GLU   7          2HG       GLU   7   3.381  -9.976   0.379
   57    HA   PRO   8           HA       PRO   8   2.135  -5.468  -4.939
   58   1HB   PRO   8          1HB       PRO   8  -0.114  -6.845  -5.678
   59   2HB   PRO   8          2HB       PRO   8   1.479  -7.124  -6.410
   60   1HG   PRO   8          1HG       PRO   8   0.033  -8.686  -4.326
   61   2HG   PRO   8          2HG       PRO   8   1.047  -9.254  -5.659
   62   1HD   PRO   8          1HD       PRO   8   1.871  -9.071  -3.040
   63   2HD   PRO   8          2HD       PRO   8   2.967  -9.027  -4.438
   64    HA   PRO   9           HA       PRO   9  -0.793  -3.610  -2.248
   65   1HB   PRO   9          1HB       PRO   9  -2.391  -2.253  -4.023
   66   2HB   PRO   9          2HB       PRO   9  -0.751  -1.736  -3.587
   67   1HG   PRO   9          1HG       PRO   9  -1.714  -3.202  -6.000
   68   2HG   PRO   9          2HG       PRO   9  -0.488  -1.930  -5.864
   69   1HD   PRO   9          1HD       PRO   9   0.094  -4.593  -6.111
   70   2HD   PRO   9          2HD       PRO   9   1.161  -3.420  -5.305
   71    H    TYR  10           H        TYR  10  -3.275  -3.448  -1.885
   72    HA   TYR  10           HA       TYR  10  -4.688  -5.823  -3.076
   73   1HB   TYR  10          1HB       TYR  10  -3.604  -6.126  -0.772
   74   2HB   TYR  10          2HB       TYR  10  -4.788  -4.964  -0.176
   75    HD1  TYR  10           1HD      TYR  10  -6.926  -5.691   0.453
   76    HD2  TYR  10           2HD      TYR  10  -4.529  -8.154  -2.125
   77    HE1  TYR  10           1HE      TYR  10  -8.627  -7.489   0.589
   78    HE2  TYR  10           2HE      TYR  10  -6.230  -9.953  -1.988
   79    HH   TYR  10           HH       TYR  10  -8.806 -10.013  -1.502
   80    H    THR  11           H        THR  11  -6.017  -4.483  -4.378
   81    HA   THR  11           HA       THR  11  -7.417  -2.156  -3.503
   82    HB   THR  11           HB       THR  11  -7.748  -4.267  -5.627
   83    HG1  THR  11           1HG      THR  11  -6.282  -2.533  -5.877
   84   1HG2  THR  11          1HG2      THR  11  -9.784  -2.233  -4.768
   85   2HG2  THR  11          2HG2      THR  11 -10.029  -3.896  -5.300
   86   3HG2  THR  11          3HG2      THR  11  -9.633  -2.644  -6.477
   87    H    GLY  12           H        GLY  12  -7.841  -5.545  -2.899
   88   1HA   GLY  12          1HA       GLY  12  -9.314  -6.644  -1.421
   89   2HA   GLY  12          2HA       GLY  12  -9.848  -5.058  -0.868
   90    HA   PRO  13           HA       PRO  13 -12.786  -7.069  -4.062
   91   1HB   PRO  13          1HB       PRO  13 -14.211  -8.855  -2.554
   92   2HB   PRO  13          2HB       PRO  13 -12.762  -9.304  -3.476
   93   1HG   PRO  13          1HG       PRO  13 -13.089  -8.765  -0.567
   94   2HG   PRO  13          2HG       PRO  13 -12.068  -9.956  -1.386
   95   1HD   PRO  13          1HD       PRO  13 -11.171  -7.563  -0.350
   96   2HD   PRO  13          2HD       PRO  13 -10.355  -8.468  -1.644
   97    H    CYS  14           H        CYS  14 -13.086  -4.659  -2.978
   98    HA   CYS  14           HA       CYS  14 -15.788  -4.704  -1.670
   99   1HB   CYS  14          1HB       CYS  14 -13.231  -3.322  -1.046
  100   2HB   CYS  14          2HB       CYS  14 -14.696  -2.359  -0.857
  101    H    LYS  15           H        LYS  15 -16.457  -2.077  -1.850
  102    HA   LYS  15           HA       LYS  15 -16.531  -1.616  -4.803
  103   1HB   LYS  15          1HB       LYS  15 -18.414  -1.563  -2.619
  104   2HB   LYS  15          2HB       LYS  15 -18.371   0.022  -3.394
  105   1HG   LYS  15          1HG       LYS  15 -19.122  -0.805  -5.424
  106   2HG   LYS  15          2HG       LYS  15 -18.445  -2.409  -5.139
  107   1HD   LYS  15          1HD       LYS  15 -20.241  -2.390  -3.156
  108   2HD   LYS  15          2HD       LYS  15 -21.046  -1.250  -4.235
  109   1HE   LYS  15          1HE       LYS  15 -21.530  -2.881  -5.778
  110   2HE   LYS  15          2HE       LYS  15 -19.982  -3.711  -5.525
  111   1HZ   LYS  15          1HZ       LYS  15 -20.797  -4.860  -3.753
  112   2HZ   LYS  15          2HZ       LYS  15 -22.268  -4.647  -4.576
  113   3HZ   LYS  15          3HZ       LYS  15 -21.858  -3.623  -3.283
  114    H    ALA  16           H        ALA  16 -15.734  -0.091  -1.707
  115    HA   ALA  16           HA       ALA  16 -15.446   2.603  -2.549
  116   1HB   ALA  16          1HB       ALA  16 -13.520   2.298  -0.657
  117   2HB   ALA  16          2HB       ALA  16 -14.435   0.811  -0.404
  118   3HB   ALA  16          3HB       ALA  16 -15.239   2.375  -0.273
  119    H    ARG  17           H        ARG  17 -13.518   3.768  -3.209
  120    HA   ARG  17           HA       ARG  17 -11.247   2.115  -4.217
  121   1HB   ARG  17          1HB       ARG  17 -11.460   3.458  -6.376
  122   2HB   ARG  17          2HB       ARG  17 -12.750   2.289  -6.091
  123   1HG   ARG  17          1HG       ARG  17 -14.296   3.958  -5.506
  124   2HG   ARG  17          2HG       ARG  17 -13.031   5.129  -5.129
  125   1HD   ARG  17          1HD       ARG  17 -12.510   5.419  -7.480
  126   2HD   ARG  17          2HD       ARG  17 -13.576   4.071  -7.929
  127    HE   ARG  17           HE       ARG  17 -15.481   5.458  -7.088
  128   1HH1  ARG  17          1HH2      ARG  17 -14.267   6.956  -9.390
  129   2HH1  ARG  17          2HH2      ARG  17 -14.097   8.550  -8.732
  130   1HH2  ARG  17          1HH1      ARG  17 -14.464   7.521  -5.443
  131   2HH2  ARG  17          2HH1      ARG  17 -14.212   8.870  -6.500
  132    H    ILE  18           H        ILE  18 -10.306   3.262  -2.265
  133    HA   ILE  18           HA       ILE  18  -9.877   6.178  -2.567
  134    HB   ILE  18           HB       ILE  18  -8.765   4.303  -0.470
  135   1HG1  ILE  18          1HG1      ILE  18 -11.494   5.628  -0.452
  136   2HG1  ILE  18          2HG1      ILE  18 -11.228   3.916  -0.783
  137   1HG2  ILE  18          1HG2      ILE  18  -7.948   6.298   0.223
  138   2HG2  ILE  18          2HG2      ILE  18  -9.605   6.666   0.699
  139   3HG2  ILE  18          3HG2      ILE  18  -8.998   7.200  -0.869
  140   1HD1  ILE  18          1HD1      ILE  18 -11.479   3.686   1.471
  141   2HD1  ILE  18          2HD1      ILE  18 -11.120   5.385   1.780
  142   3HD1  ILE  18          3HD1      ILE  18  -9.804   4.238   1.531
  143    H    ILE  19           H        ILE  19  -7.646   7.035  -2.498
  144    HA   ILE  19           HA       ILE  19  -5.796   5.384  -4.121
  145    HB   ILE  19           HB       ILE  19  -5.761   8.271  -3.177
  146   1HG1  ILE  19          1HG1      ILE  19  -7.614   7.707  -4.728
  147   2HG1  ILE  19          2HG1      ILE  19  -6.431   8.769  -5.494
  148   1HG2  ILE  19          1HG2      ILE  19  -3.841   8.617  -4.433
  149   2HG2  ILE  19          2HG2      ILE  19  -4.162   7.243  -5.491
  150   3HG2  ILE  19          3HG2      ILE  19  -3.548   6.975  -3.860
  151   1HD1  ILE  19          1HD1      ILE  19  -6.857   7.073  -7.105
  152   2HD1  ILE  19          2HD1      ILE  19  -6.815   5.797  -5.889
  153   3HD1  ILE  19          3HD1      ILE  19  -5.324   6.610  -6.364
  154    H    ARG  20           H        ARG  20  -5.246   3.890  -2.321
  155    HA   ARG  20           HA       ARG  20  -3.925   4.953   0.070
  156   1HB   ARG  20          1HB       ARG  20  -4.552   2.270  -1.135
  157   2HB   ARG  20          2HB       ARG  20  -3.427   2.372   0.218
  158   1HG   ARG  20          1HG       ARG  20  -6.300   3.344   0.161
  159   2HG   ARG  20          2HG       ARG  20  -5.657   1.997   1.100
  160   1HD   ARG  20          1HD       ARG  20  -5.515   3.599   2.752
  161   2HD   ARG  20          2HD       ARG  20  -4.005   4.019   1.920
  162    HE   ARG  20           HE       ARG  20  -5.650   5.517   0.484
  163   1HH1  ARG  20          1HH2      ARG  20  -7.050   4.497   3.337
  164   2HH1  ARG  20          2HH2      ARG  20  -7.354   6.080   3.968
  165   1HH2  ARG  20          1HH1      ARG  20  -5.526   7.701   1.509
  166   2HH2  ARG  20          2HH1      ARG  20  -6.490   7.894   2.935
  167    H    TYR  21           H        TYR  21  -1.662   3.893   0.570
  168    HA   TYR  21           HA       TYR  21   0.062   4.291  -1.847
  169   1HB   TYR  21          1HB       TYR  21   0.329   4.929   1.087
  170   2HB   TYR  21          2HB       TYR  21   1.754   4.844   0.053
  171    HD1  TYR  21           1HD      TYR  21   2.077   6.437  -1.789
  172    HD2  TYR  21           2HD      TYR  21  -1.324   6.685   0.820
  173    HE1  TYR  21           1HE      TYR  21   1.612   8.729  -2.615
  174    HE2  TYR  21           2HE      TYR  21  -1.791   8.978  -0.005
  175    HH   TYR  21           HH       TYR  21  -0.359  10.254  -2.781
  176    H    PHE  22           H        PHE  22   1.768   2.838  -2.188
  177    HA   PHE  22           HA       PHE  22   2.161   0.600  -0.277
  178   1HB   PHE  22          1HB       PHE  22   1.540  -1.063  -1.842
  179   2HB   PHE  22          2HB       PHE  22   0.309   0.168  -2.035
  180    HD1  PHE  22           1HD      PHE  22   3.259  -1.420  -3.541
  181    HD2  PHE  22           2HD      PHE  22   0.254   1.614  -4.013
  182    HE1  PHE  22           1HE      PHE  22   3.853  -1.205  -5.939
  183    HE2  PHE  22           2HE      PHE  22   0.851   1.832  -6.410
  184    HZ   PHE  22           HZ       PHE  22   2.648   0.421  -7.374
  185    H    TYR  23           H        TYR  23   4.182  -0.521  -0.712
  186    HA   TYR  23           HA       TYR  23   6.238   1.262  -1.814
  187   1HB   TYR  23          1HB       TYR  23   6.499  -0.086   0.253
  188   2HB   TYR  23          2HB       TYR  23   6.380  -1.561  -0.707
  189    HD1  TYR  23           1HD      TYR  23   8.344  -2.522  -1.535
  190    HD2  TYR  23           2HD      TYR  23   8.303   1.668  -0.589
  191    HE1  TYR  23           1HE      TYR  23  10.762  -2.386  -2.048
  192    HE2  TYR  23           2HE      TYR  23  10.723   1.807  -1.116
  193    HH   TYR  23           HH       TYR  23  12.732  -0.430  -1.108
  194    H    ASN  24           H        ASN  24   6.581   1.280  -4.022
  195    HA   ASN  24           HA       ASN  24   5.904  -1.030  -5.702
  196   1HB   ASN  24          1HB       ASN  24   5.530   1.275  -6.434
  197   2HB   ASN  24          2HB       ASN  24   7.237   1.648  -6.222
  198   1HD2  ASN  24          1HD2      ASN  24   5.674   1.759  -8.758
  199   2HD2  ASN  24          2HD2      ASN  24   6.428   0.674  -9.823
  200    H    ALA  25           H        ALA  25   7.471  -2.561  -4.668
  201    HA   ALA  25           HA       ALA  25  10.215  -2.295  -4.379
  202   1HB   ALA  25          1HB       ALA  25  10.106  -4.798  -5.264
  203   2HB   ALA  25          2HB       ALA  25   8.368  -4.500  -5.230
  204   3HB   ALA  25          3HB       ALA  25   9.317  -4.352  -3.752
  205    H    LYS  26           H        LYS  26   8.390  -2.426  -7.371
  206    HA   LYS  26           HA       LYS  26  10.706  -2.922  -9.084
  207   1HB   LYS  26          1HB       LYS  26   7.970  -1.783  -9.740
  208   2HB   LYS  26          2HB       LYS  26   9.075  -2.588 -10.854
  209   1HG   LYS  26          1HG       LYS  26   7.710  -3.850  -8.455
  210   2HG   LYS  26          2HG       LYS  26   7.329  -4.154 -10.149
  211   1HD   LYS  26          1HD       LYS  26   9.512  -5.134 -10.525
  212   2HD   LYS  26          2HD       LYS  26  10.049  -4.666  -8.911
  213   1HE   LYS  26          1HE       LYS  26   7.880  -6.685  -9.593
  214   2HE   LYS  26          2HE       LYS  26   9.441  -7.012  -8.811
  215   1HZ   LYS  26          1HZ       LYS  26   8.161  -6.716  -6.962
  216   2HZ   LYS  26          2HZ       LYS  26   7.042  -5.707  -7.749
  217   3HZ   LYS  26          3HZ       LYS  26   8.542  -5.087  -7.247
  218    H    ALA  27           H        ALA  27   9.179  -0.127  -7.634
  219    HA   ALA  27           HA       ALA  27  10.649   1.730  -9.448
  220   1HB   ALA  27          1HB       ALA  27   9.202   3.403  -8.432
  221   2HB   ALA  27          2HB       ALA  27   8.700   2.263  -7.185
  222   3HB   ALA  27          3HB       ALA  27   8.216   2.005  -8.860
  223    H    GLY  28           H        GLY  28  10.662   0.496  -6.158
  224   1HA   GLY  28          1HA       GLY  28  12.677   0.564  -4.797
  225   2HA   GLY  28          2HA       GLY  28  13.179   2.010  -5.674
  226    H    LEU  29           H        LEU  29   9.989   2.487  -5.142
  227    HA   LEU  29           HA       LEU  29  10.296   3.534  -2.370
  228   1HB   LEU  29          1HB       LEU  29   9.477   5.719  -3.146
  229   2HB   LEU  29          2HB       LEU  29  10.933   5.276  -4.037
  230    HG   LEU  29           HG       LEU  29   8.451   4.291  -5.271
  231   1HD1  LEU  29          1HD1      LEU  29   7.694   6.466  -6.079
  232   2HD1  LEU  29          2HD1      LEU  29   8.980   7.278  -5.186
  233   3HD1  LEU  29          3HD1      LEU  29   7.677   6.469  -4.315
  234   1HD2  LEU  29          1HD2      LEU  29  10.485   4.144  -6.508
  235   2HD2  LEU  29          2HD2      LEU  29  10.923   5.810  -6.131
  236   3HD2  LEU  29          3HD2      LEU  29   9.597   5.476  -7.246
  237    H    CYS  30           H        CYS  30   7.740   5.055  -2.951
  238    HA   CYS  30           HA       CYS  30   5.866   2.710  -2.910
  239   1HB   CYS  30          1HB       CYS  30   5.925   5.310  -1.354
  240   2HB   CYS  30          2HB       CYS  30   4.542   4.215  -1.350
  241    H    GLN  31           H        GLN  31   3.691   3.182  -3.704
  242    HA   GLN  31           HA       GLN  31   3.399   5.643  -5.358
  243   1HB   GLN  31          1HB       GLN  31   3.215   2.759  -6.277
  244   2HB   GLN  31          2HB       GLN  31   2.609   4.113  -7.228
  245   1HG   GLN  31          1HG       GLN  31   5.189   4.891  -6.479
  246   2HG   GLN  31          2HG       GLN  31   5.348   3.180  -6.881
  247   1HE2  GLN  31          1HE2      GLN  31   6.532   3.829  -8.878
  248   2HE2  GLN  31          2HE2      GLN  31   5.676   4.424 -10.218
  249    H    THR  32           H        THR  32   1.041   5.768  -6.156
  250    HA   THR  32           HA       THR  32  -0.727   4.982  -3.916
  251    HB   THR  32           HB       THR  32  -2.300   6.444  -5.450
  252    HG1  THR  32           1HG      THR  32  -0.664   7.934  -6.546
  253   1HG2  THR  32          1HG2      THR  32  -0.672   8.477  -4.647
  254   2HG2  THR  32          2HG2      THR  32  -0.073   7.157  -3.641
  255   3HG2  THR  32          3HG2      THR  32  -1.775   7.617  -3.572
  256    H    PHE  33           H        PHE  33  -2.499   3.611  -4.154
  257    HA   PHE  33           HA       PHE  33  -3.040   2.437  -6.836
  258   1HB   PHE  33          1HB       PHE  33  -2.606   0.232  -6.107
  259   2HB   PHE  33          2HB       PHE  33  -1.292   1.160  -5.396
  260    HD1  PHE  33           1HD      PHE  33  -1.298   1.715  -2.970
  261    HD2  PHE  33           2HD      PHE  33  -4.339  -0.752  -4.743
  262    HE1  PHE  33           1HE      PHE  33  -1.991   0.961  -0.722
  263    HE2  PHE  33           2HE      PHE  33  -5.029  -1.516  -2.487
  264    HZ   PHE  33           HZ       PHE  33  -3.856  -0.660  -0.474
  265    H    VAL  34           H        VAL  34  -5.104   1.105  -6.747
  266    HA   VAL  34           HA       VAL  34  -7.174   2.604  -5.364
  267    HB   VAL  34           HB       VAL  34  -7.207  -0.005  -6.917
  268   1HG1  VAL  34          1HG1      VAL  34  -9.386   1.852  -5.947
  269   2HG1  VAL  34          2HG1      VAL  34  -9.261   0.107  -5.727
  270   3HG1  VAL  34          3HG1      VAL  34  -9.630   0.770  -7.318
  271   1HG2  VAL  34          1HG2      VAL  34  -6.403   2.356  -7.895
  272   2HG2  VAL  34          2HG2      VAL  34  -8.144   2.607  -8.023
  273   3HG2  VAL  34          3HG2      VAL  34  -7.386   1.247  -8.850
  274    H    TYR  35           H        TYR  35  -7.977   2.200  -3.350
  275    HA   TYR  35           HA       TYR  35  -7.284  -0.410  -2.037
  276   1HB   TYR  35          1HB       TYR  35  -6.290   1.575  -1.034
  277   2HB   TYR  35          2HB       TYR  35  -7.860   2.376  -0.979
  278    HD1  TYR  35           1HD      TYR  35  -7.341  -1.220  -0.258
  279    HD2  TYR  35           2HD      TYR  35  -7.958   2.691   1.410
  280    HE1  TYR  35           1HE      TYR  35  -7.788  -2.236   1.960
  281    HE2  TYR  35           2HE      TYR  35  -8.401   1.675   3.628
  282    HH   TYR  35           HH       TYR  35  -8.983  -0.340   4.642
  283    H    GLY  36           H        GLY  36  -8.992  -1.564  -0.998
  284   1HA   GLY  36          1HA       GLY  36 -11.721  -0.742  -1.821
  285   2HA   GLY  36          2HA       GLY  36 -11.257  -2.351  -1.276
  286    H    ALA  37           H        ALA  37  -9.902  -0.003   0.752
  287    HA   ALA  37           HA       ALA  37 -10.441   0.661   2.959
  288   1HB   ALA  37          1HB       ALA  37 -13.002   0.640   1.418
  289   2HB   ALA  37          2HB       ALA  37 -12.170   1.991   2.186
  290   3HB   ALA  37          3HB       ALA  37 -13.093   0.851   3.164
  291    H    CYS  38           H        CYS  38 -10.726  -2.376   1.940
  292    HA   CYS  38           HA       CYS  38 -11.487  -3.367   4.628
  293   1HB   CYS  38          1HB       CYS  38 -13.254  -4.769   3.778
  294   2HB   CYS  38          2HB       CYS  38 -13.552  -3.142   3.167
  295    H    ARG  39           H        ARG  39 -10.989  -5.746   4.816
  296    HA   ARG  39           HA       ARG  39  -9.303  -7.413   4.635
  297   1HB   ARG  39          1HB       ARG  39 -10.406  -6.912   1.865
  298   2HB   ARG  39          2HB       ARG  39  -9.269  -8.225   2.182
  299   1HG   ARG  39          1HG       ARG  39 -10.801  -9.128   3.901
  300   2HG   ARG  39          2HG       ARG  39 -11.937  -7.818   3.574
  301   1HD   ARG  39          1HD       ARG  39 -12.182  -8.606   1.242
  302   2HD   ARG  39          2HD       ARG  39 -11.023  -9.911   1.562
  303    HE   ARG  39           HE       ARG  39 -12.945 -10.115   3.588
  304   1HH1  ARG  39          1HH2      ARG  39 -14.306  -9.082   0.864
  305   2HH1  ARG  39          2HH2      ARG  39 -15.056 -10.566   0.384
  306   1HH2  ARG  39          1HH1      ARG  39 -13.305 -12.500   2.670
  307   2HH2  ARG  39          2HH1      ARG  39 -14.492 -12.502   1.408
  308    H    ALA  40           H        ALA  40  -8.254  -4.712   4.659
  309    HA   ALA  40           HA       ALA  40  -6.259  -4.443   2.537
  310   1HB   ALA  40          1HB       ALA  40  -6.188  -2.340   3.386
  311   2HB   ALA  40          2HB       ALA  40  -5.881  -2.931   5.018
  312   3HB   ALA  40          3HB       ALA  40  -7.533  -2.837   4.410
  313    H    LYS  41           H        LYS  41  -3.935  -4.504   2.931
  314    HA   LYS  41           HA       LYS  41  -3.137  -6.290   5.211
  315   1HB   LYS  41          1HB       LYS  41  -1.926  -6.094   2.434
  316   2HB   LYS  41          2HB       LYS  41  -1.557  -7.303   3.664
  317   1HG   LYS  41          1HG       LYS  41  -3.772  -8.245   3.503
  318   2HG   LYS  41          2HG       LYS  41  -4.319  -6.917   2.477
  319   1HD   LYS  41          1HD       LYS  41  -3.876  -8.642   0.932
  320   2HD   LYS  41          2HD       LYS  41  -2.406  -7.668   0.880
  321   1HE   LYS  41          1HE       LYS  41  -1.879 -10.097   1.061
  322   2HE   LYS  41          2HE       LYS  41  -1.340  -9.223   2.509
  323   1HZ   LYS  41          1HZ       LYS  41  -2.920 -11.360   2.611
  324   2HZ   LYS  41          2HZ       LYS  41  -4.107 -10.153   2.471
  325   3HZ   LYS  41          3HZ       LYS  41  -2.997 -10.112   3.757
  326    H    ARG  42           H        ARG  42  -0.396  -6.057   5.010
  327    HA   ARG  42           HA       ARG  42   0.099  -3.416   6.098
  328   1HB   ARG  42          1HB       ARG  42   2.089  -5.498   5.142
  329   2HB   ARG  42          2HB       ARG  42   2.347  -4.263   6.371
  330   1HG   ARG  42          1HG       ARG  42   0.419  -5.354   7.658
  331   2HG   ARG  42          2HG       ARG  42   0.565  -6.702   6.529
  332   1HD   ARG  42          1HD       ARG  42   3.123  -5.788   7.724
  333   2HD   ARG  42          2HD       ARG  42   1.982  -6.542   8.855
  334    HE   ARG  42           HE       ARG  42   3.023  -7.819   6.353
  335   1HH1  ARG  42          1HH1      ARG  42   0.247  -8.539   7.597
  336   2HH1  ARG  42          2HH1      ARG  42   0.673  -9.985   8.448
  337   1HH2  ARG  42          1HH2      ARG  42   4.088  -9.423   8.228
  338   2HH2  ARG  42          2HH2      ARG  42   2.848 -10.486   8.806
  339    H    ASN  43           H        ASN  43   0.177  -4.749   2.896
  340    HA   ASN  43           HA       ASN  43   2.007  -2.700   1.824
  341   1HB   ASN  43          1HB       ASN  43   1.598  -5.194   1.118
  342   2HB   ASN  43          2HB       ASN  43   0.224  -4.534   0.230
  343   1HD2  ASN  43          1HD2      ASN  43   3.680  -3.586   0.754
  344   2HD2  ASN  43          2HD2      ASN  43   3.979  -3.236  -0.879
  345    H    ASN  44           H        ASN  44   0.035  -1.300   3.033
  346    HA   ASN  44           HA       ASN  44  -1.304   0.077   0.808
  347   1HB   ASN  44          1HB       ASN  44  -2.859  -1.733   1.123
  348   2HB   ASN  44          2HB       ASN  44  -2.760  -1.596   2.877
  349   1HD2  ASN  44          1HD2      ASN  44  -5.300  -1.484   2.004
  350   2HD2  ASN  44          2HD2      ASN  44  -5.908   0.111   1.983
  351    H    PHE  45           H        PHE  45   0.157   1.706   1.864
  352    HA   PHE  45           HA       PHE  45  -0.534   2.578   4.594
  353   1HB   PHE  45          1HB       PHE  45   1.328   3.853   2.573
  354   2HB   PHE  45          2HB       PHE  45   1.409   3.965   4.332
  355    HD1  PHE  45           1HD      PHE  45   2.160   1.926   1.389
  356    HD2  PHE  45           2HD      PHE  45   2.092   1.975   5.685
  357    HE1  PHE  45           1HE      PHE  45   3.566  -0.118   1.432
  358    HE2  PHE  45           2HE      PHE  45   3.499  -0.068   5.729
  359    HZ   PHE  45           HZ       PHE  45   4.232  -1.123   3.602
  360    H    LYS  46           H        LYS  46  -1.543   4.561   5.081
  361    HA   LYS  46           HA       LYS  46  -3.465   5.572   3.177
  362   1HB   LYS  46          1HB       LYS  46  -3.886   5.524   5.560
  363   2HB   LYS  46          2HB       LYS  46  -2.451   6.497   5.882
  364   1HG   LYS  46          1HG       LYS  46  -3.452   8.393   4.676
  365   2HG   LYS  46          2HG       LYS  46  -4.875   7.418   4.303
  366   1HD   LYS  46          1HD       LYS  46  -5.376   7.196   6.694
  367   2HD   LYS  46          2HD       LYS  46  -3.910   8.088   7.104
  368   1HE   LYS  46          1HE       LYS  46  -4.902   9.995   5.645
  369   2HE   LYS  46          2HE       LYS  46  -6.436   9.114   5.796
  370   1HZ   LYS  46          1HZ       LYS  46  -4.756  10.328   7.898
  371   2HZ   LYS  46          2HZ       LYS  46  -5.734   8.992   8.281
  372   3HZ   LYS  46          3HZ       LYS  46  -6.437  10.421   7.690
  373    H    SER  47           H        SER  47  -0.198   6.524   4.063
  374    HA   SER  47           HA       SER  47  -0.366   8.722   2.040
  375   1HB   SER  47          1HB       SER  47   0.744  10.220   3.623
  376   2HB   SER  47          2HB       SER  47  -0.723   9.581   4.357
  377    HG   SER  47           HG       SER  47   1.728   9.398   5.278
  378    H    ALA  48           H        ALA  48   1.791   9.360   1.241
  379    HA   ALA  48           HA       ALA  48   3.530   7.138   0.720
  380   1HB   ALA  48          1HB       ALA  48   3.290   9.083  -0.752
  381   2HB   ALA  48          2HB       ALA  48   4.971   8.957  -0.233
  382   3HB   ALA  48          3HB       ALA  48   3.905  10.147   0.512
  383    H    GLU  49           H        GLU  49   3.380   9.486   3.295
  384    HA   GLU  49           HA       GLU  49   6.120   9.204   4.219
  385   1HB   GLU  49          1HB       GLU  49   4.542  11.121   4.638
  386   2HB   GLU  49          2HB       GLU  49   3.607  10.061   5.694
  387   1HG   GLU  49          1HG       GLU  49   4.981  10.865   7.323
  388   2HG   GLU  49          2HG       GLU  49   6.134   9.697   6.678
  389    H    ASP  50           H        ASP  50   3.104   7.478   4.775
  390    HA   ASP  50           HA       ASP  50   4.099   6.005   7.107
  391   1HB   ASP  50          1HB       ASP  50   1.641   6.401   5.583
  392   2HB   ASP  50          2HB       ASP  50   1.874   4.704   6.006
  393    H    CYS  51           H        CYS  51   3.890   5.548   3.625
  394    HA   CYS  51           HA       CYS  51   4.593   2.703   3.697
  395   1HB   CYS  51          1HB       CYS  51   3.221   3.806   1.928
  396   2HB   CYS  51          2HB       CYS  51   4.627   4.765   1.464
  397    H    MET  52           H        MET  52   6.260   5.768   2.907
  398    HA   MET  52           HA       MET  52   8.823   4.574   2.326
  399   1HB   MET  52          1HB       MET  52   7.983   6.862   1.679
  400   2HB   MET  52          2HB       MET  52   8.148   7.346   3.368
  401   1HG   MET  52          1HG       MET  52  10.431   7.435   3.249
  402   2HG   MET  52          2HG       MET  52  10.528   6.048   2.165
  403   1HE   MET  52          1HE       MET  52   9.654   7.261  -1.223
  404   2HE   MET  52          2HE       MET  52   9.508   6.005   0.005
  405   3HE   MET  52          3HE       MET  52  11.103   6.481  -0.574
  406    H    ARG  53           H        ARG  53   7.553   6.230   5.235
  407    HA   ARG  53           HA       ARG  53   9.814   5.871   6.915
  408   1HB   ARG  53          1HB       ARG  53   7.957   7.353   7.434
  409   2HB   ARG  53          2HB       ARG  53   6.829   5.997   7.454
  410   1HG   ARG  53          1HG       ARG  53   9.043   5.493   9.249
  411   2HG   ARG  53          2HG       ARG  53   8.281   7.035   9.637
  412   1HD   ARG  53          1HD       ARG  53   6.914   4.328   9.422
  413   2HD   ARG  53          2HD       ARG  53   7.088   5.329  10.877
  414    HE   ARG  53           HE       ARG  53   5.317   5.918   8.554
  415   1HH1  ARG  53          1HH2      ARG  53   4.091   5.761  11.202
  416   2HH1  ARG  53          2HH2      ARG  53   4.037   7.411  11.722
  417   1HH2  ARG  53          1HH1      ARG  53   6.359   8.503   9.393
  418   2HH2  ARG  53          2HH1      ARG  53   5.320   8.963  10.700
  419    H    THR  54           H        THR  54   7.482   3.586   5.756
  420    HA   THR  54           HA       THR  54   8.023   1.607   7.890
  421    HB   THR  54           HB       THR  54   6.268   1.801   5.438
  422    HG1  THR  54           1HG      THR  54   5.058   1.065   7.687
  423   1HG2  THR  54          1HG2      THR  54   6.291  -0.440   5.240
  424   2HG2  THR  54          2HG2      THR  54   5.566  -0.528   6.847
  425   3HG2  THR  54          3HG2      THR  54   7.318  -0.604   6.664
  426    H    CYS  55           H        CYS  55   8.473   1.901   4.350
  427    HA   CYS  55           HA       CYS  55  10.659  -0.146   4.561
  428   1HB   CYS  55          1HB       CYS  55   8.266  -0.572   3.431
  429   2HB   CYS  55          2HB       CYS  55   9.062   0.203   2.062
  430    H    GLY  56           H        GLY  56  11.213   2.614   4.773
  431   1HA   GLY  56          1HA       GLY  56  12.158   3.391   2.055
  432   2HA   GLY  56          2HA       GLY  56  12.012   4.488   3.430
  433    H    GLY  57           H        GLY  57  13.323   1.442   4.241
  434   1HA   GLY  57          1HA       GLY  57  15.943   2.675   4.746
  435   2HA   GLY  57          2HA       GLY  57  15.450   1.053   5.232
  436    H    ALA  58           H        ALA  58  15.959   2.875   2.182
  437    HA   ALA  58           HA       ALA  58  17.401   0.458   1.137
  438   1HB   ALA  58          1HB       ALA  58  16.332   0.868  -0.984
  439   2HB   ALA  58          2HB       ALA  58  15.724   2.431  -0.438
  440   3HB   ALA  58          3HB       ALA  58  15.067   0.941   0.242
  Start of MODEL    7
    1   1H    ARG   1          1H        ARG   1  14.914  -6.514   4.914
    2   2H    ARG   1          2H        ARG   1  14.824  -5.343   6.143
    3   3H    ARG   1          3H        ARG   1  15.612  -4.987   4.679
    4    HA   ARG   1           HA       ARG   1  13.224  -4.096   5.046
    5   1HB   ARG   1          1HB       ARG   1  14.826  -5.054   2.830
    6   2HB   ARG   1          2HB       ARG   1  13.112  -5.207   2.450
    7   1HG   ARG   1          1HG       ARG   1  13.505  -2.690   3.745
    8   2HG   ARG   1          2HG       ARG   1  14.714  -2.839   2.470
    9   1HD   ARG   1          1HD       ARG   1  12.823  -3.517   0.900
   10   2HD   ARG   1          2HD       ARG   1  11.695  -3.054   2.192
   11    HE   ARG   1           HE       ARG   1  12.387  -0.770   1.906
   12   1HH1  ARG   1          1HH1      ARG   1  14.529  -2.959   0.339
   13   2HH1  ARG   1          2HH1      ARG   1  15.162  -1.772  -0.752
   14   1HH2  ARG   1          1HH2      ARG   1  13.079   0.762   0.372
   15   2HH2  ARG   1          2HH2      ARG   1  14.340   0.333  -0.733
   16    HA   PRO   2           HA       PRO   2  10.234  -7.278   5.657
   17   1HB   PRO   2          1HB       PRO   2   8.019  -5.960   4.730
   18   2HB   PRO   2          2HB       PRO   2   8.754  -5.632   6.307
   19   1HG   PRO   2          1HG       PRO   2   9.003  -4.159   3.725
   20   2HG   PRO   2          2HG       PRO   2   8.873  -3.518   5.370
   21   1HD   PRO   2          1HD       PRO   2  11.220  -3.679   3.984
   22   2HD   PRO   2          2HD       PRO   2  11.127  -3.760   5.759
   23    H    ASP   3           H        ASP   3   8.805  -8.690   4.417
   24    HA   ASP   3           HA       ASP   3   9.563  -8.808   1.549
   25   1HB   ASP   3          1HB       ASP   3   9.385 -10.665   3.561
   26   2HB   ASP   3          2HB       ASP   3   7.825 -10.871   2.762
   27    H    PHE   4           H        PHE   4   6.822  -8.172   3.668
   28    HA   PHE   4           HA       PHE   4   4.766  -8.564   1.670
   29   1HB   PHE   4          1HB       PHE   4   3.346  -7.395   3.266
   30   2HB   PHE   4          2HB       PHE   4   4.392  -8.524   4.117
   31    HD1  PHE   4           1HD      PHE   4   3.728  -4.934   3.441
   32    HD2  PHE   4           2HD      PHE   4   6.151  -7.766   5.587
   33    HE1  PHE   4           1HE      PHE   4   4.561  -3.125   4.888
   34    HE2  PHE   4           2HE      PHE   4   6.987  -5.938   7.038
   35    HZ   PHE   4           HZ       PHE   4   6.190  -3.614   6.687
   36    H    CYS   5           H        CYS   5   6.932  -5.905   2.387
   37    HA   CYS   5           HA       CYS   5   5.459  -3.851   0.996
   38   1HB   CYS   5          1HB       CYS   5   8.337  -4.311   1.800
   39   2HB   CYS   5          2HB       CYS   5   7.847  -2.852   0.940
   40    H    LEU   6           H        LEU   6   7.666  -6.400   0.000
   41    HA   LEU   6           HA       LEU   6   8.106  -5.367  -2.695
   42   1HB   LEU   6          1HB       LEU   6   8.408  -8.214  -1.710
   43   2HB   LEU   6          2HB       LEU   6   9.347  -7.392  -2.955
   44    HG   LEU   6           HG       LEU   6   9.421  -6.941   0.036
   45   1HD1  LEU   6          1HD1      LEU   6  10.836  -8.695  -1.364
   46   2HD1  LEU   6          2HD1      LEU   6  11.591  -7.752  -0.079
   47   3HD1  LEU   6          3HD1      LEU   6  11.794  -7.269  -1.763
   48   1HD2  LEU   6          1HD2      LEU   6   9.432  -4.728  -0.839
   49   2HD2  LEU   6          2HD2      LEU   6  10.402  -5.200  -2.233
   50   3HD2  LEU   6          3HD2      LEU   6  11.135  -5.134  -0.631
   51    H    GLU   7           H        GLU   7   5.557  -7.009  -1.102
   52    HA   GLU   7           HA       GLU   7   4.542  -8.486  -3.416
   53   1HB   GLU   7          1HB       GLU   7   3.757  -7.875  -0.597
   54   2HB   GLU   7          2HB       GLU   7   2.489  -8.414  -1.697
   55   1HG   GLU   7          1HG       GLU   7   4.925 -10.005  -1.959
   56   2HG   GLU   7          2HG       GLU   7   4.270 -10.057  -0.322
   57    HA   PRO   8           HA       PRO   8   2.108  -5.337  -5.251
   58   1HB   PRO   8          1HB       PRO   8  -0.191  -6.689  -5.897
   59   2HB   PRO   8          2HB       PRO   8   1.344  -6.909  -6.762
   60   1HG   PRO   8          1HG       PRO   8   0.081  -8.594  -4.649
   61   2HG   PRO   8          2HG       PRO   8   0.965  -9.084  -6.102
   62   1HD   PRO   8          1HD       PRO   8   2.041  -9.065  -3.584
   63   2HD   PRO   8          2HD       PRO   8   3.001  -8.877  -5.069
   64    HA   PRO   9           HA       PRO   9  -0.576  -3.633  -2.227
   65   1HB   PRO   9          1HB       PRO   9  -2.250  -2.122  -3.790
   66   2HB   PRO   9          2HB       PRO   9  -0.574  -1.669  -3.427
   67   1HG   PRO   9          1HG       PRO   9  -1.730  -2.927  -5.870
   68   2HG   PRO   9          2HG       PRO   9  -0.461  -1.700  -5.722
   69   1HD   PRO   9          1HD       PRO   9   0.023  -4.352  -6.201
   70   2HD   PRO   9          2HD       PRO   9   1.177  -3.268  -5.392
   71    H    TYR  10           H        TYR  10  -2.940  -3.547  -1.570
   72    HA   TYR  10           HA       TYR  10  -4.460  -5.863  -2.752
   73   1HB   TYR  10          1HB       TYR  10  -3.515  -6.144  -0.454
   74   2HB   TYR  10          2HB       TYR  10  -4.451  -4.745   0.070
   75    HD1  TYR  10           1HD      TYR  10  -6.582  -5.101   0.955
   76    HD2  TYR  10           2HD      TYR  10  -4.912  -8.009  -1.731
   77    HE1  TYR  10           1HE      TYR  10  -8.561  -6.556   1.301
   78    HE2  TYR  10           2HE      TYR  10  -6.892  -9.464  -1.385
   79    HH   TYR  10           HH       TYR  10  -9.005  -9.529  -0.561
   80    H    THR  11           H        THR  11  -5.709  -4.611  -4.192
   81    HA   THR  11           HA       THR  11  -7.095  -2.202  -3.503
   82    HB   THR  11           HB       THR  11  -7.308  -4.384  -5.570
   83    HG1  THR  11           1HG      THR  11  -6.755  -2.677  -6.898
   84   1HG2  THR  11          1HG2      THR  11  -9.589  -3.976  -5.484
   85   2HG2  THR  11          2HG2      THR  11  -9.081  -2.707  -6.598
   86   3HG2  THR  11          3HG2      THR  11  -9.377  -2.325  -4.902
   87    H    GLY  12           H        GLY  12  -7.616  -5.563  -2.816
   88   1HA   GLY  12          1HA       GLY  12  -9.260  -6.635  -1.516
   89   2HA   GLY  12          2HA       GLY  12  -9.665  -5.040  -0.882
   90    HA   PRO  13           HA       PRO  13 -12.941  -6.632  -3.863
   91   1HB   PRO  13          1HB       PRO  13 -14.857  -7.346  -2.042
   92   2HB   PRO  13          2HB       PRO  13 -13.636  -8.474  -2.659
   93   1HG   PRO  13          1HG       PRO  13 -13.759  -7.020  -0.066
   94   2HG   PRO  13          2HG       PRO  13 -13.164  -8.649  -0.420
   95   1HD   PRO  13          1HD       PRO  13 -11.566  -6.428  -0.030
   96   2HD   PRO  13          2HD       PRO  13 -11.070  -7.890  -0.913
   97    H    CYS  14           H        CYS  14 -14.845  -5.760  -1.067
   98    HA   CYS  14           HA       CYS  14 -16.361  -3.947  -0.837
   99   1HB   CYS  14          1HB       CYS  14 -13.533  -3.055  -1.008
  100   2HB   CYS  14          2HB       CYS  14 -14.743  -1.778  -1.126
  101    H    LYS  15           H        LYS  15 -16.296  -1.392  -2.046
  102    HA   LYS  15           HA       LYS  15 -16.432  -1.907  -4.980
  103   1HB   LYS  15          1HB       LYS  15 -18.719  -0.479  -4.580
  104   2HB   LYS  15          2HB       LYS  15 -18.676  -2.237  -4.641
  105   1HG   LYS  15          1HG       LYS  15 -19.921  -1.429  -2.657
  106   2HG   LYS  15          2HG       LYS  15 -18.483  -2.336  -2.190
  107   1HD   LYS  15          1HD       LYS  15 -17.659  -0.546  -1.095
  108   2HD   LYS  15          2HD       LYS  15 -17.815   0.455  -2.538
  109   1HE   LYS  15          1HE       LYS  15 -20.300   0.666  -1.959
  110   2HE   LYS  15          2HE       LYS  15 -19.889  -0.043  -0.385
  111   1HZ   LYS  15          1HZ       LYS  15 -18.663   1.763   0.195
  112   2HZ   LYS  15          2HZ       LYS  15 -19.695   2.559  -0.894
  113   3HZ   LYS  15          3HZ       LYS  15 -18.146   2.072  -1.390
  114    H    ALA  16           H        ALA  16 -14.910  -0.161  -2.863
  115    HA   ALA  16           HA       ALA  16 -15.512   2.523  -4.034
  116   1HB   ALA  16          1HB       ALA  16 -14.498   1.429  -1.468
  117   2HB   ALA  16          2HB       ALA  16 -15.517   2.837  -1.764
  118   3HB   ALA  16          3HB       ALA  16 -13.771   2.948  -1.990
  119    H    ARG  17           H        ARG  17 -13.438   3.912  -4.269
  120    HA   ARG  17           HA       ARG  17 -11.144   2.268  -5.277
  121   1HB   ARG  17          1HB       ARG  17 -13.032   3.401  -6.873
  122   2HB   ARG  17          2HB       ARG  17 -11.900   4.746  -6.735
  123   1HG   ARG  17          1HG       ARG  17 -10.056   3.120  -7.361
  124   2HG   ARG  17          2HG       ARG  17 -11.319   1.941  -7.724
  125   1HD   ARG  17          1HD       ARG  17 -10.498   3.320  -9.724
  126   2HD   ARG  17          2HD       ARG  17 -12.251   3.372  -9.448
  127    HE   ARG  17           HE       ARG  17 -10.599   5.446  -8.107
  128   1HH1  ARG  17          1HH1      ARG  17 -12.200   4.615 -11.012
  129   2HH1  ARG  17          2HH1      ARG  17 -12.922   6.174 -11.232
  130   1HH2  ARG  17          1HH2      ARG  17 -11.777   7.425  -8.209
  131   2HH2  ARG  17          2HH2      ARG  17 -12.682   7.764  -9.647
  132    H    ILE  18           H        ILE  18 -10.413   3.068  -3.013
  133    HA   ILE  18           HA       ILE  18  -9.723   5.935  -2.858
  134    HB   ILE  18           HB       ILE  18  -9.275   3.543  -1.046
  135   1HG1  ILE  18          1HG1      ILE  18 -11.193   5.875  -0.774
  136   2HG1  ILE  18          2HG1      ILE  18 -11.646   4.323  -1.480
  137   1HG2  ILE  18          1HG2      ILE  18  -8.545   6.447  -0.815
  138   2HG2  ILE  18          2HG2      ILE  18  -7.629   5.024  -0.315
  139   3HG2  ILE  18          3HG2      ILE  18  -9.013   5.561   0.637
  140   1HD1  ILE  18          1HD1      ILE  18 -10.924   3.205   0.637
  141   2HD1  ILE  18          2HD1      ILE  18 -12.258   4.333   0.880
  142   3HD1  ILE  18          3HD1      ILE  18 -10.618   4.796   1.333
  143    H    ILE  19           H        ILE  19  -7.503   6.653  -2.605
  144    HA   ILE  19           HA       ILE  19  -5.563   4.957  -4.104
  145    HB   ILE  19           HB       ILE  19  -5.861   7.899  -3.474
  146   1HG1  ILE  19          1HG1      ILE  19  -7.135   6.915  -5.378
  147   2HG1  ILE  19          2HG1      ILE  19  -5.933   8.088  -5.917
  148   1HG2  ILE  19          1HG2      ILE  19  -3.472   6.408  -4.576
  149   2HG2  ILE  19          2HG2      ILE  19  -3.513   7.552  -3.234
  150   3HG2  ILE  19          3HG2      ILE  19  -3.735   8.125  -4.888
  151   1HD1  ILE  19          1HD1      ILE  19  -5.707   6.199  -7.369
  152   2HD1  ILE  19          2HD1      ILE  19  -5.762   5.068  -6.017
  153   3HD1  ILE  19          3HD1      ILE  19  -4.352   6.105  -6.243
  154    H    ARG  20           H        ARG  20  -4.845   3.607  -2.348
  155    HA   ARG  20           HA       ARG  20  -3.711   4.917   0.061
  156   1HB   ARG  20          1HB       ARG  20  -4.287   2.106  -0.862
  157   2HB   ARG  20          2HB       ARG  20  -3.270   2.391   0.549
  158   1HG   ARG  20          1HG       ARG  20  -6.062   3.523   0.198
  159   2HG   ARG  20          2HG       ARG  20  -5.687   2.069   1.122
  160   1HD   ARG  20          1HD       ARG  20  -5.425   3.500   2.888
  161   2HD   ARG  20          2HD       ARG  20  -3.878   3.923   2.127
  162    HE   ARG  20           HE       ARG  20  -5.705   5.473   0.753
  163   1HH1  ARG  20          1HH1      ARG  20  -7.225   5.150   3.435
  164   2HH1  ARG  20          2HH1      ARG  20  -6.760   6.617   4.229
  165   1HH2  ARG  20          1HH2      ARG  20  -4.149   7.284   2.048
  166   2HH2  ARG  20          2HH2      ARG  20  -5.019   7.825   3.443
  167    H    TYR  21           H        TYR  21  -1.482   3.731   0.705
  168    HA   TYR  21           HA       TYR  21   0.317   4.022  -1.668
  169   1HB   TYR  21          1HB       TYR  21   0.560   4.597   1.284
  170   2HB   TYR  21          2HB       TYR  21   1.994   4.468   0.264
  171    HD1  TYR  21           1HD      TYR  21  -0.686   6.584   1.346
  172    HD2  TYR  21           2HD      TYR  21   2.077   5.906  -1.865
  173    HE1  TYR  21           1HE      TYR  21  -1.071   8.897   0.528
  174    HE2  TYR  21           2HE      TYR  21   1.699   8.219  -2.682
  175    HH   TYR  21           HH       TYR  21  -0.817  10.048  -1.919
  176    H    PHE  22           H        PHE  22   2.008   2.514  -1.934
  177    HA   PHE  22           HA       PHE  22   2.242   0.229  -0.073
  178   1HB   PHE  22          1HB       PHE  22   1.515  -1.394  -1.622
  179   2HB   PHE  22          2HB       PHE  22   0.366  -0.089  -1.850
  180    HD1  PHE  22           1HD      PHE  22   3.238  -1.876  -3.285
  181    HD2  PHE  22           2HD      PHE  22   0.431   1.327  -3.852
  182    HE1  PHE  22           1HE      PHE  22   3.895  -1.723  -5.672
  183    HE2  PHE  22           2HE      PHE  22   1.088   1.481  -6.238
  184    HZ   PHE  22           HZ       PHE  22   2.821  -0.043  -7.149
  185    H    TYR  23           H        TYR  23   4.186  -1.022  -0.562
  186    HA   TYR  23           HA       TYR  23   6.322   0.669  -1.677
  187   1HB   TYR  23          1HB       TYR  23   6.508  -0.665   0.411
  188   2HB   TYR  23          2HB       TYR  23   6.352  -2.145  -0.536
  189    HD1  TYR  23           1HD      TYR  23   8.369  -3.205  -1.064
  190    HD2  TYR  23           2HD      TYR  23   8.292   1.075  -0.707
  191    HE1  TYR  23           1HE      TYR  23  10.792  -3.120  -1.585
  192    HE2  TYR  23           2HE      TYR  23  10.716   1.161  -1.231
  193    HH   TYR  23           HH       TYR  23  12.393  -0.234  -2.385
  194    H    ASN  24           H        ASN  24   6.530   0.668  -3.904
  195    HA   ASN  24           HA       ASN  24   5.892  -1.745  -5.488
  196   1HB   ASN  24          1HB       ASN  24   5.253   0.559  -6.177
  197   2HB   ASN  24          2HB       ASN  24   6.957   0.997  -6.242
  198   1HD2  ASN  24          1HD2      ASN  24   4.888   0.810  -8.474
  199   2HD2  ASN  24          2HD2      ASN  24   5.580  -0.239  -9.615
  200    H    ALA  25           H        ALA  25   7.663  -3.146  -4.713
  201    HA   ALA  25           HA       ALA  25  10.377  -2.593  -4.538
  202   1HB   ALA  25          1HB       ALA  25   9.906  -4.790  -4.049
  203   2HB   ALA  25          2HB       ALA  25  10.399  -5.038  -5.725
  204   3HB   ALA  25          3HB       ALA  25   8.687  -4.911  -5.318
  205    H    LYS  26           H        LYS  26   8.429  -2.971  -7.462
  206    HA   LYS  26           HA       LYS  26  10.586  -3.032  -9.362
  207   1HB   LYS  26          1HB       LYS  26   7.835  -3.272  -9.345
  208   2HB   LYS  26          2HB       LYS  26   8.066  -1.722 -10.155
  209   1HG   LYS  26          1HG       LYS  26   8.196  -3.231 -11.942
  210   2HG   LYS  26          2HG       LYS  26   9.895  -3.021 -11.520
  211   1HD   LYS  26          1HD       LYS  26  10.077  -5.212 -11.021
  212   2HD   LYS  26          2HD       LYS  26   8.737  -5.094  -9.880
  213   1HE   LYS  26          1HE       LYS  26   7.944  -6.653 -11.480
  214   2HE   LYS  26          2HE       LYS  26   7.244  -5.125 -12.048
  215   1HZ   LYS  26          1HZ       LYS  26   9.971  -5.717 -12.894
  216   2HZ   LYS  26          2HZ       LYS  26   8.698  -5.002 -13.765
  217   3HZ   LYS  26          3HZ       LYS  26   8.763  -6.690 -13.580
  218    H    ALA  27           H        ALA  27   8.938  -0.438  -7.633
  219    HA   ALA  27           HA       ALA  27  10.296   1.640  -9.272
  220   1HB   ALA  27          1HB       ALA  27   8.764   3.122  -8.195
  221   2HB   ALA  27          2HB       ALA  27   8.484   1.987  -6.874
  222   3HB   ALA  27          3HB       ALA  27   7.848   1.643  -8.480
  223    H    GLY  28           H        GLY  28  10.685  -0.083  -6.296
  224   1HA   GLY  28          1HA       GLY  28  12.609  -0.015  -4.890
  225   2HA   GLY  28          2HA       GLY  28  13.119   1.466  -5.704
  226    H    LEU  29           H        LEU  29  10.044   2.161  -5.129
  227    HA   LEU  29           HA       LEU  29  10.435   2.970  -2.280
  228   1HB   LEU  29          1HB       LEU  29   9.615   5.213  -2.927
  229   2HB   LEU  29          2HB       LEU  29  11.065   4.794  -3.841
  230    HG   LEU  29           HG       LEU  29   8.574   3.899  -5.117
  231   1HD1  LEU  29          1HD1      LEU  29   9.028   6.792  -4.425
  232   2HD1  LEU  29          2HD1      LEU  29   7.526   5.868  -4.401
  233   3HD1  LEU  29          3HD1      LEU  29   8.233   6.361  -5.939
  234   1HD2  LEU  29          1HD2      LEU  29   9.736   4.464  -7.057
  235   2HD2  LEU  29          2HD2      LEU  29  11.070   4.131  -5.952
  236   3HD2  LEU  29          3HD2      LEU  29  10.589   5.797  -6.281
  237    H    CYS  30           H        CYS  30   7.886   4.567  -2.672
  238    HA   CYS  30           HA       CYS  30   6.000   2.237  -2.664
  239   1HB   CYS  30          1HB       CYS  30   5.934   4.874  -1.168
  240   2HB   CYS  30          2HB       CYS  30   4.710   3.612  -1.046
  241    H    GLN  31           H        GLN  31   4.053   2.468  -3.787
  242    HA   GLN  31           HA       GLN  31   3.679   4.999  -5.349
  243   1HB   GLN  31          1HB       GLN  31   3.504   2.091  -6.189
  244   2HB   GLN  31          2HB       GLN  31   2.872   3.411  -7.175
  245   1HG   GLN  31          1HG       GLN  31   5.502   4.144  -6.366
  246   2HG   GLN  31          2HG       GLN  31   5.583   2.482  -6.951
  247   1HE2  GLN  31          1HE2      GLN  31   6.831   3.566  -8.812
  248   2HE2  GLN  31          2HE2      GLN  31   5.928   4.213 -10.096
  249    H    THR  32           H        THR  32   1.363   5.289  -6.024
  250    HA   THR  32           HA       THR  32  -0.446   4.522  -3.831
  251    HB   THR  32           HB       THR  32  -1.942   5.964  -5.550
  252    HG1  THR  32           1HG      THR  32  -0.107   5.856  -7.044
  253   1HG2  THR  32          1HG2      THR  32  -0.906   6.445  -3.170
  254   2HG2  THR  32          2HG2      THR  32  -1.505   7.774  -4.160
  255   3HG2  THR  32          3HG2      THR  32   0.225   7.435  -4.093
  256    H    PHE  33           H        PHE  33  -2.360   3.299  -4.106
  257    HA   PHE  33           HA       PHE  33  -2.841   2.027  -6.754
  258   1HB   PHE  33          1HB       PHE  33  -2.666  -0.176  -5.871
  259   2HB   PHE  33          2HB       PHE  33  -1.268   0.678  -5.234
  260    HD1  PHE  33           1HD      PHE  33  -4.469  -0.897  -4.431
  261    HD2  PHE  33           2HD      PHE  33  -1.201   1.407  -2.853
  262    HE1  PHE  33           1HE      PHE  33  -5.192  -1.443  -2.127
  263    HE2  PHE  33           2HE      PHE  33  -1.932   0.868  -0.554
  264    HZ   PHE  33           HZ       PHE  33  -3.925  -0.562  -0.190
  265    H    VAL  34           H        VAL  34  -4.990   0.970  -6.819
  266    HA   VAL  34           HA       VAL  34  -7.017   2.602  -5.527
  267    HB   VAL  34           HB       VAL  34  -7.070   0.104  -7.245
  268   1HG1  VAL  34          1HG1      VAL  34  -9.161   0.107  -6.112
  269   2HG1  VAL  34          2HG1      VAL  34  -9.481   0.895  -7.659
  270   3HG1  VAL  34          3HG1      VAL  34  -9.292   1.865  -6.197
  271   1HG2  VAL  34          1HG2      VAL  34  -6.825   2.992  -7.723
  272   2HG2  VAL  34          2HG2      VAL  34  -8.122   2.242  -8.654
  273   3HG2  VAL  34          3HG2      VAL  34  -6.471   1.642  -8.802
  274    H    TYR  35           H        TYR  35  -7.002   2.232  -3.265
  275    HA   TYR  35           HA       TYR  35  -6.995  -0.473  -2.147
  276   1HB   TYR  35          1HB       TYR  35  -5.984   1.393  -0.972
  277   2HB   TYR  35          2HB       TYR  35  -7.490   2.307  -1.037
  278    HD1  TYR  35           1HD      TYR  35  -7.177  -1.334  -0.360
  279    HD2  TYR  35           2HD      TYR  35  -7.922   2.556   1.302
  280    HE1  TYR  35           1HE      TYR  35  -7.916  -2.384   1.764
  281    HE2  TYR  35           2HE      TYR  35  -8.660   1.508   3.425
  282    HH   TYR  35           HH       TYR  35  -9.491  -0.581   4.251
  283    H    GLY  36           H        GLY  36  -8.812  -1.563  -1.252
  284   1HA   GLY  36          1HA       GLY  36 -11.408  -0.845  -2.385
  285   2HA   GLY  36          2HA       GLY  36 -11.069  -2.260  -1.391
  286    H    ALA  37           H        ALA  37  -9.790   0.319   0.230
  287    HA   ALA  37           HA       ALA  37 -10.563   1.728   1.975
  288   1HB   ALA  37          1HB       ALA  37 -13.408   1.044   1.522
  289   2HB   ALA  37          2HB       ALA  37 -12.569   1.722   0.127
  290   3HB   ALA  37          3HB       ALA  37 -12.637   2.626   1.639
  291    H    CYS  38           H        CYS  38 -11.003  -1.586   1.749
  292    HA   CYS  38           HA       CYS  38 -11.594  -1.738   4.670
  293   1HB   CYS  38          1HB       CYS  38 -13.216  -3.583   4.131
  294   2HB   CYS  38          2HB       CYS  38 -13.720  -2.009   3.516
  295    H    ARG  39           H        ARG  39 -11.163  -4.021   5.476
  296    HA   ARG  39           HA       ARG  39  -9.575  -5.745   5.775
  297   1HB   ARG  39          1HB       ARG  39 -10.028  -5.832   2.775
  298   2HB   ARG  39          2HB       ARG  39  -9.419  -7.162   3.759
  299   1HG   ARG  39          1HG       ARG  39 -11.505  -7.258   5.005
  300   2HG   ARG  39          2HG       ARG  39 -12.103  -5.814   4.189
  301   1HD   ARG  39          1HD       ARG  39 -13.128  -7.562   2.969
  302   2HD   ARG  39          2HD       ARG  39 -11.680  -7.227   1.998
  303    HE   ARG  39           HE       ARG  39 -10.588  -9.137   3.178
  304   1HH1  ARG  39          1HH2      ARG  39 -13.808  -9.303   2.317
  305   2HH1  ARG  39          2HH2      ARG  39 -14.189 -10.683   3.290
  306   1HH2  ARG  39          1HH1      ARG  39 -11.150 -10.679   4.958
  307   2HH2  ARG  39          2HH1      ARG  39 -12.682 -11.466   4.782
  308    H    ALA  40           H        ALA  40  -8.421  -3.084   5.419
  309    HA   ALA  40           HA       ALA  40  -6.246  -3.090   3.536
  310   1HB   ALA  40          1HB       ALA  40  -6.509  -0.978   4.351
  311   2HB   ALA  40          2HB       ALA  40  -5.467  -1.513   5.670
  312   3HB   ALA  40          3HB       ALA  40  -7.221  -1.560   5.856
  313    H    LYS  41           H        LYS  41  -4.082  -3.786   3.815
  314    HA   LYS  41           HA       LYS  41  -3.510  -5.316   6.335
  315   1HB   LYS  41          1HB       LYS  41  -2.849  -5.980   3.449
  316   2HB   LYS  41          2HB       LYS  41  -2.337  -6.932   4.842
  317   1HG   LYS  41          1HG       LYS  41  -4.442  -7.774   5.206
  318   2HG   LYS  41          2HG       LYS  41  -5.239  -6.301   4.653
  319   1HD   LYS  41          1HD       LYS  41  -5.435  -7.096   2.546
  320   2HD   LYS  41          2HD       LYS  41  -3.752  -7.625   2.514
  321   1HE   LYS  41          1HE       LYS  41  -5.750  -9.187   4.138
  322   2HE   LYS  41          2HE       LYS  41  -5.661  -9.435   2.384
  323   1HZ   LYS  41          1HZ       LYS  41  -4.102 -10.844   3.730
  324   2HZ   LYS  41          2HZ       LYS  41  -3.291  -9.423   4.181
  325   3HZ   LYS  41          3HZ       LYS  41  -3.344  -9.893   2.548
  326    H    ARG  42           H        ARG  42  -0.853  -6.003   5.476
  327    HA   ARG  42           HA       ARG  42   0.588  -3.646   6.300
  328   1HB   ARG  42          1HB       ARG  42   2.496  -5.115   6.093
  329   2HB   ARG  42          2HB       ARG  42   1.156  -6.060   6.722
  330   1HG   ARG  42          1HG       ARG  42   0.679  -6.593   4.212
  331   2HG   ARG  42          2HG       ARG  42   2.342  -6.073   3.964
  332   1HD   ARG  42          1HD       ARG  42   2.368  -8.487   4.348
  333   2HD   ARG  42          2HD       ARG  42   2.997  -7.720   5.821
  334    HE   ARG  42           HE       ARG  42   0.077  -8.190   5.666
  335   1HH1  ARG  42          1HH2      ARG  42   2.054  -7.730   8.072
  336   2HH1  ARG  42          2HH2      ARG  42   1.945  -9.284   8.830
  337   1HH2  ARG  42          1HH1      ARG  42   0.408 -10.793   6.111
  338   2HH2  ARG  42          2HH1      ARG  42   1.015 -11.020   7.718
  339    H    ASN  43           H        ASN  43  -0.088  -5.053   3.106
  340    HA   ASN  43           HA       ASN  43   1.809  -3.131   1.863
  341   1HB   ASN  43          1HB       ASN  43   1.276  -5.681   1.291
  342   2HB   ASN  43          2HB       ASN  43  -0.002  -4.955   0.316
  343   1HD2  ASN  43          1HD2      ASN  43   3.494  -4.252   0.986
  344   2HD2  ASN  43          2HD2      ASN  43   3.896  -3.958  -0.637
  345    H    ASN  44           H        ASN  44  -0.085  -1.688   3.086
  346    HA   ASN  44           HA       ASN  44  -1.490  -0.322   0.903
  347   1HB   ASN  44          1HB       ASN  44  -3.088  -2.094   1.298
  348   2HB   ASN  44          2HB       ASN  44  -2.923  -1.935   3.046
  349   1HD2  ASN  44          1HD2      ASN  44  -5.501  -1.747   2.210
  350   2HD2  ASN  44          2HD2      ASN  44  -6.050  -0.129   2.183
  351    H    PHE  45           H        PHE  45   0.090   1.236   1.928
  352    HA   PHE  45           HA       PHE  45  -0.465   2.103   4.678
  353   1HB   PHE  45          1HB       PHE  45   1.354   3.266   2.544
  354   2HB   PHE  45          2HB       PHE  45   1.497   3.471   4.293
  355    HD1  PHE  45           1HD      PHE  45   2.377   1.428   1.461
  356    HD2  PHE  45           2HD      PHE  45   1.817   1.333   5.718
  357    HE1  PHE  45           1HE      PHE  45   3.678  -0.682   1.584
  358    HE2  PHE  45           2HE      PHE  45   3.122  -0.773   5.844
  359    HZ   PHE  45           HZ       PHE  45   4.052  -1.791   3.777
  360    H    LYS  46           H        LYS  46  -1.343   4.159   5.221
  361    HA   LYS  46           HA       LYS  46  -3.114   5.300   3.129
  362   1HB   LYS  46          1HB       LYS  46  -2.973   5.894   6.095
  363   2HB   LYS  46          2HB       LYS  46  -4.345   6.141   5.013
  364   1HG   LYS  46          1HG       LYS  46  -4.617   3.754   4.723
  365   2HG   LYS  46          2HG       LYS  46  -3.123   3.430   5.599
  366   1HD   LYS  46          1HD       LYS  46  -4.067   4.166   7.666
  367   2HD   LYS  46          2HD       LYS  46  -5.460   4.883   6.857
  368   1HE   LYS  46          1HE       LYS  46  -5.372   2.141   6.078
  369   2HE   LYS  46          2HE       LYS  46  -5.165   2.196   7.841
  370   1HZ   LYS  46          1HZ       LYS  46  -7.144   3.936   6.512
  371   2HZ   LYS  46          2HZ       LYS  46  -7.130   3.361   8.111
  372   3HZ   LYS  46          3HZ       LYS  46  -7.541   2.319   6.833
  373    H    SER  47           H        SER  47  -0.029   5.875   3.998
  374    HA   SER  47           HA       SER  47  -0.336   8.817   3.515
  375   1HB   SER  47          1HB       SER  47   1.186   9.285   5.284
  376   2HB   SER  47          2HB       SER  47   0.067   8.092   5.937
  377    HG   SER  47           HG       SER  47   2.460   7.751   6.168
  378    H    ALA  48           H        ALA  48   1.607   9.814   2.653
  379    HA   ALA  48           HA       ALA  48   2.962   8.169   0.635
  380   1HB   ALA  48          1HB       ALA  48   3.771  10.370  -0.056
  381   2HB   ALA  48          2HB       ALA  48   3.218  11.049   1.474
  382   3HB   ALA  48          3HB       ALA  48   2.044  10.450   0.301
  383    H    GLU  49           H        GLU  49   3.591   7.863   3.567
  384    HA   GLU  49           HA       GLU  49   6.525   7.817   3.319
  385   1HB   GLU  49          1HB       GLU  49   5.361  10.118   4.171
  386   2HB   GLU  49          2HB       GLU  49   5.562   9.278   5.709
  387   1HG   GLU  49          1HG       GLU  49   7.875   9.284   5.558
  388   2HG   GLU  49          2HG       GLU  49   7.864   9.294   3.795
  389    H    ASP  50           H        ASP  50   3.606   6.850   4.952
  390    HA   ASP  50           HA       ASP  50   4.830   5.546   7.234
  391   1HB   ASP  50          1HB       ASP  50   2.490   6.109   7.298
  392   2HB   ASP  50          2HB       ASP  50   2.192   5.307   5.755
  393    H    CYS  51           H        CYS  51   4.306   4.818   3.887
  394    HA   CYS  51           HA       CYS  51   4.651   1.944   3.998
  395   1HB   CYS  51          1HB       CYS  51   3.560   3.001   2.120
  396   2HB   CYS  51          2HB       CYS  51   4.923   4.090   1.871
  397    H    MET  52           H        MET  52   6.776   4.722   3.317
  398    HA   MET  52           HA       MET  52   9.169   3.177   2.840
  399   1HB   MET  52          1HB       MET  52   8.567   6.034   3.643
  400   2HB   MET  52          2HB       MET  52  10.207   5.472   3.321
  401   1HG   MET  52          1HG       MET  52   9.033   4.526   1.110
  402   2HG   MET  52          2HG       MET  52   7.922   5.855   1.437
  403   1HE   MET  52          1HE       MET  52  10.928   5.541  -1.039
  404   2HE   MET  52          2HE       MET  52   9.967   6.962  -1.447
  405   3HE   MET  52          3HE       MET  52   9.162   5.482  -0.932
  406    H    ARG  53           H        ARG  53   8.043   5.010   5.710
  407    HA   ARG  53           HA       ARG  53  10.148   4.419   7.482
  408   1HB   ARG  53          1HB       ARG  53   7.365   5.291   7.546
  409   2HB   ARG  53          2HB       ARG  53   7.777   4.339   8.973
  410   1HG   ARG  53          1HG       ARG  53   9.204   5.929   9.770
  411   2HG   ARG  53          2HG       ARG  53   9.818   6.320   8.165
  412   1HD   ARG  53          1HD       ARG  53   8.622   8.269   8.586
  413   2HD   ARG  53          2HD       ARG  53   7.305   7.289   7.910
  414    HE   ARG  53           HE       ARG  53   6.404   7.132  10.102
  415   1HH1  ARG  53          1HH1      ARG  53   8.292   9.638  10.464
  416   2HH1  ARG  53          2HH1      ARG  53   8.955   9.262  12.020
  417   1HH2  ARG  53          1HH2      ARG  53   7.859   5.971  11.983
  418   2HH2  ARG  53          2HH2      ARG  53   8.708   7.185  12.881
  419    H    THR  54           H        THR  54   7.738   2.299   6.166
  420    HA   THR  54           HA       THR  54   8.314   0.210   8.223
  421    HB   THR  54           HB       THR  54   6.161   0.684   6.149
  422    HG1  THR  54           1HG      THR  54   6.129   0.267   8.955
  423   1HG2  THR  54          1HG2      THR  54   6.628  -1.670   6.003
  424   2HG2  THR  54          2HG2      THR  54   5.175  -1.480   6.987
  425   3HG2  THR  54          3HG2      THR  54   6.726  -1.813   7.758
  426    H    CYS  55           H        CYS  55   8.218   0.724   4.693
  427    HA   CYS  55           HA       CYS  55   9.437  -1.895   4.159
  428   1HB   CYS  55          1HB       CYS  55   8.861   0.482   2.362
  429   2HB   CYS  55          2HB       CYS  55   9.147  -1.180   1.839
  430    H    GLY  56           H        GLY  56  10.408   1.462   3.300
  431   1HA   GLY  56          1HA       GLY  56  13.208   0.758   3.993
  432   2HA   GLY  56          2HA       GLY  56  12.880   1.287   2.343
  433    H    GLY  57           H        GLY  57  13.242   3.418   2.038
  434   1HA   GLY  57          1HA       GLY  57  12.131   5.550   3.456
  435   2HA   GLY  57          2HA       GLY  57  13.675   5.231   4.249
  436    H    ALA  58           H        ALA  58  12.331   7.168   1.995
  437    HA   ALA  58           HA       ALA  58  14.930   7.817   0.788
  438   1HB   ALA  58          1HB       ALA  58  14.602   6.755  -1.189
  439   2HB   ALA  58          2HB       ALA  58  12.962   7.388  -1.323
  440   3HB   ALA  58          3HB       ALA  58  13.265   5.908  -0.412
  Start of MODEL    8
    1   1H    ARG   1          1H        ARG   1  15.066  -4.976   4.724
    2   2H    ARG   1          2H        ARG   1  14.192  -5.398   6.119
    3   3H    ARG   1          3H        ARG   1  14.830  -3.832   5.954
    4    HA   ARG   1           HA       ARG   1  12.782  -3.276   5.249
    5   1HB   ARG   1          1HB       ARG   1  13.838  -2.892   3.226
    6   2HB   ARG   1          2HB       ARG   1  14.333  -4.574   3.046
    7   1HG   ARG   1          1HG       ARG   1  12.380  -5.171   2.001
    8   2HG   ARG   1          2HG       ARG   1  11.406  -4.054   2.956
    9   1HD   ARG   1          1HD       ARG   1  11.365  -3.028   0.837
   10   2HD   ARG   1          2HD       ARG   1  12.756  -2.218   1.583
   11    HE   ARG   1           HE       ARG   1  12.936  -4.537  -0.307
   12   1HH1  ARG   1          1HH1      ARG   1  13.861  -1.384   0.090
   13   2HH1  ARG   1          2HH1      ARG   1  15.555  -1.640  -0.161
   14   1HH2  ARG   1          1HH2      ARG   1  15.317  -5.097  -0.058
   15   2HH2  ARG   1          2HH2      ARG   1  16.381  -3.742  -0.242
   16    HA   PRO   2           HA       PRO   2   9.860  -6.487   5.962
   17   1HB   PRO   2          1HB       PRO   2   7.651  -5.232   4.933
   18   2HB   PRO   2          2HB       PRO   2   8.341  -4.846   6.518
   19   1HG   PRO   2          1HG       PRO   2   8.683  -3.466   3.885
   20   2HG   PRO   2          2HG       PRO   2   8.439  -2.763   5.493
   21   1HD   PRO   2          1HD       PRO   2  10.872  -2.888   4.303
   22   2HD   PRO   2          2HD       PRO   2  10.666  -3.020   6.067
   23    H    ASP   3           H        ASP   3   8.488  -7.969   4.775
   24    HA   ASP   3           HA       ASP   3   9.306  -8.256   1.942
   25   1HB   ASP   3          1HB       ASP   3   8.314  -9.928   4.174
   26   2HB   ASP   3          2HB       ASP   3   7.699 -10.386   2.584
   27    H    PHE   4           H        PHE   4   6.495  -7.478   3.931
   28    HA   PHE   4           HA       PHE   4   4.514  -7.886   1.867
   29   1HB   PHE   4          1HB       PHE   4   3.059  -6.646   3.383
   30   2HB   PHE   4          2HB       PHE   4   4.055  -7.766   4.303
   31    HD1  PHE   4           1HD      PHE   4   5.732  -6.997   5.845
   32    HD2  PHE   4           2HD      PHE   4   3.552  -4.188   3.421
   33    HE1  PHE   4           1HE      PHE   4   6.552  -5.130   7.257
   34    HE2  PHE   4           2HE      PHE   4   4.378  -2.340   4.835
   35    HZ   PHE   4           HZ       PHE   4   5.869  -2.801   6.744
   36    H    CYS   5           H        CYS   5   6.718  -5.257   2.571
   37    HA   CYS   5           HA       CYS   5   5.327  -3.225   1.052
   38   1HB   CYS   5          1HB       CYS   5   8.128  -3.683   2.079
   39   2HB   CYS   5          2HB       CYS   5   7.761  -2.279   1.075
   40    H    LEU   6           H        LEU   6   7.595  -5.799   0.276
   41    HA   LEU   6           HA       LEU   6   8.202  -4.857  -2.417
   42   1HB   LEU   6          1HB       LEU   6   8.413  -7.642  -1.234
   43   2HB   LEU   6          2HB       LEU   6   9.360  -6.974  -2.564
   44    HG   LEU   6           HG       LEU   6   9.445  -6.169   0.353
   45   1HD1  LEU   6          1HD1      LEU   6  11.254  -7.508   0.409
   46   2HD1  LEU   6          2HD1      LEU   6  11.983  -6.605  -0.919
   47   3HD1  LEU   6          3HD1      LEU   6  10.935  -7.981  -1.260
   48   1HD2  LEU   6          1HD2      LEU   6  11.059  -4.434  -0.348
   49   2HD2  LEU   6          2HD2      LEU   6   9.480  -4.157  -1.083
   50   3HD2  LEU   6          3HD2      LEU   6  10.785  -4.861  -2.037
   51    H    GLU   7           H        GLU   7   5.670  -6.717  -0.915
   52    HA   GLU   7           HA       GLU   7   4.736  -8.053  -3.328
   53   1HB   GLU   7          1HB       GLU   7   4.123  -7.847  -0.490
   54   2HB   GLU   7          2HB       GLU   7   2.650  -7.825  -1.459
   55   1HG   GLU   7          1HG       GLU   7   3.397  -9.877  -2.623
   56   2HG   GLU   7          2HG       GLU   7   4.860  -9.899  -1.638
   57    HA   PRO   8           HA       PRO   8   2.346  -4.804  -5.062
   58   1HB   PRO   8          1HB       PRO   8   0.156  -6.170  -5.993
   59   2HB   PRO   8          2HB       PRO   8   1.753  -6.254  -6.764
   60   1HG   PRO   8          1HG       PRO   8   0.429  -8.170  -4.897
   61   2HG   PRO   8          2HG       PRO   8   1.411  -8.496  -6.334
   62   1HD   PRO   8          1HD       PRO   8   2.354  -8.684  -3.775
   63   2HD   PRO   8          2HD       PRO   8   3.382  -8.292  -5.172
   64    HA   PRO   9           HA       PRO   9  -0.722  -3.500  -2.213
   65   1HB   PRO   9          1HB       PRO   9  -2.556  -2.232  -3.811
   66   2HB   PRO   9          2HB       PRO   9  -0.966  -1.550  -3.414
   67   1HG   PRO   9          1HG       PRO   9  -1.889  -2.945  -5.881
   68   2HG   PRO   9          2HG       PRO   9  -0.797  -1.562  -5.706
   69   1HD   PRO   9          1HD       PRO   9   0.035  -4.133  -6.173
   70   2HD   PRO   9          2HD       PRO   9   1.027  -2.900  -5.362
   71    H    TYR  10           H        TYR  10  -3.213  -3.612  -1.783
   72    HA   TYR  10           HA       TYR  10  -4.412  -6.054  -3.063
   73   1HB   TYR  10          1HB       TYR  10  -3.189  -6.414  -0.844
   74   2HB   TYR  10          2HB       TYR  10  -4.431  -5.407  -0.103
   75    HD1  TYR  10           1HD      TYR  10  -6.355  -6.435   0.713
   76    HD2  TYR  10           2HD      TYR  10  -4.114  -8.352  -2.411
   77    HE1  TYR  10           1HE      TYR  10  -7.886  -8.384   0.809
   78    HE2  TYR  10           2HE      TYR  10  -5.644 -10.301  -2.312
   79    HH   TYR  10           HH       TYR  10  -8.140 -10.640  -1.550
   80    H    THR  11           H        THR  11  -5.917  -4.768  -4.207
   81    HA   THR  11           HA       THR  11  -7.510  -2.675  -3.071
   82    HB   THR  11           HB       THR  11  -7.656  -4.560  -5.419
   83    HG1  THR  11           1HG      THR  11  -7.824  -1.749  -5.370
   84   1HG2  THR  11          1HG2      THR  11  -9.805  -2.561  -4.660
   85   2HG2  THR  11          2HG2      THR  11  -9.988  -4.316  -4.638
   86   3HG2  THR  11          3HG2      THR  11  -9.733  -3.475  -6.167
   87    H    GLY  12           H        GLY  12  -7.578  -6.139  -2.875
   88   1HA   GLY  12          1HA       GLY  12  -9.032  -7.623  -1.770
   89   2HA   GLY  12          2HA       GLY  12  -9.353  -6.271  -0.685
   90    HA   PRO  13           HA       PRO  13 -13.255  -7.237  -2.932
   91   1HB   PRO  13          1HB       PRO  13 -14.818  -7.308  -0.680
   92   2HB   PRO  13          2HB       PRO  13 -13.938  -8.719  -1.295
   93   1HG   PRO  13          1HG       PRO  13 -13.280  -6.885   0.953
   94   2HG   PRO  13          2HG       PRO  13 -13.036  -8.633   0.813
   95   1HD   PRO  13          1HD       PRO  13 -11.065  -6.733   0.474
   96   2HD   PRO  13          2HD       PRO  13 -11.011  -8.374  -0.206
   97    H    CYS  14           H        CYS  14 -15.543  -5.993  -1.710
   98    HA   CYS  14           HA       CYS  14 -16.584  -3.887  -1.498
   99   1HB   CYS  14          1HB       CYS  14 -13.789  -2.949  -0.785
  100   2HB   CYS  14          2HB       CYS  14 -15.322  -2.247  -0.266
  101    H    LYS  15           H        LYS  15 -16.964  -2.085  -2.854
  102    HA   LYS  15           HA       LYS  15 -15.299  -1.994  -5.320
  103   1HB   LYS  15          1HB       LYS  15 -18.068  -1.845  -4.634
  104   2HB   LYS  15          2HB       LYS  15 -17.620  -0.303  -5.363
  105   1HG   LYS  15          1HG       LYS  15 -16.399  -1.848  -7.126
  106   2HG   LYS  15          2HG       LYS  15 -17.543  -3.060  -6.547
  107   1HD   LYS  15          1HD       LYS  15 -18.326  -0.300  -7.532
  108   2HD   LYS  15          2HD       LYS  15 -18.391  -1.762  -8.519
  109   1HE   LYS  15          1HE       LYS  15 -19.724  -2.031  -5.896
  110   2HE   LYS  15          2HE       LYS  15 -20.481  -0.850  -6.984
  111   1HZ   LYS  15          1HZ       LYS  15 -20.903  -3.472  -7.169
  112   2HZ   LYS  15          2HZ       LYS  15 -19.544  -3.342  -8.180
  113   3HZ   LYS  15          3HZ       LYS  15 -20.946  -2.441  -8.515
  114    H    ALA  16           H        ALA  16 -15.033  -0.555  -2.452
  115    HA   ALA  16           HA       ALA  16 -15.204   2.229  -2.739
  116   1HB   ALA  16          1HB       ALA  16 -13.520   0.279  -1.236
  117   2HB   ALA  16          2HB       ALA  16 -14.591   1.538  -0.624
  118   3HB   ALA  16          3HB       ALA  16 -12.992   1.961  -1.234
  119    H    ARG  17           H        ARG  17 -13.361   3.781  -3.112
  120    HA   ARG  17           HA       ARG  17 -11.237   2.792  -4.942
  121   1HB   ARG  17          1HB       ARG  17 -13.062   3.333  -6.427
  122   2HB   ARG  17          2HB       ARG  17 -13.381   4.844  -5.574
  123   1HG   ARG  17          1HG       ARG  17 -11.856   5.929  -6.831
  124   2HG   ARG  17          2HG       ARG  17 -10.617   4.738  -6.429
  125   1HD   ARG  17          1HD       ARG  17 -10.766   3.896  -8.530
  126   2HD   ARG  17          2HD       ARG  17 -12.484   3.538  -8.264
  127    HE   ARG  17           HE       ARG  17 -13.025   5.714  -9.185
  128   1HH1  ARG  17          1HH2      ARG  17 -10.010   6.340  -8.073
  129   2HH1  ARG  17          2HH2      ARG  17  -9.389   7.057  -9.522
  130   1HH2  ARG  17          1HH1      ARG  17 -12.083   6.084 -11.475
  131   2HH2  ARG  17          2HH1      ARG  17 -10.560   6.910 -11.448
  132    H    ILE  18           H        ILE  18 -10.354   3.450  -2.638
  133    HA   ILE  18           HA       ILE  18  -9.912   6.385  -2.411
  134    HB   ILE  18           HB       ILE  18  -9.364   3.987  -0.636
  135   1HG1  ILE  18          1HG1      ILE  18 -11.321   6.301  -0.498
  136   2HG1  ILE  18          2HG1      ILE  18 -11.715   4.603  -0.771
  137   1HG2  ILE  18          1HG2      ILE  18  -7.624   5.663  -0.261
  138   2HG2  ILE  18          2HG2      ILE  18  -8.755   5.677   1.092
  139   3HG2  ILE  18          3HG2      ILE  18  -8.841   6.934  -0.142
  140   1HD1  ILE  18          1HD1      ILE  18 -11.378   5.983   1.727
  141   2HD1  ILE  18          2HD1      ILE  18 -10.142   4.732   1.598
  142   3HD1  ILE  18          3HD1      ILE  18 -11.848   4.305   1.457
  143    H    ILE  19           H        ILE  19  -7.743   7.235  -2.337
  144    HA   ILE  19           HA       ILE  19  -5.809   5.695  -3.954
  145    HB   ILE  19           HB       ILE  19  -5.807   8.502  -2.799
  146   1HG1  ILE  19          1HG1      ILE  19  -7.623   7.988  -4.449
  147   2HG1  ILE  19          2HG1      ILE  19  -6.475   9.192  -5.040
  148   1HG2  ILE  19          1HG2      ILE  19  -3.670   7.016  -3.827
  149   2HG2  ILE  19          2HG2      ILE  19  -3.732   8.770  -3.646
  150   3HG2  ILE  19          3HG2      ILE  19  -4.195   8.025  -5.176
  151   1HD1  ILE  19          1HD1      ILE  19  -5.261   7.401  -6.260
  152   2HD1  ILE  19          2HD1      ILE  19  -6.938   7.531  -6.790
  153   3HD1  ILE  19          3HD1      ILE  19  -6.456   6.229  -5.702
  154    H    ARG  20           H        ARG  20  -5.273   4.076  -2.279
  155    HA   ARG  20           HA       ARG  20  -4.000   5.000   0.211
  156   1HB   ARG  20          1HB       ARG  20  -4.762   2.416  -1.106
  157   2HB   ARG  20          2HB       ARG  20  -3.575   2.375   0.199
  158   1HG   ARG  20          1HG       ARG  20  -6.283   3.724   0.417
  159   2HG   ARG  20          2HG       ARG  20  -5.955   2.083   0.976
  160   1HD   ARG  20          1HD       ARG  20  -4.833   2.828   2.828
  161   2HD   ARG  20          2HD       ARG  20  -4.021   4.121   1.922
  162    HE   ARG  20           HE       ARG  20  -6.142   5.418   2.087
  163   1HH1  ARG  20          1HH2      ARG  20  -5.121   3.582   4.663
  164   2HH1  ARG  20          2HH2      ARG  20  -6.630   3.589   5.515
  165   1HH2  ARG  20          1HH1      ARG  20  -8.404   4.997   2.888
  166   2HH2  ARG  20          2HH1      ARG  20  -8.491   4.393   4.508
  167    H    TYR  21           H        TYR  21  -1.740   4.101   0.709
  168    HA   TYR  21           HA       TYR  21  -0.012   4.413  -1.714
  169   1HB   TYR  21          1HB       TYR  21   0.227   5.061   1.214
  170   2HB   TYR  21          2HB       TYR  21   1.683   4.886   0.234
  171    HD1  TYR  21           1HD      TYR  21   2.190   6.450  -1.570
  172    HD2  TYR  21           2HD      TYR  21  -1.365   6.864   0.805
  173    HE1  TYR  21           1HE      TYR  21   1.870   8.746  -2.452
  174    HE2  TYR  21           2HE      TYR  21  -1.687   9.162  -0.075
  175    HH   TYR  21           HH       TYR  21   0.121  11.000  -1.114
  176    H    PHE  22           H        PHE  22   1.723   2.960  -2.022
  177    HA   PHE  22           HA       PHE  22   2.113   0.724  -0.132
  178   1HB   PHE  22          1HB       PHE  22   1.325  -0.954  -1.560
  179   2HB   PHE  22          2HB       PHE  22   0.173   0.335  -1.858
  180    HD1  PHE  22           1HD      PHE  22   3.045  -1.525  -3.204
  181    HD2  PHE  22           2HD      PHE  22   0.193   1.601  -3.957
  182    HE1  PHE  22           1HE      PHE  22   3.665  -1.538  -5.605
  183    HE2  PHE  22           2HE      PHE  22   0.817   1.589  -6.358
  184    HZ   PHE  22           HZ       PHE  22   2.554   0.019  -7.183
  185    H    TYR  23           H        TYR  23   4.042  -0.544  -0.748
  186    HA   TYR  23           HA       TYR  23   6.075   1.189  -2.033
  187   1HB   TYR  23          1HB       TYR  23   6.418   0.059   0.153
  188   2HB   TYR  23          2HB       TYR  23   6.269  -1.506  -0.645
  189    HD1  TYR  23           1HD      TYR  23   8.194  -2.540  -1.492
  190    HD2  TYR  23           2HD      TYR  23   8.182   1.711  -0.881
  191    HE1  TYR  23           1HE      TYR  23  10.589  -2.443  -2.124
  192    HE2  TYR  23           2HE      TYR  23  10.578   1.808  -1.514
  193    HH   TYR  23           HH       TYR  23  12.151   0.303  -2.987
  194    H    ASN  24           H        ASN  24   6.730   0.870  -4.130
  195    HA   ASN  24           HA       ASN  24   5.848  -1.603  -5.554
  196   1HB   ASN  24          1HB       ASN  24   5.194   0.554  -6.487
  197   2HB   ASN  24          2HB       ASN  24   6.863   1.110  -6.457
  198   1HD2  ASN  24          1HD2      ASN  24   5.822   1.246  -8.935
  199   2HD2  ASN  24          2HD2      ASN  24   6.308  -0.050  -9.916
  200    H    ALA  25           H        ALA  25   7.608  -2.972  -4.697
  201    HA   ALA  25           HA       ALA  25  10.339  -2.470  -4.628
  202   1HB   ALA  25          1HB       ALA  25   8.693  -4.633  -4.384
  203   2HB   ALA  25          2HB       ALA  25  10.453  -4.750  -4.410
  204   3HB   ALA  25          3HB       ALA  25   9.528  -5.031  -5.885
  205    H    LYS  26           H        LYS  26   8.288  -2.756  -7.443
  206    HA   LYS  26           HA       LYS  26  10.424  -3.164  -9.376
  207   1HB   LYS  26          1HB       LYS  26   7.763  -3.506  -9.376
  208   2HB   LYS  26          2HB       LYS  26   7.813  -1.884 -10.068
  209   1HG   LYS  26          1HG       LYS  26   7.894  -3.480 -11.891
  210   2HG   LYS  26          2HG       LYS  26   9.490  -2.740 -11.745
  211   1HD   LYS  26          1HD       LYS  26  10.390  -4.784 -11.459
  212   2HD   LYS  26          2HD       LYS  26   9.425  -4.992  -9.997
  213   1HE   LYS  26          1HE       LYS  26   8.153  -6.540 -11.058
  214   2HE   LYS  26          2HE       LYS  26   7.732  -5.352 -12.308
  215   1HZ   LYS  26          1HZ       LYS  26   8.973  -7.245 -13.227
  216   2HZ   LYS  26          2HZ       LYS  26  10.266  -6.915 -12.175
  217   3HZ   LYS  26          3HZ       LYS  26   9.847  -5.801 -13.387
  218    H    ALA  27           H        ALA  27   8.933  -0.395  -7.809
  219    HA   ALA  27           HA       ALA  27  10.253   1.496  -9.697
  220   1HB   ALA  27          1HB       ALA  27   7.945   1.426  -7.939
  221   2HB   ALA  27          2HB       ALA  27   8.309   2.557  -9.241
  222   3HB   ALA  27          3HB       ALA  27   8.929   2.853  -7.616
  223    H    GLY  28           H        GLY  28  10.325   0.497  -6.282
  224   1HA   GLY  28          1HA       GLY  28  12.486   0.499  -5.100
  225   2HA   GLY  28          2HA       GLY  28  12.941   1.920  -6.041
  226    H    LEU  29           H        LEU  29   9.897   2.669  -5.440
  227    HA   LEU  29           HA       LEU  29  10.374   3.674  -2.662
  228   1HB   LEU  29          1HB       LEU  29   9.196   5.258  -4.962
  229   2HB   LEU  29          2HB       LEU  29   9.682   5.872  -3.382
  230    HG   LEU  29           HG       LEU  29  11.991   4.657  -4.259
  231   1HD1  LEU  29          1HD1      LEU  29  11.847   4.352  -6.490
  232   2HD1  LEU  29          2HD1      LEU  29  11.817   6.108  -6.645
  233   3HD1  LEU  29          3HD1      LEU  29  10.304   5.204  -6.568
  234   1HD2  LEU  29          1HD2      LEU  29  12.127   7.316  -5.179
  235   2HD2  LEU  29          2HD2      LEU  29  12.583   6.727  -3.581
  236   3HD2  LEU  29          3HD2      LEU  29  10.953   7.337  -3.863
  237    H    CYS  30           H        CYS  30   7.831   5.244  -3.044
  238    HA   CYS  30           HA       CYS  30   5.918   2.949  -2.772
  239   1HB   CYS  30          1HB       CYS  30   6.143   5.650  -1.425
  240   2HB   CYS  30          2HB       CYS  30   4.696   4.653  -1.298
  241    H    GLN  31           H        GLN  31   3.745   3.316  -3.533
  242    HA   GLN  31           HA       GLN  31   3.299   5.672  -5.298
  243   1HB   GLN  31          1HB       GLN  31   2.951   2.777  -6.144
  244   2HB   GLN  31          2HB       GLN  31   2.714   4.202  -7.157
  245   1HG   GLN  31          1HG       GLN  31   5.223   4.698  -6.372
  246   2HG   GLN  31          2HG       GLN  31   5.251   2.942  -6.207
  247   1HE2  GLN  31          1HE2      GLN  31   6.910   3.578  -8.129
  248   2HE2  GLN  31          2HE2      GLN  31   6.247   3.466  -9.686
  249    H    THR  32           H        THR  32   0.917   5.699  -5.995
  250    HA   THR  32           HA       THR  32  -0.750   4.821  -3.699
  251    HB   THR  32           HB       THR  32  -2.393   6.361  -5.046
  252    HG1  THR  32           1HG      THR  32  -1.073   7.873  -6.286
  253   1HG2  THR  32          1HG2      THR  32  -1.147   8.393  -4.134
  254   2HG2  THR  32          2HG2      THR  32   0.131   7.275  -3.656
  255   3HG2  THR  32          3HG2      THR  32  -1.486   7.112  -2.969
  256    H    PHE  33           H        PHE  33  -2.544   3.463  -3.952
  257    HA   PHE  33           HA       PHE  33  -3.103   2.379  -6.684
  258   1HB   PHE  33          1HB       PHE  33  -2.833   0.140  -5.911
  259   2HB   PHE  33          2HB       PHE  33  -1.441   1.014  -5.279
  260    HD1  PHE  33           1HD      PHE  33  -4.490  -0.795  -4.457
  261    HD2  PHE  33           2HD      PHE  33  -1.413   1.753  -2.872
  262    HE1  PHE  33           1HE      PHE  33  -5.135  -1.443  -2.152
  263    HE2  PHE  33           2HE      PHE  33  -2.063   1.113  -0.576
  264    HZ   PHE  33           HZ       PHE  33  -3.922  -0.490  -0.210
  265    H    VAL  34           H        VAL  34  -5.206   1.144  -6.691
  266    HA   VAL  34           HA       VAL  34  -7.270   2.642  -5.287
  267    HB   VAL  34           HB       VAL  34  -7.420   0.099  -6.937
  268   1HG1  VAL  34          1HG1      VAL  34  -9.406   1.215  -5.482
  269   2HG1  VAL  34          2HG1      VAL  34  -9.689   0.419  -7.030
  270   3HG1  VAL  34          3HG1      VAL  34  -9.548   2.175  -6.955
  271   1HG2  VAL  34          1HG2      VAL  34  -6.222   1.873  -8.148
  272   2HG2  VAL  34          2HG2      VAL  34  -7.513   3.015  -7.776
  273   3HG2  VAL  34          3HG2      VAL  34  -7.828   1.644  -8.840
  274    H    TYR  35           H        TYR  35  -7.673   2.231  -3.144
  275    HA   TYR  35           HA       TYR  35  -7.214  -0.484  -2.032
  276   1HB   TYR  35          1HB       TYR  35  -6.352   1.482  -0.868
  277   2HB   TYR  35          2HB       TYR  35  -7.956   2.213  -0.847
  278    HD1  TYR  35           1HD      TYR  35  -7.224  -1.384  -0.288
  279    HD2  TYR  35           2HD      TYR  35  -8.275   2.366   1.529
  280    HE1  TYR  35           1HE      TYR  35  -7.720  -2.554   1.841
  281    HE2  TYR  35           2HE      TYR  35  -8.772   1.193   3.657
  282    HH   TYR  35           HH       TYR  35  -8.206  -0.877   4.791
  283    H    GLY  36           H        GLY  36  -8.936  -1.713  -1.086
  284   1HA   GLY  36          1HA       GLY  36 -11.618  -1.067  -2.140
  285   2HA   GLY  36          2HA       GLY  36 -11.140  -2.590  -1.393
  286    H    ALA  37           H        ALA  37  -9.947  -0.293   0.632
  287    HA   ALA  37           HA       ALA  37 -10.742   0.723   2.627
  288   1HB   ALA  37          1HB       ALA  37 -12.732   1.737   2.294
  289   2HB   ALA  37          2HB       ALA  37 -13.572   0.187   2.237
  290   3HB   ALA  37          3HB       ALA  37 -12.845   0.850   0.774
  291    H    CYS  38           H        CYS  38 -10.809  -2.434   1.863
  292    HA   CYS  38           HA       CYS  38 -11.488  -3.231   4.634
  293   1HB   CYS  38          1HB       CYS  38 -13.084  -4.948   3.776
  294   2HB   CYS  38          2HB       CYS  38 -13.620  -3.305   3.422
  295    H    ARG  39           H        ARG  39 -11.072  -5.718   4.824
  296    HA   ARG  39           HA       ARG  39  -9.326  -7.333   4.785
  297   1HB   ARG  39          1HB       ARG  39 -10.938  -7.310   2.558
  298   2HB   ARG  39          2HB       ARG  39  -9.331  -7.244   1.834
  299   1HG   ARG  39          1HG       ARG  39  -8.865  -9.381   2.432
  300   2HG   ARG  39          2HG       ARG  39  -9.524  -9.157   4.053
  301   1HD   ARG  39          1HD       ARG  39 -11.842  -9.317   3.031
  302   2HD   ARG  39          2HD       ARG  39 -11.061  -9.789   1.509
  303    HE   ARG  39           HE       ARG  39 -10.311 -11.281   3.969
  304   1HH1  ARG  39          1HH2      ARG  39 -13.132 -11.904   3.053
  305   2HH1  ARG  39          2HH2      ARG  39 -12.862 -13.252   1.999
  306   1HH2  ARG  39          1HH1      ARG  39  -9.454 -12.678   1.705
  307   2HH2  ARG  39          2HH1      ARG  39 -10.779 -13.690   1.236
  308    H    ALA  40           H        ALA  40  -8.393  -4.500   4.730
  309    HA   ALA  40           HA       ALA  40  -6.298  -4.114   2.819
  310   1HB   ALA  40          1HB       ALA  40  -5.623  -2.833   5.238
  311   2HB   ALA  40          2HB       ALA  40  -7.385  -2.914   5.221
  312   3HB   ALA  40          3HB       ALA  40  -6.524  -2.138   3.891
  313    H    LYS  41           H        LYS  41  -3.977  -4.292   3.185
  314    HA   LYS  41           HA       LYS  41  -3.207  -6.356   5.227
  315   1HB   LYS  41          1HB       LYS  41  -2.241  -5.984   2.370
  316   2HB   LYS  41          2HB       LYS  41  -1.667  -7.223   3.487
  317   1HG   LYS  41          1HG       LYS  41  -3.943  -8.156   3.628
  318   2HG   LYS  41          2HG       LYS  41  -4.532  -6.901   2.537
  319   1HD   LYS  41          1HD       LYS  41  -3.359  -7.786   0.697
  320   2HD   LYS  41          2HD       LYS  41  -2.252  -8.697   1.725
  321   1HE   LYS  41          1HE       LYS  41  -4.058 -10.230   2.365
  322   2HE   LYS  41          2HE       LYS  41  -5.226  -9.274   1.432
  323   1HZ   LYS  41          1HZ       LYS  41  -4.578 -10.814  -0.130
  324   2HZ   LYS  41          2HZ       LYS  41  -3.006 -10.966   0.497
  325   3HZ   LYS  41          3HZ       LYS  41  -3.428  -9.603  -0.426
  326    H    ARG  42           H        ARG  42  -0.419  -6.217   4.625
  327    HA   ARG  42           HA       ARG  42   0.291  -3.758   6.037
  328   1HB   ARG  42          1HB       ARG  42   2.235  -5.624   4.692
  329   2HB   ARG  42          2HB       ARG  42   2.398  -4.780   6.229
  330   1HG   ARG  42          1HG       ARG  42   0.272  -6.277   6.847
  331   2HG   ARG  42          2HG       ARG  42   0.958  -7.321   5.602
  332   1HD   ARG  42          1HD       ARG  42   3.177  -6.582   7.121
  333   2HD   ARG  42          2HD       ARG  42   1.900  -6.836   8.329
  334    HE   ARG  42           HE       ARG  42   2.748  -8.854   6.282
  335   1HH1  ARG  42          1HH2      ARG  42  -0.107  -8.801   7.551
  336   2HH1  ARG  42          2HH2      ARG  42   0.086 -10.028   8.758
  337   1HH2  ARG  42          1HH1      ARG  42   3.547 -10.072   8.538
  338   2HH2  ARG  42          2HH1      ARG  42   2.156 -10.748   9.318
  339    H    ASN  43           H        ASN  43   0.035  -4.741   2.728
  340    HA   ASN  43           HA       ASN  43   1.811  -2.575   1.750
  341   1HB   ASN  43          1HB       ASN  43   1.437  -5.056   0.881
  342   2HB   ASN  43          2HB       ASN  43   0.084  -4.318   0.022
  343   1HD2  ASN  43          1HD2      ASN  43   3.617  -3.834   0.573
  344   2HD2  ASN  43          2HD2      ASN  43   3.917  -3.180  -0.964
  345    H    ASN  44           H        ASN  44   0.036  -1.157   2.989
  346    HA   ASN  44           HA       ASN  44  -1.569   0.154   0.936
  347   1HB   ASN  44          1HB       ASN  44  -2.977  -1.781   1.351
  348   2HB   ASN  44          2HB       ASN  44  -2.834  -1.568   3.095
  349   1HD2  ASN  44          1HD2      ASN  44  -5.402  -1.635   2.257
  350   2HD2  ASN  44          2HD2      ASN  44  -6.095  -0.075   2.201
  351    H    PHE  45           H        PHE  45  -0.103   1.820   1.924
  352    HA   PHE  45           HA       PHE  45  -0.708   2.629   4.706
  353   1HB   PHE  45          1HB       PHE  45   1.129   3.924   2.672
  354   2HB   PHE  45          2HB       PHE  45   1.243   4.002   4.432
  355    HD1  PHE  45           1HD      PHE  45   2.103   2.129   1.448
  356    HD2  PHE  45           2HD      PHE  45   1.763   1.870   5.724
  357    HE1  PHE  45           1HE      PHE  45   3.497   0.075   1.435
  358    HE2  PHE  45           2HE      PHE  45   3.157  -0.182   5.711
  359    HZ   PHE  45           HZ       PHE  45   4.019  -1.090   3.566
  360    H    LYS  46           H        LYS  46  -1.415   4.849   5.173
  361    HA   LYS  46           HA       LYS  46  -3.438   5.797   3.256
  362   1HB   LYS  46          1HB       LYS  46  -3.937   5.633   5.632
  363   2HB   LYS  46          2HB       LYS  46  -2.554   6.654   6.029
  364   1HG   LYS  46          1HG       LYS  46  -3.586   8.538   4.837
  365   2HG   LYS  46          2HG       LYS  46  -4.949   7.517   4.377
  366   1HD   LYS  46          1HD       LYS  46  -5.155   7.102   6.961
  367   2HD   LYS  46          2HD       LYS  46  -4.208   8.585   7.090
  368   1HE   LYS  46          1HE       LYS  46  -6.433   9.388   7.092
  369   2HE   LYS  46          2HE       LYS  46  -5.984   9.528   5.380
  370   1HZ   LYS  46          1HZ       LYS  46  -6.954   6.929   6.281
  371   2HZ   LYS  46          2HZ       LYS  46  -7.248   7.749   4.820
  372   3HZ   LYS  46          3HZ       LYS  46  -8.113   8.166   6.221
  373    H    SER  47           H        SER  47  -0.168   6.543   4.025
  374    HA   SER  47           HA       SER  47  -0.317   8.952   2.272
  375   1HB   SER  47          1HB       SER  47   0.921  10.252   3.932
  376   2HB   SER  47          2HB       SER  47  -0.542   9.612   4.672
  377    HG   SER  47           HG       SER  47   1.314   9.277   5.975
  378    H    ALA  48           H        ALA  48   1.809   9.529   1.400
  379    HA   ALA  48           HA       ALA  48   3.429   7.263   0.687
  380   1HB   ALA  48          1HB       ALA  48   3.094  10.001   0.011
  381   2HB   ALA  48          2HB       ALA  48   4.065   8.799  -0.843
  382   3HB   ALA  48          3HB       ALA  48   4.797   9.790   0.421
  383    H    GLU  49           H        GLU  49   3.520   9.527   3.346
  384    HA   GLU  49           HA       GLU  49   6.297   9.074   4.091
  385   1HB   GLU  49          1HB       GLU  49   3.884  10.140   5.595
  386   2HB   GLU  49          2HB       GLU  49   5.555  10.277   6.145
  387   1HG   GLU  49          1HG       GLU  49   4.675  11.303   3.441
  388   2HG   GLU  49          2HG       GLU  49   4.572  12.301   4.891
  389    H    ASP  50           H        ASP  50   3.208   7.547   4.846
  390    HA   ASP  50           HA       ASP  50   4.214   6.000   7.108
  391   1HB   ASP  50          1HB       ASP  50   1.843   6.643   6.795
  392   2HB   ASP  50          2HB       ASP  50   1.783   5.694   5.309
  393    H    CYS  51           H        CYS  51   3.867   5.538   3.631
  394    HA   CYS  51           HA       CYS  51   4.478   2.687   3.643
  395   1HB   CYS  51          1HB       CYS  51   3.198   3.745   1.856
  396   2HB   CYS  51          2HB       CYS  51   4.518   4.869   1.529
  397    H    MET  52           H        MET  52   6.295   5.682   2.981
  398    HA   MET  52           HA       MET  52   8.803   4.392   2.369
  399   1HB   MET  52          1HB       MET  52   7.842   6.793   1.926
  400   2HB   MET  52          2HB       MET  52   8.511   7.159   3.517
  401   1HG   MET  52          1HG       MET  52  10.552   7.374   2.590
  402   2HG   MET  52          2HG       MET  52  10.482   5.692   2.065
  403   1HE   MET  52          1HE       MET  52   7.715   6.159  -0.193
  404   2HE   MET  52          2HE       MET  52   8.892   4.981   0.379
  405   3HE   MET  52          3HE       MET  52   8.998   5.591  -1.270
  406    H    ARG  53           H        ARG  53   7.391   5.689   5.373
  407    HA   ARG  53           HA       ARG  53   9.785   5.380   6.972
  408   1HB   ARG  53          1HB       ARG  53   6.885   5.948   7.330
  409   2HB   ARG  53          2HB       ARG  53   7.741   5.342   8.748
  410   1HG   ARG  53          1HG       ARG  53   9.199   7.179   8.807
  411   2HG   ARG  53          2HG       ARG  53   8.929   7.571   7.108
  412   1HD   ARG  53          1HD       ARG  53   7.771   9.193   8.600
  413   2HD   ARG  53          2HD       ARG  53   6.594   8.254   7.662
  414    HE   ARG  53           HE       ARG  53   5.852   7.415   9.744
  415   1HH1  ARG  53          1HH2      ARG  53   7.770   9.473  11.066
  416   2HH1  ARG  53          2HH2      ARG  53   8.609   8.437  12.172
  417   1HH2  ARG  53          1HH1      ARG  53   7.555   5.508  10.644
  418   2HH2  ARG  53          2HH1      ARG  53   8.486   6.193  11.934
  419    H    THR  54           H        THR  54   7.318   3.184   5.879
  420    HA   THR  54           HA       THR  54   8.112   1.135   7.900
  421    HB   THR  54           HB       THR  54   5.822   1.522   5.966
  422    HG1  THR  54           1HG      THR  54   5.273   2.427   7.805
  423   1HG2  THR  54          1HG2      THR  54   4.966  -0.665   6.610
  424   2HG2  THR  54          2HG2      THR  54   6.362  -0.936   7.654
  425   3HG2  THR  54          3HG2      THR  54   6.570  -0.857   5.903
  426    H    CYS  55           H        CYS  55   7.825   1.615   4.373
  427    HA   CYS  55           HA       CYS  55   9.126  -0.974   3.823
  428   1HB   CYS  55          1HB       CYS  55   8.282   1.304   2.004
  429   2HB   CYS  55          2HB       CYS  55   8.649  -0.347   1.504
  430    H    GLY  56           H        GLY  56   9.886   2.500   3.514
  431   1HA   GLY  56          1HA       GLY  56  12.293   2.435   2.138
  432   2HA   GLY  56          2HA       GLY  56  12.000   3.547   3.476
  433    H    GLY  57           H        GLY  57  14.565   2.545   3.049
  434   1HA   GLY  57          1HA       GLY  57  15.963   1.940   5.065
  435   2HA   GLY  57          2HA       GLY  57  14.853   0.589   5.297
  436    H    ALA  58           H        ALA  58  16.391   1.838   2.321
  437    HA   ALA  58           HA       ALA  58  17.277  -0.937   1.706
  438   1HB   ALA  58          1HB       ALA  58  17.659   0.105  -0.551
  439   2HB   ALA  58          2HB       ALA  58  17.118   1.644   0.118
  440   3HB   ALA  58          3HB       ALA  58  16.001   0.282   0.024
  Start of MODEL    9
    1   1H    ARG   1          1H        ARG   1  13.956  -5.377   7.141
    2   2H    ARG   1          2H        ARG   1  14.800  -5.070   5.700
    3   3H    ARG   1          3H        ARG   1  14.072  -6.584   5.956
    4    HA   ARG   1           HA       ARG   1  12.322  -4.244   6.061
    5   1HB   ARG   1          1HB       ARG   1  13.393  -3.510   4.159
    6   2HB   ARG   1          2HB       ARG   1  14.035  -5.108   3.779
    7   1HG   ARG   1          1HG       ARG   1  11.987  -5.811   2.797
    8   2HG   ARG   1          2HG       ARG   1  11.091  -4.471   3.511
    9   1HD   ARG   1          1HD       ARG   1  11.418  -3.823   1.236
   10   2HD   ARG   1          2HD       ARG   1  12.688  -2.949   2.118
   11    HE   ARG   1           HE       ARG   1  13.080  -5.327   0.393
   12   1HH1  ARG   1          1HH1      ARG   1  14.478  -2.491   1.232
   13   2HH1  ARG   1          2HH1      ARG   1  16.053  -3.119   1.583
   14   1HH2  ARG   1          1HH2      ARG   1  15.038  -6.436   1.497
   15   2HH2  ARG   1          2HH2      ARG   1  16.370  -5.355   1.735
   16    HA   PRO   2           HA       PRO   2   9.516  -7.636   6.129
   17   1HB   PRO   2          1HB       PRO   2   7.271  -6.306   5.298
   18   2HB   PRO   2          2HB       PRO   2   7.935  -6.161   6.932
   19   1HG   PRO   2          1HG       PRO   2   8.230  -4.343   4.577
   20   2HG   PRO   2          2HG       PRO   2   7.964  -3.936   6.279
   21   1HD   PRO   2          1HD       PRO   2  10.399  -3.783   5.075
   22   2HD   PRO   2          2HD       PRO   2  10.200  -4.167   6.800
   23    H    ASP   3           H        ASP   3   8.290  -8.978   4.641
   24    HA   ASP   3           HA       ASP   3   9.241  -8.781   1.863
   25   1HB   ASP   3          1HB       ASP   3   8.830 -10.821   3.577
   26   2HB   ASP   3          2HB       ASP   3   7.262 -10.817   2.771
   27    H    PHE   4           H        PHE   4   6.326  -8.058   3.687
   28    HA   PHE   4           HA       PHE   4   4.474  -8.218   1.482
   29   1HB   PHE   4          1HB       PHE   4   2.989  -6.999   2.956
   30   2HB   PHE   4          2HB       PHE   4   3.884  -8.183   3.896
   31    HD1  PHE   4           1HD      PHE   4   4.231  -4.565   2.809
   32    HD2  PHE   4           2HD      PHE   4   4.783  -7.508   5.899
   33    HE1  PHE   4           1HE      PHE   4   5.025  -2.808   4.347
   34    HE2  PHE   4           2HE      PHE   4   5.596  -5.739   7.430
   35    HZ   PHE   4           HZ       PHE   4   5.712  -3.387   6.656
   36    H    CYS   5           H        CYS   5   6.870  -5.863   2.346
   37    HA   CYS   5           HA       CYS   5   5.702  -3.586   1.009
   38   1HB   CYS   5          1HB       CYS   5   8.387  -4.470   2.006
   39   2HB   CYS   5          2HB       CYS   5   8.315  -3.063   0.944
   40    H    LEU   6           H        LEU   6   7.680  -6.319  -0.031
   41    HA   LEU   6           HA       LEU   6   8.099  -5.240  -2.737
   42   1HB   LEU   6          1HB       LEU   6   8.562  -8.043  -1.686
   43   2HB   LEU   6          2HB       LEU   6   9.391  -7.245  -3.022
   44    HG   LEU   6           HG       LEU   6   9.506  -6.053  -0.260
   45   1HD1  LEU   6          1HD1      LEU   6  10.246  -8.644  -0.611
   46   2HD1  LEU   6          2HD1      LEU   6  11.044  -7.547   0.517
   47   3HD1  LEU   6          3HD1      LEU   6  11.732  -7.823  -1.084
   48   1HD2  LEU   6          1HD2      LEU   6  11.142  -5.981  -2.794
   49   2HD2  LEU   6          2HD2      LEU   6  11.839  -5.483  -1.254
   50   3HD2  LEU   6          3HD2      LEU   6  10.436  -4.633  -1.901
   51    H    GLU   7           H        GLU   7   5.645  -6.940  -1.087
   52    HA   GLU   7           HA       GLU   7   4.661  -8.497  -3.365
   53   1HB   GLU   7          1HB       GLU   7   4.021  -7.988  -0.522
   54   2HB   GLU   7          2HB       GLU   7   2.629  -8.365  -1.537
   55   1HG   GLU   7          1HG       GLU   7   3.650 -10.433  -2.271
   56   2HG   GLU   7          2HG       GLU   7   5.167 -10.022  -1.471
   57    HA   PRO   8           HA       PRO   8   2.023  -5.498  -5.178
   58   1HB   PRO   8          1HB       PRO   8  -0.264  -6.924  -5.676
   59   2HB   PRO   8          2HB       PRO   8   1.238  -7.148  -6.593
   60   1HG   PRO   8          1HG       PRO   8   0.091  -8.772  -4.372
   61   2HG   PRO   8          2HG       PRO   8   0.937  -9.302  -5.833
   62   1HD   PRO   8          1HD       PRO   8   2.092  -9.150  -3.349
   63   2HD   PRO   8          2HD       PRO   8   2.997  -9.027  -4.873
   64    HA   PRO   9           HA       PRO   9  -0.582  -3.767  -2.095
   65   1HB   PRO   9          1HB       PRO   9  -2.309  -2.297  -3.644
   66   2HB   PRO   9          2HB       PRO   9  -0.630  -1.820  -3.328
   67   1HG   PRO   9          1HG       PRO   9  -1.831  -3.127  -5.722
   68   2HG   PRO   9          2HG       PRO   9  -0.565  -1.891  -5.624
   69   1HD   PRO   9          1HD       PRO   9  -0.084  -4.555  -6.069
   70   2HD   PRO   9          2HD       PRO   9   1.088  -3.448  -5.320
   71    H    TYR  10           H        TYR  10  -3.055  -3.544  -1.564
   72    HA   TYR  10           HA       TYR  10  -4.496  -5.983  -2.591
   73   1HB   TYR  10          1HB       TYR  10  -3.634  -6.219  -0.302
   74   2HB   TYR  10          2HB       TYR  10  -4.419  -4.711   0.165
   75    HD1  TYR  10           1HD      TYR  10  -6.756  -4.632   0.685
   76    HD2  TYR  10           2HD      TYR  10  -5.030  -8.190  -0.992
   77    HE1  TYR  10           1HE      TYR  10  -8.850  -5.875   1.164
   78    HE2  TYR  10           2HE      TYR  10  -7.122  -9.430  -0.513
   79    HH   TYR  10           HH       TYR  10  -9.963  -7.786   0.855
   80    H    THR  11           H        THR  11  -5.735  -4.827  -4.121
   81    HA   THR  11           HA       THR  11  -7.176  -2.406  -3.569
   82    HB   THR  11           HB       THR  11  -7.297  -4.672  -5.551
   83    HG1  THR  11           1HG      THR  11  -5.808  -2.978  -5.814
   84   1HG2  THR  11          1HG2      THR  11  -9.414  -2.617  -5.024
   85   2HG2  THR  11          2HG2      THR  11  -9.589  -4.301  -5.517
   86   3HG2  THR  11          3HG2      THR  11  -9.078  -3.087  -6.690
   87    H    GLY  12           H        GLY  12  -7.655  -5.748  -2.765
   88   1HA   GLY  12          1HA       GLY  12  -9.297  -6.798  -1.449
   89   2HA   GLY  12          2HA       GLY  12  -9.752  -5.188  -0.893
   90    HA   PRO  13           HA       PRO  13 -12.744  -6.965  -4.147
   91   1HB   PRO  13          1HB       PRO  13 -14.344  -8.620  -2.665
   92   2HB   PRO  13          2HB       PRO  13 -12.911  -9.187  -3.543
   93   1HG   PRO  13          1HG       PRO  13 -13.287  -8.641  -0.648
   94   2HG   PRO  13          2HG       PRO  13 -12.293  -9.866  -1.446
   95   1HD   PRO  13          1HD       PRO  13 -11.360  -7.490  -0.357
   96   2HD   PRO  13          2HD       PRO  13 -10.498  -8.477  -1.557
   97    H    CYS  14           H        CYS  14 -13.274  -4.632  -3.703
   98    HA   CYS  14           HA       CYS  14 -15.853  -4.415  -2.222
   99   1HB   CYS  14          1HB       CYS  14 -13.231  -3.161  -1.600
  100   2HB   CYS  14          2HB       CYS  14 -14.633  -2.096  -1.501
  101    H    LYS  15           H        LYS  15 -16.904  -2.233  -2.752
  102    HA   LYS  15           HA       LYS  15 -16.516  -1.661  -5.642
  103   1HB   LYS  15          1HB       LYS  15 -18.621  -0.658  -3.702
  104   2HB   LYS  15          2HB       LYS  15 -18.728  -0.707  -5.462
  105   1HG   LYS  15          1HG       LYS  15 -18.390  -3.177  -3.739
  106   2HG   LYS  15          2HG       LYS  15 -19.960  -2.576  -4.278
  107   1HD   LYS  15          1HD       LYS  15 -19.195  -2.758  -6.633
  108   2HD   LYS  15          2HD       LYS  15 -17.651  -3.399  -6.069
  109   1HE   LYS  15          1HE       LYS  15 -20.110  -4.761  -5.063
  110   2HE   LYS  15          2HE       LYS  15 -19.684  -5.021  -6.767
  111   1HZ   LYS  15          1HZ       LYS  15 -17.338  -5.364  -5.903
  112   2HZ   LYS  15          2HZ       LYS  15 -18.446  -6.603  -5.555
  113   3HZ   LYS  15          3HZ       LYS  15 -18.017  -5.481  -4.353
  114    H    ALA  16           H        ALA  16 -15.193  -0.516  -2.860
  115    HA   ALA  16           HA       ALA  16 -15.428   2.373  -3.442
  116   1HB   ALA  16          1HB       ALA  16 -13.957   2.467  -1.384
  117   2HB   ALA  16          2HB       ALA  16 -13.988   0.704  -1.358
  118   3HB   ALA  16          3HB       ALA  16 -15.482   1.615  -1.140
  119    H    ARG  17           H        ARG  17 -13.394   3.667  -3.679
  120    HA   ARG  17           HA       ARG  17 -11.085   2.141  -4.800
  121   1HB   ARG  17          1HB       ARG  17 -12.321   4.529  -6.188
  122   2HB   ARG  17          2HB       ARG  17 -11.178   3.359  -6.849
  123   1HG   ARG  17          1HG       ARG  17 -13.100   1.635  -6.272
  124   2HG   ARG  17          2HG       ARG  17 -14.122   3.070  -6.355
  125   1HD   ARG  17          1HD       ARG  17 -14.029   2.028  -8.575
  126   2HD   ARG  17          2HD       ARG  17 -13.121   3.552  -8.631
  127    HE   ARG  17           HE       ARG  17 -11.335   1.493  -7.813
  128   1HH1  ARG  17          1HH1      ARG  17 -12.886  -0.014  -9.910
  129   2HH1  ARG  17          2HH1      ARG  17 -11.984   0.347 -11.344
  130   1HH2  ARG  17          1HH2      ARG  17 -10.305   3.033  -9.929
  131   2HH2  ARG  17          2HH2      ARG  17 -10.521   2.074 -11.355
  132    H    ILE  18           H        ILE  18 -10.342   2.985  -2.569
  133    HA   ILE  18           HA       ILE  18  -9.827   5.885  -2.407
  134    HB   ILE  18           HB       ILE  18  -9.043   3.535  -0.651
  135   1HG1  ILE  18          1HG1      ILE  18 -11.358   5.493  -0.493
  136   2HG1  ILE  18          2HG1      ILE  18 -11.478   3.774  -0.868
  137   1HG2  ILE  18          1HG2      ILE  18  -9.046   6.527  -0.150
  138   2HG2  ILE  18          2HG2      ILE  18  -7.626   5.484  -0.242
  139   3HG2  ILE  18          3HG2      ILE  18  -8.769   5.303   1.088
  140   1HD1  ILE  18          1HD1      ILE  18 -11.491   4.999   1.698
  141   2HD1  ILE  18          2HD1      ILE  18  -9.978   4.104   1.564
  142   3HD1  ILE  18          3HD1      ILE  18 -11.516   3.274   1.329
  143    H    ILE  19           H        ILE  19  -7.645   6.746  -2.249
  144    HA   ILE  19           HA       ILE  19  -5.686   5.223  -3.893
  145    HB   ILE  19           HB       ILE  19  -5.975   8.102  -2.990
  146   1HG1  ILE  19          1HG1      ILE  19  -7.492   7.313  -4.790
  147   2HG1  ILE  19          2HG1      ILE  19  -6.337   8.504  -5.387
  148   1HG2  ILE  19          1HG2      ILE  19  -3.866   8.578  -3.673
  149   2HG2  ILE  19          2HG2      ILE  19  -3.993   7.518  -5.075
  150   3HG2  ILE  19          3HG2      ILE  19  -3.562   6.850  -3.502
  151   1HD1  ILE  19          1HD1      ILE  19  -6.003   6.928  -7.018
  152   2HD1  ILE  19          2HD1      ILE  19  -6.556   5.603  -5.994
  153   3HD1  ILE  19          3HD1      ILE  19  -4.920   6.235  -5.812
  154    H    ARG  20           H        ARG  20  -4.980   3.758  -2.180
  155    HA   ARG  20           HA       ARG  20  -3.775   4.952   0.247
  156   1HB   ARG  20          1HB       ARG  20  -4.379   2.191  -0.801
  157   2HB   ARG  20          2HB       ARG  20  -3.345   2.405   0.612
  158   1HG   ARG  20          1HG       ARG  20  -6.169   3.476   0.305
  159   2HG   ARG  20          2HG       ARG  20  -5.699   2.088   1.284
  160   1HD   ARG  20          1HD       ARG  20  -5.422   3.584   2.985
  161   2HD   ARG  20          2HD       ARG  20  -3.970   4.127   2.120
  162    HE   ARG  20           HE       ARG  20  -5.360   5.847   1.033
  163   1HH1  ARG  20          1HH2      ARG  20  -7.301   3.721   2.846
  164   2HH1  ARG  20          2HH2      ARG  20  -8.392   4.945   3.404
  165   1HH2  ARG  20          1HH1      ARG  20  -6.575   7.561   2.033
  166   2HH2  ARG  20          2HH1      ARG  20  -7.979   7.120   2.945
  167    H    TYR  21           H        TYR  21  -1.535   3.819   0.822
  168    HA   TYR  21           HA       TYR  21   0.238   4.149  -1.572
  169   1HB   TYR  21          1HB       TYR  21   0.466   4.742   1.370
  170   2HB   TYR  21          2HB       TYR  21   1.921   4.544   0.399
  171    HD1  TYR  21           1HD      TYR  21  -1.084   6.597   0.963
  172    HD2  TYR  21           2HD      TYR  21   2.521   6.145  -1.326
  173    HE1  TYR  21           1HE      TYR  21  -1.301   8.936   0.156
  174    HE2  TYR  21           2HE      TYR  21   2.303   8.479  -2.135
  175    HH   TYR  21           HH       TYR  21   1.140  10.646  -1.194
  176    H    PHE  22           H        PHE  22   1.827   2.591  -1.960
  177    HA   PHE  22           HA       PHE  22   2.127   0.330  -0.053
  178   1HB   PHE  22          1HB       PHE  22   1.458  -1.293  -1.624
  179   2HB   PHE  22          2HB       PHE  22   0.287  -0.010  -1.848
  180    HD1  PHE  22           1HD      PHE  22   3.125  -1.799  -3.308
  181    HD2  PHE  22           2HD      PHE  22   0.403   1.489  -3.816
  182    HE1  PHE  22           1HE      PHE  22   3.769  -1.634  -5.699
  183    HE2  PHE  22           2HE      PHE  22   1.051   1.656  -6.205
  184    HZ   PHE  22           HZ       PHE  22   2.732   0.093  -7.148
  185    H    TYR  23           H        TYR  23   4.100  -0.878  -0.485
  186    HA   TYR  23           HA       TYR  23   6.220   0.842  -1.597
  187   1HB   TYR  23          1HB       TYR  23   6.388  -0.456   0.537
  188   2HB   TYR  23          2HB       TYR  23   6.331  -1.951  -0.405
  189    HD1  TYR  23           1HD      TYR  23   8.371  -2.885  -1.079
  190    HD2  TYR  23           2HD      TYR  23   8.140   1.343  -0.358
  191    HE1  TYR  23           1HE      TYR  23  10.790  -2.673  -1.568
  192    HE2  TYR  23           2HE      TYR  23  10.561   1.556  -0.845
  193    HH   TYR  23           HH       TYR  23  12.664  -0.876  -0.809
  194    H    ASN  24           H        ASN  24   6.311   0.792  -3.853
  195    HA   ASN  24           HA       ASN  24   5.811  -1.676  -5.365
  196   1HB   ASN  24          1HB       ASN  24   5.214   0.607  -6.157
  197   2HB   ASN  24          2HB       ASN  24   6.922   1.037  -6.167
  198   1HD2  ASN  24          1HD2      ASN  24   4.903   0.739  -8.462
  199   2HD2  ASN  24          2HD2      ASN  24   5.654  -0.332  -9.544
  200    H    ALA  25           H        ALA  25   7.529  -3.064  -4.482
  201    HA   ALA  25           HA       ALA  25  10.232  -2.539  -4.180
  202   1HB   ALA  25          1HB       ALA  25   9.771  -4.724  -3.687
  203   2HB   ALA  25          2HB       ALA  25  10.249  -5.010  -5.361
  204   3HB   ALA  25          3HB       ALA  25   8.543  -4.845  -4.947
  205    H    LYS  26           H        LYS  26   8.421  -2.746  -7.176
  206    HA   LYS  26           HA       LYS  26  10.738  -2.923  -8.930
  207   1HB   LYS  26          1HB       LYS  26   8.007  -3.271  -9.101
  208   2HB   LYS  26          2HB       LYS  26   8.239  -1.746  -9.957
  209   1HG   LYS  26          1HG       LYS  26  10.309  -3.248 -10.944
  210   2HG   LYS  26          2HG       LYS  26   9.069  -4.479 -10.706
  211   1HD   LYS  26          1HD       LYS  26   7.637  -2.404 -11.826
  212   2HD   LYS  26          2HD       LYS  26   9.186  -2.286 -12.661
  213   1HE   LYS  26          1HE       LYS  26   9.040  -4.663 -13.299
  214   2HE   LYS  26          2HE       LYS  26   7.508  -4.814 -12.416
  215   1HZ   LYS  26          1HZ       LYS  26   7.510  -4.215 -14.945
  216   2HZ   LYS  26          2HZ       LYS  26   7.856  -2.650 -14.384
  217   3HZ   LYS  26          3HZ       LYS  26   6.431  -3.435 -13.894
  218    H    ALA  27           H        ALA  27   8.989  -0.344  -7.334
  219    HA   ALA  27           HA       ALA  27  10.282   1.736  -9.025
  220   1HB   ALA  27          1HB       ALA  27   8.568   2.344  -6.656
  221   2HB   ALA  27          2HB       ALA  27   7.803   1.513  -8.011
  222   3HB   ALA  27          3HB       ALA  27   8.567   3.083  -8.257
  223    H    GLY  28           H        GLY  28  10.701   0.120  -5.994
  224   1HA   GLY  28          1HA       GLY  28  12.537   0.320  -4.506
  225   2HA   GLY  28          2HA       GLY  28  13.095   1.713  -5.435
  226    H    LEU  29           H        LEU  29   9.881   2.223  -4.852
  227    HA   LEU  29           HA       LEU  29  10.265   3.421  -2.159
  228   1HB   LEU  29          1HB       LEU  29   9.455   5.576  -3.035
  229   2HB   LEU  29          2HB       LEU  29  10.891   5.071  -3.926
  230    HG   LEU  29           HG       LEU  29   8.475   3.980  -5.123
  231   1HD1  LEU  29          1HD1      LEU  29   7.433   6.029  -5.846
  232   2HD1  LEU  29          2HD1      LEU  29   8.692   7.002  -5.086
  233   3HD1  LEU  29          3HD1      LEU  29   7.553   6.100  -4.089
  234   1HD2  LEU  29          1HD2      LEU  29  10.172   6.052  -6.444
  235   2HD2  LEU  29          2HD2      LEU  29   9.597   4.507  -7.070
  236   3HD2  LEU  29          3HD2      LEU  29  10.963   4.553  -5.955
  237    H    CYS  30           H        CYS  30   7.738   4.934  -2.648
  238    HA   CYS  30           HA       CYS  30   5.823   2.625  -2.596
  239   1HB   CYS  30          1HB       CYS  30   5.867   5.232  -1.045
  240   2HB   CYS  30          2HB       CYS  30   4.565   4.048  -0.962
  241    H    GLN  31           H        GLN  31   3.837   2.943  -3.644
  242    HA   GLN  31           HA       GLN  31   3.467   5.515  -5.127
  243   1HB   GLN  31          1HB       GLN  31   3.587   2.668  -6.109
  244   2HB   GLN  31          2HB       GLN  31   2.645   3.868  -6.996
  245   1HG   GLN  31          1HG       GLN  31   4.901   5.284  -6.672
  246   2HG   GLN  31          2HG       GLN  31   5.599   3.666  -6.615
  247   1HE2  GLN  31          1HE2      GLN  31   6.575   3.718  -8.722
  248   2HE2  GLN  31          2HE2      GLN  31   5.665   3.805 -10.152
  249    H    THR  32           H        THR  32   1.168   5.842  -5.740
  250    HA   THR  32           HA       THR  32  -0.634   4.865  -3.653
  251    HB   THR  32           HB       THR  32  -2.159   6.254  -5.451
  252    HG1  THR  32           1HG      THR  32  -0.387   6.506  -6.843
  253   1HG2  THR  32          1HG2      THR  32  -1.667   6.708  -3.000
  254   2HG2  THR  32          2HG2      THR  32  -1.840   8.142  -4.012
  255   3HG2  THR  32          3HG2      THR  32  -0.235   7.587  -3.536
  256    H    PHE  33           H        PHE  33  -2.347   3.428  -3.929
  257    HA   PHE  33           HA       PHE  33  -2.745   2.232  -6.636
  258   1HB   PHE  33          1HB       PHE  33  -2.430   0.035  -5.804
  259   2HB   PHE  33          2HB       PHE  33  -1.123   0.962  -5.079
  260    HD1  PHE  33           1HD      PHE  33  -1.218   1.624  -2.680
  261    HD2  PHE  33           2HD      PHE  33  -4.237  -0.858  -4.470
  262    HE1  PHE  33           1HE      PHE  33  -2.006   0.967  -0.434
  263    HE2  PHE  33           2HE      PHE  33  -5.025  -1.519  -2.213
  264    HZ   PHE  33           HZ       PHE  33  -3.908  -0.610  -0.194
  265    H    VAL  34           H        VAL  34  -4.821   1.045  -6.759
  266    HA   VAL  34           HA       VAL  34  -6.959   2.533  -5.473
  267    HB   VAL  34           HB       VAL  34  -7.084  -0.043  -7.068
  268   1HG1  VAL  34          1HG1      VAL  34  -9.079   1.450  -5.871
  269   2HG1  VAL  34          2HG1      VAL  34  -9.308   0.360  -7.238
  270   3HG1  VAL  34          3HG1      VAL  34  -9.058   2.084  -7.517
  271   1HG2  VAL  34          1HG2      VAL  34  -7.390   1.694  -8.995
  272   2HG2  VAL  34          2HG2      VAL  34  -5.755   1.335  -8.439
  273   3HG2  VAL  34          3HG2      VAL  34  -6.566   2.807  -7.903
  274    H    TYR  35           H        TYR  35  -7.388   2.150  -3.330
  275    HA   TYR  35           HA       TYR  35  -7.057  -0.562  -2.184
  276   1HB   TYR  35          1HB       TYR  35  -6.218   1.397  -0.993
  277   2HB   TYR  35          2HB       TYR  35  -7.807   2.160  -1.066
  278    HD1  TYR  35           1HD      TYR  35  -7.030  -1.419  -0.387
  279    HD2  TYR  35           2HD      TYR  35  -8.404   2.316   1.230
  280    HE1  TYR  35           1HE      TYR  35  -7.668  -2.566   1.718
  281    HE2  TYR  35           2HE      TYR  35  -9.043   1.169   3.335
  282    HH   TYR  35           HH       TYR  35  -9.703  -1.336   3.936
  283    H    GLY  36           H        GLY  36  -8.849  -1.713  -1.229
  284   1HA   GLY  36          1HA       GLY  36 -11.443  -1.150  -2.492
  285   2HA   GLY  36          2HA       GLY  36 -11.050  -2.569  -1.522
  286    H    ALA  37           H        ALA  37  -9.939  -0.107   0.314
  287    HA   ALA  37           HA       ALA  37 -10.835   1.139   2.127
  288   1HB   ALA  37          1HB       ALA  37 -13.581   0.547   1.045
  289   2HB   ALA  37          2HB       ALA  37 -12.511   1.642   0.171
  290   3HB   ALA  37          3HB       ALA  37 -12.994   2.015   1.825
  291    H    CYS  38           H        CYS  38 -11.110  -2.067   1.619
  292    HA   CYS  38           HA       CYS  38 -12.235  -2.533   4.339
  293   1HB   CYS  38          1HB       CYS  38 -13.628  -4.369   3.360
  294   2HB   CYS  38          2HB       CYS  38 -14.080  -2.777   2.750
  295    H    ARG  39           H        ARG  39 -11.679  -4.753   5.115
  296    HA   ARG  39           HA       ARG  39 -10.002  -6.375   5.534
  297   1HB   ARG  39          1HB       ARG  39 -10.336  -6.352   2.522
  298   2HB   ARG  39          2HB       ARG  39  -9.441  -7.604   3.385
  299   1HG   ARG  39          1HG       ARG  39 -11.604  -7.831   4.820
  300   2HG   ARG  39          2HG       ARG  39 -12.386  -6.971   3.492
  301   1HD   ARG  39          1HD       ARG  39 -12.402  -8.857   2.226
  302   2HD   ARG  39          2HD       ARG  39 -10.663  -9.100   2.491
  303    HE   ARG  39           HE       ARG  39 -11.596  -9.872   4.888
  304   1HH1  ARG  39          1HH2      ARG  39 -12.457 -10.663   1.660
  305   2HH1  ARG  39          2HH2      ARG  39 -13.383 -12.058   2.100
  306   1HH2  ARG  39          1HH1      ARG  39 -12.972 -11.585   5.510
  307   2HH2  ARG  39          2HH1      ARG  39 -13.674 -12.580   4.280
  308    H    ALA  40           H        ALA  40  -9.035  -3.587   5.259
  309    HA   ALA  40           HA       ALA  40  -6.803  -3.186   3.628
  310   1HB   ALA  40          1HB       ALA  40  -6.149  -2.230   6.213
  311   2HB   ALA  40          2HB       ALA  40  -7.910  -2.199   6.112
  312   3HB   ALA  40          3HB       ALA  40  -6.942  -1.335   4.918
  313    H    LYS  41           H        LYS  41  -4.535  -3.663   3.888
  314    HA   LYS  41           HA       LYS  41  -3.903  -5.837   5.857
  315   1HB   LYS  41          1HB       LYS  41  -3.037  -5.617   2.955
  316   2HB   LYS  41          2HB       LYS  41  -2.661  -6.945   4.051
  317   1HG   LYS  41          1HG       LYS  41  -5.236  -7.160   4.325
  318   2HG   LYS  41          2HG       LYS  41  -5.327  -6.179   2.861
  319   1HD   LYS  41          1HD       LYS  41  -4.621  -7.893   1.538
  320   2HD   LYS  41          2HD       LYS  41  -3.399  -8.404   2.702
  321   1HE   LYS  41          1HE       LYS  41  -6.372  -8.937   3.049
  322   2HE   LYS  41          2HE       LYS  41  -5.228 -10.110   2.371
  323   1HZ   LYS  41          1HZ       LYS  41  -4.025  -9.075   4.638
  324   2HZ   LYS  41          2HZ       LYS  41  -4.697 -10.626   4.464
  325   3HZ   LYS  41          3HZ       LYS  41  -5.635  -9.356   5.090
  326    H    ARG  42           H        ARG  42  -1.202  -6.099   5.127
  327    HA   ARG  42           HA       ARG  42  -0.025  -3.778   6.429
  328   1HB   ARG  42          1HB       ARG  42   1.989  -5.100   6.278
  329   2HB   ARG  42          2HB       ARG  42   0.674  -6.210   6.630
  330   1HG   ARG  42          1HG       ARG  42   0.531  -6.312   3.980
  331   2HG   ARG  42          2HG       ARG  42   2.217  -5.834   4.109
  332   1HD   ARG  42          1HD       ARG  42   2.784  -7.802   5.322
  333   2HD   ARG  42          2HD       ARG  42   1.091  -8.121   5.745
  334    HE   ARG  42           HE       ARG  42   1.441  -8.042   2.875
  335   1HH1  ARG  42          1HH1      ARG  42   3.402  -9.892   4.699
  336   2HH1  ARG  42          2HH1      ARG  42   2.709 -11.426   4.292
  337   1HH2  ARG  42          1HH2      ARG  42  -0.083 -10.055   2.758
  338   2HH2  ARG  42          2HH2      ARG  42   0.735 -11.518   3.194
  339    H    ASN  43           H        ASN  43  -0.241  -4.927   3.068
  340    HA   ASN  43           HA       ASN  43   1.606  -2.809   2.147
  341   1HB   ASN  43          1HB       ASN  43   1.309  -5.261   1.279
  342   2HB   ASN  43          2HB       ASN  43  -0.085  -4.610   0.416
  343   1HD2  ASN  43          1HD2      ASN  43   3.460  -4.176   0.817
  344   2HD2  ASN  43          2HD2      ASN  43   3.704  -3.451  -0.698
  345    H    ASN  44           H        ASN  44  -0.086  -1.274   3.216
  346    HA   ASN  44           HA       ASN  44  -1.639   0.010   1.108
  347   1HB   ASN  44          1HB       ASN  44  -3.103  -1.882   1.683
  348   2HB   ASN  44          2HB       ASN  44  -2.996  -1.472   3.393
  349   1HD2  ASN  44          1HD2      ASN  44  -5.534  -1.575   2.312
  350   2HD2  ASN  44          2HD2      ASN  44  -6.175  -0.002   2.131
  351    H    PHE  45           H        PHE  45   0.055   1.521   2.108
  352    HA   PHE  45           HA       PHE  45  -0.479   2.508   4.825
  353   1HB   PHE  45          1HB       PHE  45   1.333   3.662   2.687
  354   2HB   PHE  45          2HB       PHE  45   1.522   3.770   4.438
  355    HD1  PHE  45           1HD      PHE  45   2.247   1.843   1.467
  356    HD2  PHE  45           2HD      PHE  45   1.950   1.598   5.749
  357    HE1  PHE  45           1HE      PHE  45   3.560  -0.264   1.437
  358    HE2  PHE  45           2HE      PHE  45   3.265  -0.508   5.718
  359    HZ   PHE  45           HZ       PHE  45   4.067  -1.452   3.558
  360    H    LYS  46           H        LYS  46  -1.562   4.425   5.316
  361    HA   LYS  46           HA       LYS  46  -3.311   5.579   3.297
  362   1HB   LYS  46          1HB       LYS  46  -3.967   5.325   5.634
  363   2HB   LYS  46          2HB       LYS  46  -2.609   6.326   6.155
  364   1HG   LYS  46          1HG       LYS  46  -3.973   7.853   4.220
  365   2HG   LYS  46          2HG       LYS  46  -5.233   7.142   5.230
  366   1HD   LYS  46          1HD       LYS  46  -2.982   8.098   6.821
  367   2HD   LYS  46          2HD       LYS  46  -3.689   9.389   5.849
  368   1HE   LYS  46          1HE       LYS  46  -5.131   9.503   7.660
  369   2HE   LYS  46          2HE       LYS  46  -5.959   8.211   6.767
  370   1HZ   LYS  46          1HZ       LYS  46  -3.683   7.432   8.419
  371   2HZ   LYS  46          2HZ       LYS  46  -5.156   6.627   8.156
  372   3HZ   LYS  46          3HZ       LYS  46  -5.073   7.916   9.259
  373    H    SER  47           H        SER  47  -0.132   6.311   4.513
  374    HA   SER  47           HA       SER  47  -0.118   8.796   2.838
  375   1HB   SER  47          1HB       SER  47   1.142   9.898   4.622
  376   2HB   SER  47          2HB       SER  47  -0.363   9.266   5.279
  377    HG   SER  47           HG       SER  47   0.702   7.919   6.472
  378    H    ALA  48           H        ALA  48   2.009   9.324   2.001
  379    HA   ALA  48           HA       ALA  48   3.569   7.042   1.185
  380   1HB   ALA  48          1HB       ALA  48   5.107   8.959   0.408
  381   2HB   ALA  48          2HB       ALA  48   3.905  10.047   1.102
  382   3HB   ALA  48          3HB       ALA  48   3.459   8.967  -0.219
  383    H    GLU  49           H        GLU  49   3.732   9.228   3.901
  384    HA   GLU  49           HA       GLU  49   6.497   8.701   4.623
  385   1HB   GLU  49          1HB       GLU  49   4.068  10.011   5.783
  386   2HB   GLU  49          2HB       GLU  49   5.398   9.625   6.876
  387   1HG   GLU  49          1HG       GLU  49   6.937  10.952   5.599
  388   2HG   GLU  49          2HG       GLU  49   5.788  11.123   4.272
  389    H    ASP  50           H        ASP  50   3.363   7.262   5.407
  390    HA   ASP  50           HA       ASP  50   4.303   5.606   7.590
  391   1HB   ASP  50          1HB       ASP  50   1.916   5.667   5.737
  392   2HB   ASP  50          2HB       ASP  50   2.105   4.379   6.928
  393    H    CYS  51           H        CYS  51   3.969   5.191   4.085
  394    HA   CYS  51           HA       CYS  51   4.701   2.367   4.060
  395   1HB   CYS  51          1HB       CYS  51   3.387   3.508   2.294
  396   2HB   CYS  51          2HB       CYS  51   4.770   4.541   1.931
  397    H    MET  52           H        MET  52   6.406   5.448   3.435
  398    HA   MET  52           HA       MET  52   8.963   4.347   2.787
  399   1HB   MET  52          1HB       MET  52   7.727   6.854   3.087
  400   2HB   MET  52          2HB       MET  52   9.053   6.865   4.248
  401   1HG   MET  52          1HG       MET  52  10.452   7.295   2.532
  402   2HG   MET  52          2HG       MET  52  10.099   5.681   1.913
  403   1HE   MET  52          1HE       MET  52   9.167   6.477  -1.410
  404   2HE   MET  52          2HE       MET  52   8.503   5.257  -0.326
  405   3HE   MET  52          3HE       MET  52  10.208   5.692  -0.215
  406    H    ARG  53           H        ARG  53   7.729   5.619   5.912
  407    HA   ARG  53           HA       ARG  53   9.963   5.062   7.529
  408   1HB   ARG  53          1HB       ARG  53   6.994   5.229   7.882
  409   2HB   ARG  53          2HB       ARG  53   7.952   4.632   9.238
  410   1HG   ARG  53          1HG       ARG  53   9.390   6.674   9.049
  411   2HG   ARG  53          2HG       ARG  53   8.310   7.276   7.791
  412   1HD   ARG  53          1HD       ARG  53   6.747   6.457  10.081
  413   2HD   ARG  53          2HD       ARG  53   8.008   7.600  10.588
  414    HE   ARG  53           HE       ARG  53   6.925   8.579   8.163
  415   1HH1  ARG  53          1HH2      ARG  53   4.959   7.280  10.495
  416   2HH1  ARG  53          2HH2      ARG  53   4.153   8.755  10.916
  417   1HH2  ARG  53          1HH1      ARG  53   6.304  10.762   9.078
  418   2HH2  ARG  53          2HH1      ARG  53   4.915  10.727  10.113
  419    H    THR  54           H        THR  54   7.657   2.879   6.080
  420    HA   THR  54           HA       THR  54   8.451   0.598   7.783
  421    HB   THR  54           HB       THR  54   6.545   1.059   5.475
  422    HG1  THR  54           1HG      THR  54   5.121   0.290   7.237
  423   1HG2  THR  54          1HG2      THR  54   7.711  -1.449   6.457
  424   2HG2  THR  54          2HG2      THR  54   6.822  -1.125   4.969
  425   3HG2  THR  54          3HG2      THR  54   5.947  -1.439   6.466
  426    H    CYS  55           H        CYS  55   8.630   1.501   4.318
  427    HA   CYS  55           HA       CYS  55  11.117  -0.143   4.099
  428   1HB   CYS  55          1HB       CYS  55   8.692  -0.269   2.278
  429   2HB   CYS  55          2HB       CYS  55  10.189  -1.174   2.052
  430    H    GLY  56           H        GLY  56  11.201   2.605   4.243
  431   1HA   GLY  56          1HA       GLY  56  11.329   3.573   1.425
  432   2HA   GLY  56          2HA       GLY  56  11.305   4.609   2.854
  433    H    GLY  57           H        GLY  57  13.272   5.321   1.291
  434   1HA   GLY  57          1HA       GLY  57  15.601   5.651   1.280
  435   2HA   GLY  57          2HA       GLY  57  15.675   4.682   2.754
  436    H    ALA  58           H        ALA  58  16.289   4.715  -0.608
  437    HA   ALA  58           HA       ALA  58  16.935   1.788  -0.504
  438   1HB   ALA  58          1HB       ALA  58  15.937   1.498  -2.622
  439   2HB   ALA  58          2HB       ALA  58  15.998   3.222  -2.987
  440   3HB   ALA  58          3HB       ALA  58  14.831   2.609  -1.815
  Start of MODEL   10
    1   1H    ARG   1          1H        ARG   1  14.602  -5.043   4.340
    2   2H    ARG   1          2H        ARG   1  14.196  -5.822   2.885
    3   3H    ARG   1          3H        ARG   1  13.932  -6.602   4.371
    4    HA   ARG   1           HA       ARG   1  12.520  -4.306   4.684
    5   1HB   ARG   1          1HB       ARG   1  12.847  -5.093   1.821
    6   2HB   ARG   1          2HB       ARG   1  11.239  -4.578   2.331
    7   1HG   ARG   1          1HG       ARG   1  11.983  -2.429   2.918
    8   2HG   ARG   1          2HG       ARG   1  13.659  -2.946   3.073
    9   1HD   ARG   1          1HD       ARG   1  13.874  -3.167   0.658
   10   2HD   ARG   1          2HD       ARG   1  12.138  -2.867   0.434
   11    HE   ARG   1           HE       ARG   1  12.774  -0.586   0.487
   12   1HH1  ARG   1          1HH2      ARG   1  15.695  -1.633   1.080
   13   2HH1  ARG   1          2HH2      ARG   1  16.072  -0.637   2.446
   14   1HH2  ARG   1          1HH1      ARG   1  12.789   0.354   2.960
   15   2HH2  ARG   1          2HH1      ARG   1  14.426   0.482   3.515
   16    HA   PRO   2           HA       PRO   2   9.647  -7.457   5.771
   17   1HB   PRO   2          1HB       PRO   2   7.268  -6.120   5.511
   18   2HB   PRO   2          2HB       PRO   2   8.380  -5.881   6.864
   19   1HG   PRO   2          1HG       PRO   2   7.973  -4.243   4.405
   20   2HG   PRO   2          2HG       PRO   2   8.272  -3.712   6.065
   21   1HD   PRO   2          1HD       PRO   2  10.188  -3.756   4.124
   22   2HD   PRO   2          2HD       PRO   2  10.547  -3.960   5.854
   23    H    ASP   3           H        ASP   3   8.255  -8.993   4.807
   24    HA   ASP   3           HA       ASP   3   8.341  -9.207   1.943
   25   1HB   ASP   3          1HB       ASP   3   7.232 -10.641   4.286
   26   2HB   ASP   3          2HB       ASP   3   6.399 -10.943   2.761
   27    H    PHE   4           H        PHE   4   5.921  -7.935   4.216
   28    HA   PHE   4           HA       PHE   4   3.765  -7.857   2.283
   29   1HB   PHE   4          1HB       PHE   4   2.627  -6.561   3.967
   30   2HB   PHE   4          2HB       PHE   4   3.590  -7.772   4.796
   31    HD1  PHE   4           1HD      PHE   4   5.074  -7.156   6.461
   32    HD2  PHE   4           2HD      PHE   4   3.731  -4.183   3.660
   33    HE1  PHE   4           1HE      PHE   4   6.177  -5.393   7.795
   34    HE2  PHE   4           2HE      PHE   4   4.851  -2.432   4.993
   35    HZ   PHE   4           HZ       PHE   4   6.071  -3.025   7.058
   36    H    CYS   5           H        CYS   5   6.521  -5.843   2.822
   37    HA   CYS   5           HA       CYS   5   5.442  -3.508   1.420
   38   1HB   CYS   5          1HB       CYS   5   7.049  -3.129   3.135
   39   2HB   CYS   5          2HB       CYS   5   8.108  -4.401   2.528
   40    H    LEU   6           H        LEU   6   7.188  -6.432   0.632
   41    HA   LEU   6           HA       LEU   6   7.992  -5.423  -2.038
   42   1HB   LEU   6          1HB       LEU   6   8.229  -8.205  -0.859
   43   2HB   LEU   6          2HB       LEU   6   9.203  -7.499  -2.150
   44    HG   LEU   6           HG       LEU   6   9.152  -6.641   0.755
   45   1HD1  LEU   6          1HD1      LEU   6  10.769  -8.491  -0.803
   46   2HD1  LEU   6          2HD1      LEU   6  10.751  -8.222   0.939
   47   3HD1  LEU   6          3HD1      LEU   6  11.756  -7.211  -0.098
   48   1HD2  LEU   6          1HD2      LEU   6   9.407  -4.677  -0.656
   49   2HD2  LEU   6          2HD2      LEU   6  10.612  -5.500  -1.648
   50   3HD2  LEU   6          3HD2      LEU   6  10.984  -5.080   0.024
   51    H    GLU   7           H        GLU   7   5.355  -7.019  -0.549
   52    HA   GLU   7           HA       GLU   7   4.461  -8.558  -2.870
   53   1HB   GLU   7          1HB       GLU   7   3.729  -8.040  -0.087
   54   2HB   GLU   7          2HB       GLU   7   2.314  -8.115  -1.137
   55   1HG   GLU   7          1HG       GLU   7   2.524 -10.348  -1.385
   56   2HG   GLU   7          2HG       GLU   7   4.238 -10.207  -1.778
   57    HA   PRO   8           HA       PRO   8   2.378  -5.329  -5.008
   58   1HB   PRO   8          1HB       PRO   8   0.178  -6.668  -5.967
   59   2HB   PRO   8          2HB       PRO   8   1.810  -6.864  -6.641
   60   1HG   PRO   8          1HG       PRO   8   0.328  -8.585  -4.695
   61   2HG   PRO   8          2HG       PRO   8   1.325  -9.058  -6.081
   62   1HD   PRO   8          1HD       PRO   8   2.224  -9.138  -3.521
   63   2HD   PRO   8          2HD       PRO   8   3.294  -8.797  -4.901
   64    HA   PRO   9           HA       PRO   9  -0.683  -3.654  -2.358
   65   1HB   PRO   9          1HB       PRO   9  -2.320  -2.312  -4.113
   66   2HB   PRO   9          2HB       PRO   9  -0.708  -1.737  -3.639
   67   1HG   PRO   9          1HG       PRO   9  -1.566  -3.206  -6.095
   68   2HG   PRO   9          2HG       PRO   9  -0.434  -1.852  -5.929
   69   1HD   PRO   9          1HD       PRO   9   0.367  -4.436  -6.226
   70   2HD   PRO   9          2HD       PRO   9   1.307  -3.233  -5.314
   71    H    TYR  10           H        TYR  10  -3.320  -3.422  -2.354
   72    HA   TYR  10           HA       TYR  10  -4.547  -5.882  -3.525
   73   1HB   TYR  10          1HB       TYR  10  -3.480  -6.307  -1.258
   74   2HB   TYR  10          2HB       TYR  10  -4.636  -5.161  -0.581
   75    HD1  TYR  10           1HD      TYR  10  -6.644  -5.996   0.242
   76    HD2  TYR  10           2HD      TYR  10  -4.582  -8.156  -2.845
   77    HE1  TYR  10           1HE      TYR  10  -8.358  -7.785   0.349
   78    HE2  TYR  10           2HE      TYR  10  -6.296  -9.946  -2.739
   79    HH   TYR  10           HH       TYR  10  -8.200 -10.528  -0.372
   80    H    THR  11           H        THR  11  -5.914  -4.505  -4.766
   81    HA   THR  11           HA       THR  11  -7.421  -2.306  -3.737
   82    HB   THR  11           HB       THR  11  -7.623  -4.246  -6.035
   83    HG1  THR  11           1HG      THR  11  -6.364  -2.112  -5.727
   84   1HG2  THR  11          1HG2      THR  11  -9.787  -2.465  -4.994
   85   2HG2  THR  11          2HG2      THR  11  -9.912  -4.019  -5.819
   86   3HG2  THR  11          3HG2      THR  11  -9.560  -2.556  -6.740
   87    H    GLY  12           H        GLY  12  -7.690  -5.747  -3.413
   88   1HA   GLY  12          1HA       GLY  12  -9.186  -7.077  -2.182
   89   2HA   GLY  12          2HA       GLY  12  -9.631  -5.603  -1.318
   90    HA   PRO  13           HA       PRO  13 -13.023  -6.994  -4.251
   91   1HB   PRO  13          1HB       PRO  13 -14.773  -8.023  -2.410
   92   2HB   PRO  13          2HB       PRO  13 -13.538  -9.000  -3.226
   93   1HG   PRO  13          1HG       PRO  13 -13.560  -7.854  -0.480
   94   2HG   PRO  13          2HG       PRO  13 -12.908  -9.396  -1.055
   95   1HD   PRO  13          1HD       PRO  13 -11.408  -7.138  -0.514
   96   2HD   PRO  13          2HD       PRO  13 -10.894  -8.468  -1.577
   97    H    CYS  14           H        CYS  14 -14.826  -6.555  -1.300
   98    HA   CYS  14           HA       CYS  14 -16.388  -4.836  -0.784
   99   1HB   CYS  14          1HB       CYS  14 -13.583  -3.870  -0.876
  100   2HB   CYS  14          2HB       CYS  14 -14.818  -2.616  -0.768
  101    H    LYS  15           H        LYS  15 -16.411  -2.123  -1.593
  102    HA   LYS  15           HA       LYS  15 -16.608  -2.217  -4.571
  103   1HB   LYS  15          1HB       LYS  15 -18.890  -0.889  -3.956
  104   2HB   LYS  15          2HB       LYS  15 -18.841  -2.634  -4.190
  105   1HG   LYS  15          1HG       LYS  15 -18.492  -2.915  -1.732
  106   2HG   LYS  15          2HG       LYS  15 -18.661  -1.170  -1.537
  107   1HD   LYS  15          1HD       LYS  15 -20.835  -2.401  -3.093
  108   2HD   LYS  15          2HD       LYS  15 -20.737  -2.983  -1.431
  109   1HE   LYS  15          1HE       LYS  15 -20.399  -0.300  -1.037
  110   2HE   LYS  15          2HE       LYS  15 -21.473  -0.296  -2.449
  111   1HZ   LYS  15          1HZ       LYS  15 -22.371  -0.607   0.025
  112   2HZ   LYS  15          2HZ       LYS  15 -22.037  -2.233  -0.331
  113   3HZ   LYS  15          3HZ       LYS  15 -23.114  -1.351  -1.305
  114    H    ALA  16           H        ALA  16 -14.592  -0.863  -3.206
  115    HA   ALA  16           HA       ALA  16 -15.400   1.985  -3.646
  116   1HB   ALA  16          1HB       ALA  16 -13.610   1.019  -1.404
  117   2HB   ALA  16          2HB       ALA  16 -15.354   1.199  -1.208
  118   3HB   ALA  16          3HB       ALA  16 -14.359   2.607  -1.579
  119    H    ARG  17           H        ARG  17 -13.200   3.339  -3.547
  120    HA   ARG  17           HA       ARG  17 -10.884   1.868  -4.656
  121   1HB   ARG  17          1HB       ARG  17 -10.973   3.497  -6.658
  122   2HB   ARG  17          2HB       ARG  17 -12.158   2.192  -6.649
  123   1HG   ARG  17          1HG       ARG  17 -13.896   3.646  -5.910
  124   2HG   ARG  17          2HG       ARG  17 -12.751   4.914  -5.475
  125   1HD   ARG  17          1HD       ARG  17 -13.814   5.511  -7.599
  126   2HD   ARG  17          2HD       ARG  17 -12.125   5.075  -7.925
  127    HE   ARG  17           HE       ARG  17 -13.166   2.692  -8.325
  128   1HH1  ARG  17          1HH1      ARG  17 -15.959   3.961  -8.023
  129   2HH1  ARG  17          2HH1      ARG  17 -16.413   4.130  -9.685
  130   1HH2  ARG  17          1HH2      ARG  17 -13.194   3.663 -10.888
  131   2HH2  ARG  17          2HH2      ARG  17 -14.849   3.961 -11.307
  132    H    ILE  18           H        ILE  18 -10.375   2.889  -2.410
  133    HA   ILE  18           HA       ILE  18  -9.987   5.788  -2.325
  134    HB   ILE  18           HB       ILE  18  -9.098   3.493  -0.548
  135   1HG1  ILE  18          1HG1      ILE  18 -11.366   5.445  -0.110
  136   2HG1  ILE  18          2HG1      ILE  18 -11.602   3.921  -0.965
  137   1HG2  ILE  18          1HG2      ILE  18  -9.286   5.682   1.062
  138   2HG2  ILE  18          2HG2      ILE  18  -8.712   6.428  -0.429
  139   3HG2  ILE  18          3HG2      ILE  18  -7.777   5.139   0.326
  140   1HD1  ILE  18          1HD1      ILE  18 -12.083   3.261   1.209
  141   2HD1  ILE  18          2HD1      ILE  18 -10.943   4.404   1.918
  142   3HD1  ILE  18          3HD1      ILE  18 -10.352   2.928   1.155
  143    H    ILE  19           H        ILE  19  -7.858   6.796  -2.087
  144    HA   ILE  19           HA       ILE  19  -5.818   5.533  -3.826
  145    HB   ILE  19           HB       ILE  19  -6.009   8.254  -2.490
  146   1HG1  ILE  19          1HG1      ILE  19  -7.858   7.916  -4.038
  147   2HG1  ILE  19          2HG1      ILE  19  -6.681   8.991  -4.793
  148   1HG2  ILE  19          1HG2      ILE  19  -3.712   7.377  -3.250
  149   2HG2  ILE  19          2HG2      ILE  19  -4.221   8.936  -3.899
  150   3HG2  ILE  19          3HG2      ILE  19  -4.345   7.484  -4.892
  151   1HD1  ILE  19          1HD1      ILE  19  -7.337   6.141  -5.435
  152   2HD1  ILE  19          2HD1      ILE  19  -5.689   6.704  -5.707
  153   3HD1  ILE  19          3HD1      ILE  19  -7.036   7.493  -6.526
  154    H    ARG  20           H        ARG  20  -5.285   3.857  -2.113
  155    HA   ARG  20           HA       ARG  20  -3.978   4.829   0.340
  156   1HB   ARG  20          1HB       ARG  20  -4.671   2.200  -0.935
  157   2HB   ARG  20          2HB       ARG  20  -3.512   2.229   0.393
  158   1HG   ARG  20          1HG       ARG  20  -6.272   3.482   0.521
  159   2HG   ARG  20          2HG       ARG  20  -5.894   1.872   1.131
  160   1HD   ARG  20          1HD       ARG  20  -4.649   2.704   2.918
  161   2HD   ARG  20          2HD       ARG  20  -4.201   4.183   2.049
  162    HE   ARG  20           HE       ARG  20  -6.314   5.120   2.668
  163   1HH1  ARG  20          1HH1      ARG  20  -5.642   2.702   4.745
  164   2HH1  ARG  20          2HH1      ARG  20  -7.276   2.237   5.087
  165   1HH2  ARG  20          1HH2      ARG  20  -8.631   4.123   2.512
  166   2HH2  ARG  20          2HH2      ARG  20  -8.968   3.043   3.823
  167    H    TYR  21           H        TYR  21  -1.722   3.795   0.802
  168    HA   TYR  21           HA       TYR  21   0.005   4.230  -1.608
  169   1HB   TYR  21          1HB       TYR  21   0.107   4.920   1.285
  170   2HB   TYR  21          2HB       TYR  21   1.644   4.520   0.521
  171    HD1  TYR  21           1HD      TYR  21   2.435   5.824  -1.456
  172    HD2  TYR  21           2HD      TYR  21  -1.056   6.948   0.777
  173    HE1  TYR  21           1HE      TYR  21   2.524   8.090  -2.462
  174    HE2  TYR  21           2HE      TYR  21  -0.971   9.213  -0.229
  175    HH   TYR  21           HH       TYR  21   0.700   9.973  -2.912
  176    H    PHE  22           H        PHE  22   1.622   2.720  -2.064
  177    HA   PHE  22           HA       PHE  22   2.013   0.424  -0.212
  178   1HB   PHE  22          1HB       PHE  22   1.322  -1.171  -1.787
  179   2HB   PHE  22          2HB       PHE  22   0.171   0.125  -2.053
  180    HD1  PHE  22           1HD      PHE  22   3.086  -1.649  -3.399
  181    HD2  PHE  22           2HD      PHE  22   0.311   1.569  -4.036
  182    HE1  PHE  22           1HE      PHE  22   3.817  -1.489  -5.764
  183    HE2  PHE  22           2HE      PHE  22   1.041   1.732  -6.402
  184    HZ   PHE  22           HZ       PHE  22   2.797   0.203  -7.266
  185    H    TYR  23           H        TYR  23   3.985  -0.843  -0.888
  186    HA   TYR  23           HA       TYR  23   6.032   1.032  -1.989
  187   1HB   TYR  23          1HB       TYR  23   6.330  -0.116   0.207
  188   2HB   TYR  23          2HB       TYR  23   6.294  -1.672  -0.627
  189    HD1  TYR  23           1HD      TYR  23   8.225  -2.512  -1.744
  190    HD2  TYR  23           2HD      TYR  23   8.126   1.566  -0.398
  191    HE1  TYR  23           1HE      TYR  23  10.638  -2.281  -2.269
  192    HE2  TYR  23           2HE      TYR  23  10.538   1.798  -0.927
  193    HH   TYR  23           HH       TYR  23  12.309   0.836  -1.893
  194    H    ASN  24           H        ASN  24   6.573   0.832  -4.123
  195    HA   ASN  24           HA       ASN  24   5.943  -1.656  -5.604
  196   1HB   ASN  24          1HB       ASN  24   5.418   0.582  -6.510
  197   2HB   ASN  24          2HB       ASN  24   7.120   1.027  -6.414
  198   1HD2  ASN  24          1HD2      ASN  24   5.596   0.947  -8.905
  199   2HD2  ASN  24          2HD2      ASN  24   6.287  -0.258  -9.881
  200    H    ALA  25           H        ALA  25   7.574  -3.115  -4.745
  201    HA   ALA  25           HA       ALA  25  10.279  -2.669  -4.294
  202   1HB   ALA  25          1HB       ALA  25   9.842  -4.858  -3.878
  203   2HB   ALA  25          2HB       ALA  25  10.190  -5.130  -5.586
  204   3HB   ALA  25          3HB       ALA  25   8.527  -4.893  -5.052
  205    H    LYS  26           H        LYS  26   8.600  -2.778  -7.375
  206    HA   LYS  26           HA       LYS  26  10.999  -3.004  -9.013
  207   1HB   LYS  26          1HB       LYS  26   8.420  -3.477  -9.444
  208   2HB   LYS  26          2HB       LYS  26   8.420  -1.787  -9.947
  209   1HG   LYS  26          1HG       LYS  26  10.429  -3.793 -10.996
  210   2HG   LYS  26          2HG       LYS  26   8.877  -3.510 -11.785
  211   1HD   LYS  26          1HD       LYS  26   9.592  -0.983 -11.647
  212   2HD   LYS  26          2HD       LYS  26  11.217  -1.648 -11.476
  213   1HE   LYS  26          1HE       LYS  26  10.974  -1.397 -13.824
  214   2HE   LYS  26          2HE       LYS  26  10.559  -3.103 -13.565
  215   1HZ   LYS  26          1HZ       LYS  26   8.859  -0.861 -14.276
  216   2HZ   LYS  26          2HZ       LYS  26   8.229  -1.859 -13.054
  217   3HZ   LYS  26          3HZ       LYS  26   8.638  -2.518 -14.565
  218    H    ALA  27           H        ALA  27   9.235  -0.404  -7.472
  219    HA   ALA  27           HA       ALA  27  10.657   1.674  -9.054
  220   1HB   ALA  27          1HB       ALA  27   8.889   2.979  -8.419
  221   2HB   ALA  27          2HB       ALA  27   8.959   2.414  -6.750
  222   3HB   ALA  27          3HB       ALA  27   8.140   1.445  -7.975
  223    H    GLY  28           H        GLY  28  10.499   0.335  -5.773
  224   1HA   GLY  28          1HA       GLY  28  12.412   0.275  -4.300
  225   2HA   GLY  28          2HA       GLY  28  13.114   1.618  -5.204
  226    H    LEU  29           H        LEU  29  10.071   2.637  -4.926
  227    HA   LEU  29           HA       LEU  29  10.481   3.800  -2.193
  228   1HB   LEU  29          1HB       LEU  29   9.160   5.210  -4.518
  229   2HB   LEU  29          2HB       LEU  29   9.869   5.920  -3.068
  230    HG   LEU  29           HG       LEU  29  12.020   4.593  -4.135
  231   1HD1  LEU  29          1HD1      LEU  29  10.330   4.277  -6.159
  232   2HD1  LEU  29          2HD1      LEU  29  12.027   4.658  -6.457
  233   3HD1  LEU  29          3HD1      LEU  29  10.809   5.933  -6.526
  234   1HD2  LEU  29          1HD2      LEU  29  11.262   7.204  -3.563
  235   2HD2  LEU  29          2HD2      LEU  29  11.697   7.271  -5.270
  236   3HD2  LEU  29          3HD2      LEU  29  12.867   6.692  -4.085
  237    H    CYS  30           H        CYS  30   7.927   5.271  -2.621
  238    HA   CYS  30           HA       CYS  30   6.019   2.972  -2.354
  239   1HB   CYS  30          1HB       CYS  30   6.198   5.616  -0.876
  240   2HB   CYS  30          2HB       CYS  30   4.868   4.475  -0.693
  241    H    GLN  31           H        GLN  31   3.937   3.303  -3.257
  242    HA   GLN  31           HA       GLN  31   3.495   5.841  -4.769
  243   1HB   GLN  31          1HB       GLN  31   3.351   2.991  -5.800
  244   2HB   GLN  31          2HB       GLN  31   2.793   4.399  -6.705
  245   1HG   GLN  31          1HG       GLN  31   5.021   5.337  -6.737
  246   2HG   GLN  31          2HG       GLN  31   5.613   4.092  -5.636
  247   1HE2  GLN  31          1HE2      GLN  31   6.571   4.642  -8.405
  248   2HE2  GLN  31          2HE2      GLN  31   6.320   3.209  -9.281
  249    H    THR  32           H        THR  32   1.104   5.656  -5.736
  250    HA   THR  32           HA       THR  32  -0.617   4.763  -3.464
  251    HB   THR  32           HB       THR  32  -2.154   6.455  -4.309
  252    HG1  THR  32           1HG      THR  32  -0.516   6.201  -6.529
  253   1HG2  THR  32          1HG2      THR  32  -0.269   7.225  -2.917
  254   2HG2  THR  32          2HG2      THR  32  -0.727   8.448  -4.102
  255   3HG2  THR  32          3HG2      THR  32   0.705   7.454  -4.368
  256    H    PHE  33           H        PHE  33  -2.454   3.484  -3.862
  257    HA   PHE  33           HA       PHE  33  -2.909   2.516  -6.648
  258   1HB   PHE  33          1HB       PHE  33  -2.638   0.239  -5.999
  259   2HB   PHE  33          2HB       PHE  33  -1.276   1.080  -5.268
  260    HD1  PHE  33           1HD      PHE  33  -4.296  -0.832  -4.670
  261    HD2  PHE  33           2HD      PHE  33  -1.377   1.716  -2.814
  262    HE1  PHE  33           1HE      PHE  33  -5.019  -1.625  -2.435
  263    HE2  PHE  33           2HE      PHE  33  -2.107   0.934  -0.589
  264    HZ   PHE  33           HZ       PHE  33  -3.925  -0.742  -0.392
  265    H    VAL  34           H        VAL  34  -5.021   1.329  -6.792
  266    HA   VAL  34           HA       VAL  34  -7.105   2.728  -5.317
  267    HB   VAL  34           HB       VAL  34  -7.091   0.396  -7.258
  268   1HG1  VAL  34          1HG1      VAL  34  -9.159   1.133  -5.556
  269   2HG1  VAL  34          2HG1      VAL  34  -9.338   0.237  -7.064
  270   3HG1  VAL  34          3HG1      VAL  34  -9.536   1.989  -7.050
  271   1HG2  VAL  34          1HG2      VAL  34  -6.472   3.047  -7.679
  272   2HG2  VAL  34          2HG2      VAL  34  -8.198   3.011  -8.039
  273   3HG2  VAL  34          3HG2      VAL  34  -7.093   1.953  -8.915
  274    H    TYR  35           H        TYR  35  -7.446   2.174  -3.194
  275    HA   TYR  35           HA       TYR  35  -7.100  -0.636  -2.305
  276   1HB   TYR  35          1HB       TYR  35  -6.084   1.033  -0.950
  277   2HB   TYR  35          2HB       TYR  35  -7.516   2.059  -0.997
  278    HD1  TYR  35           1HD      TYR  35  -7.354  -1.625  -0.435
  279    HD2  TYR  35           2HD      TYR  35  -8.097   2.241   1.290
  280    HE1  TYR  35           1HE      TYR  35  -8.203  -2.706   1.628
  281    HE2  TYR  35           2HE      TYR  35  -8.947   1.157   3.353
  282    HH   TYR  35           HH       TYR  35  -9.041  -0.811   4.488
  283    H    GLY  36           H        GLY  36  -8.843  -1.891  -1.512
  284   1HA   GLY  36          1HA       GLY  36 -11.498  -1.199  -2.484
  285   2HA   GLY  36          2HA       GLY  36 -11.072  -2.661  -1.598
  286    H    ALA  37           H        ALA  37  -9.948  -0.022   0.122
  287    HA   ALA  37           HA       ALA  37 -10.794   1.198   1.972
  288   1HB   ALA  37          1HB       ALA  37 -12.747   1.332   0.226
  289   2HB   ALA  37          2HB       ALA  37 -13.070   1.752   1.908
  290   3HB   ALA  37          3HB       ALA  37 -13.536   0.167   1.289
  291    H    CYS  38           H        CYS  38 -10.943  -2.135   1.588
  292    HA   CYS  38           HA       CYS  38 -11.282  -2.504   4.513
  293   1HB   CYS  38          1HB       CYS  38 -13.046  -4.141   4.210
  294   2HB   CYS  38          2HB       CYS  38 -13.525  -2.666   3.371
  295    H    ARG  39           H        ARG  39 -10.869  -4.961   5.008
  296    HA   ARG  39           HA       ARG  39  -9.169  -6.625   4.983
  297   1HB   ARG  39          1HB       ARG  39 -10.344  -6.416   2.210
  298   2HB   ARG  39          2HB       ARG  39  -9.136  -7.645   2.585
  299   1HG   ARG  39          1HG       ARG  39 -10.848  -7.917   4.705
  300   2HG   ARG  39          2HG       ARG  39 -11.965  -7.460   3.419
  301   1HD   ARG  39          1HD       ARG  39 -11.751  -9.491   2.411
  302   2HD   ARG  39          2HD       ARG  39  -9.980  -9.437   2.537
  303    HE   ARG  39           HE       ARG  39 -11.808 -10.267   4.769
  304   1HH1  ARG  39          1HH1      ARG  39  -8.874  -9.291   5.182
  305   2HH1  ARG  39          2HH1      ARG  39  -8.076 -10.818   5.356
  306   1HH2  ARG  39          1HH2      ARG  39 -10.737 -12.652   4.104
  307   2HH2  ARG  39          2HH2      ARG  39  -9.129 -12.720   4.742
  308    H    ALA  40           H        ALA  40  -7.900  -4.196   5.044
  309    HA   ALA  40           HA       ALA  40  -6.051  -3.970   2.745
  310   1HB   ALA  40          1HB       ALA  40  -5.265  -2.003   4.107
  311   2HB   ALA  40          2HB       ALA  40  -6.434  -2.460   5.344
  312   3HB   ALA  40          3HB       ALA  40  -6.988  -1.971   3.746
  313    H    LYS  41           H        LYS  41  -3.884  -4.540   2.817
  314    HA   LYS  41           HA       LYS  41  -2.972  -6.095   5.191
  315   1HB   LYS  41          1HB       LYS  41  -1.812  -5.734   2.404
  316   2HB   LYS  41          2HB       LYS  41  -1.254  -6.895   3.610
  317   1HG   LYS  41          1HG       LYS  41  -2.873  -8.356   3.040
  318   2HG   LYS  41          2HG       LYS  41  -4.120  -7.119   3.214
  319   1HD   LYS  41          1HD       LYS  41  -4.336  -7.403   0.956
  320   2HD   LYS  41          2HD       LYS  41  -2.947  -6.318   0.893
  321   1HE   LYS  41          1HE       LYS  41  -1.948  -8.018  -0.275
  322   2HE   LYS  41          2HE       LYS  41  -1.763  -8.790   1.313
  323   1HZ   LYS  41          1HZ       LYS  41  -4.352  -8.976  -0.064
  324   2HZ   LYS  41          2HZ       LYS  41  -3.611 -10.083   0.991
  325   3HZ   LYS  41          3HZ       LYS  41  -3.089  -9.960  -0.622
  326    H    ARG  42           H        ARG  42  -0.215  -5.707   4.969
  327    HA   ARG  42           HA       ARG  42   0.125  -3.132   6.244
  328   1HB   ARG  42          1HB       ARG  42   2.050  -5.199   5.138
  329   2HB   ARG  42          2HB       ARG  42   2.547  -3.810   6.107
  330   1HG   ARG  42          1HG       ARG  42   1.936  -4.846   8.017
  331   2HG   ARG  42          2HG       ARG  42   0.339  -5.217   7.365
  332   1HD   ARG  42          1HD       ARG  42   0.966  -7.388   7.146
  333   2HD   ARG  42          2HD       ARG  42   2.261  -6.887   6.043
  334    HE   ARG  42           HE       ARG  42   3.766  -7.054   7.853
  335   1HH1  ARG  42          1HH1      ARG  42   1.639  -8.928   9.053
  336   2HH1  ARG  42          2HH1      ARG  42   1.521  -8.290  10.658
  337   1HH2  ARG  42          1HH2      ARG  42   3.141  -5.325   9.884
  338   2HH2  ARG  42          2HH2      ARG  42   2.371  -6.251  11.129
  339    H    ASN  43           H        ASN  43   0.765  -4.366   2.966
  340    HA   ASN  43           HA       ASN  43   2.108  -1.931   2.081
  341   1HB   ASN  43          1HB       ASN  43   1.985  -4.498   1.234
  342   2HB   ASN  43          2HB       ASN  43   0.786  -3.780   0.158
  343   1HD2  ASN  43          1HD2      ASN  43   3.242  -4.744  -0.901
  344   2HD2  ASN  43          2HD2      ASN  43   4.176  -3.427  -1.420
  345    H    ASN  44           H        ASN  44  -0.110  -0.980   3.261
  346    HA   ASN  44           HA       ASN  44  -1.641   0.217   1.039
  347   1HB   ASN  44          1HB       ASN  44  -2.854  -1.867   1.514
  348   2HB   ASN  44          2HB       ASN  44  -2.847  -1.513   3.240
  349   1HD2  ASN  44          1HD2      ASN  44  -5.339  -1.926   2.174
  350   2HD2  ASN  44          2HD2      ASN  44  -6.192  -0.453   2.003
  351    H    PHE  45           H        PHE  45  -0.095   1.821   2.219
  352    HA   PHE  45           HA       PHE  45  -1.042   2.765   4.853
  353   1HB   PHE  45          1HB       PHE  45   1.086   3.945   3.048
  354   2HB   PHE  45          2HB       PHE  45   0.980   4.047   4.806
  355    HD1  PHE  45           1HD      PHE  45   1.851   1.899   1.941
  356    HD2  PHE  45           2HD      PHE  45   1.592   2.130   6.224
  357    HE1  PHE  45           1HE      PHE  45   3.203  -0.172   2.133
  358    HE2  PHE  45           2HE      PHE  45   2.945   0.057   6.416
  359    HZ   PHE  45           HZ       PHE  45   3.746  -1.105   4.369
  360    H    LYS  46           H        LYS  46  -1.464   5.169   5.097
  361    HA   LYS  46           HA       LYS  46  -3.291   6.069   2.942
  362   1HB   LYS  46          1HB       LYS  46  -2.659   7.223   5.677
  363   2HB   LYS  46          2HB       LYS  46  -4.049   7.627   4.667
  364   1HG   LYS  46          1HG       LYS  46  -4.752   5.221   4.784
  365   2HG   LYS  46          2HG       LYS  46  -3.432   4.934   5.919
  366   1HD   LYS  46          1HD       LYS  46  -4.671   7.142   7.008
  367   2HD   LYS  46          2HD       LYS  46  -6.036   6.235   6.355
  368   1HE   LYS  46          1HE       LYS  46  -4.360   4.316   7.588
  369   2HE   LYS  46          2HE       LYS  46  -4.468   5.677   8.721
  370   1HZ   LYS  46          1HZ       LYS  46  -6.962   5.605   7.897
  371   2HZ   LYS  46          2HZ       LYS  46  -6.432   4.629   9.183
  372   3HZ   LYS  46          3HZ       LYS  46  -6.591   3.973   7.624
  373    H    SER  47           H        SER  47  -0.062   6.547   3.869
  374    HA   SER  47           HA       SER  47   0.128   8.921   2.083
  375   1HB   SER  47          1HB       SER  47   1.321  10.180   3.807
  376   2HB   SER  47          2HB       SER  47  -0.250   9.686   4.426
  377    HG   SER  47           HG       SER  47   2.182   9.068   5.357
  378    H    ALA  48           H        ALA  48   2.297   9.262   1.302
  379    HA   ALA  48           HA       ALA  48   3.845   6.885   0.857
  380   1HB   ALA  48          1HB       ALA  48   5.266   8.375  -0.349
  381   2HB   ALA  48          2HB       ALA  48   4.826   9.741   0.677
  382   3HB   ALA  48          3HB       ALA  48   3.658   9.091  -0.474
  383    H    GLU  49           H        GLU  49   3.910   9.361   3.334
  384    HA   GLU  49           HA       GLU  49   6.571   8.796   4.342
  385   1HB   GLU  49          1HB       GLU  49   4.085  10.210   5.304
  386   2HB   GLU  49          2HB       GLU  49   5.478  10.026   6.371
  387   1HG   GLU  49          1HG       GLU  49   6.789  11.450   5.120
  388   2HG   GLU  49          2HG       GLU  49   5.998  11.013   3.604
  389    H    ASP  50           H        ASP  50   3.325   7.552   4.982
  390    HA   ASP  50           HA       ASP  50   4.014   6.058   7.367
  391   1HB   ASP  50          1HB       ASP  50   1.721   6.764   6.704
  392   2HB   ASP  50          2HB       ASP  50   1.810   5.696   5.302
  393    H    CYS  51           H        CYS  51   3.951   5.384   3.896
  394    HA   CYS  51           HA       CYS  51   4.532   2.547   4.098
  395   1HB   CYS  51          1HB       CYS  51   3.517   3.478   2.113
  396   2HB   CYS  51          2HB       CYS  51   4.805   4.670   1.943
  397    H    MET  52           H        MET  52   6.484   5.484   3.517
  398    HA   MET  52           HA       MET  52   9.030   4.196   3.240
  399   1HB   MET  52          1HB       MET  52   8.077   6.673   2.884
  400   2HB   MET  52          2HB       MET  52   8.751   6.896   4.499
  401   1HG   MET  52          1HG       MET  52  10.902   6.727   3.755
  402   2HG   MET  52          2HG       MET  52  10.502   5.462   2.594
  403   1HE   MET  52          1HE       MET  52  11.580   6.641  -0.011
  404   2HE   MET  52          2HE       MET  52   9.899   6.719  -0.531
  405   3HE   MET  52          3HE       MET  52  10.398   5.492   0.631
  406    H    ARG  53           H        ARG  53   7.742   5.984   6.082
  407    HA   ARG  53           HA       ARG  53   9.672   5.410   7.979
  408   1HB   ARG  53          1HB       ARG  53   7.084   6.386   7.915
  409   2HB   ARG  53          2HB       ARG  53   6.924   4.952   8.931
  410   1HG   ARG  53          1HG       ARG  53   9.222   6.034   9.928
  411   2HG   ARG  53          2HG       ARG  53   8.351   7.493   9.451
  412   1HD   ARG  53          1HD       ARG  53   6.766   5.420  10.897
  413   2HD   ARG  53          2HD       ARG  53   7.962   6.321  11.849
  414    HE   ARG  53           HE       ARG  53   5.709   7.543  10.305
  415   1HH1  ARG  53          1HH2      ARG  53   8.696   8.260  11.697
  416   2HH1  ARG  53          2HH2      ARG  53   8.125   9.591  12.645
  417   1HH2  ARG  53          1HH1      ARG  53   4.784   9.032  11.901
  418   2HH2  ARG  53          2HH1      ARG  53   5.909  10.027  12.762
  419    H    THR  54           H        THR  54   7.399   3.182   6.518
  420    HA   THR  54           HA       THR  54   8.134   1.008   8.413
  421    HB   THR  54           HB       THR  54   6.022   1.536   6.332
  422    HG1  THR  54           1HG      THR  54   4.998   0.429   8.386
  423   1HG2  THR  54          1HG2      THR  54   6.775  -1.172   7.464
  424   2HG2  THR  54          2HG2      THR  54   6.788  -0.695   5.766
  425   3HG2  THR  54          3HG2      THR  54   5.258  -0.830   6.632
  426    H    CYS  55           H        CYS  55   8.378   1.927   4.986
  427    HA   CYS  55           HA       CYS  55  10.443  -0.214   4.636
  428   1HB   CYS  55          1HB       CYS  55   7.961  -0.558   3.762
  429   2HB   CYS  55          2HB       CYS  55   8.514   0.476   2.444
  430    H    GLY  56           H        GLY  56  11.105   2.463   5.132
  431   1HA   GLY  56          1HA       GLY  56  11.566   3.741   2.502
  432   2HA   GLY  56          2HA       GLY  56  11.908   4.463   4.076
  433    H    GLY  57           H        GLY  57  13.516   3.671   1.462
  434   1HA   GLY  57          1HA       GLY  57  16.081   3.659   2.391
  435   2HA   GLY  57          2HA       GLY  57  15.622   1.969   2.598
  436    H    ALA  58           H        ALA  58  16.860   1.052   0.963
  437    HA   ALA  58           HA       ALA  58  17.369   0.400  -1.252
  438   1HB   ALA  58          1HB       ALA  58  15.312   0.101  -2.140
  439   2HB   ALA  58          2HB       ALA  58  15.383   1.763  -2.722
  440   3HB   ALA  58          3HB       ALA  58  14.655   1.408  -1.156
  Start of MODEL   11
    1   1H    ARG   1          1H        ARG   1  14.355  -5.238   6.635
    2   2H    ARG   1          2H        ARG   1  14.925  -5.201   5.035
    3   3H    ARG   1          3H        ARG   1  14.190  -6.605   5.645
    4    HA   ARG   1           HA       ARG   1  12.577  -4.174   5.731
    5   1HB   ARG   1          1HB       ARG   1  13.956  -5.216   3.366
    6   2HB   ARG   1          2HB       ARG   1  12.206  -5.172   3.157
    7   1HG   ARG   1          1HG       ARG   1  12.295  -2.780   4.038
    8   2HG   ARG   1          2HG       ARG   1  14.049  -2.879   3.872
    9   1HD   ARG   1          1HD       ARG   1  11.959  -3.076   1.678
   10   2HD   ARG   1          2HD       ARG   1  13.301  -1.922   1.813
   11    HE   ARG   1           HE       ARG   1  13.498  -4.573   0.710
   12   1HH1  ARG   1          1HH2      ARG   1  15.194  -1.945   2.045
   13   2HH1  ARG   1          2HH2      ARG   1  16.723  -2.759   2.098
   14   1HH2  ARG   1          1HH1      ARG   1  15.428  -5.819   1.109
   15   2HH2  ARG   1          2HH1      ARG   1  16.856  -4.951   1.570
   16    HA   PRO   2           HA       PRO   2   9.738  -7.436   6.637
   17   1HB   PRO   2          1HB       PRO   2   7.418  -6.079   6.114
   18   2HB   PRO   2          2HB       PRO   2   8.370  -5.840   7.588
   19   1HG   PRO   2          1HG       PRO   2   8.277  -4.222   5.080
   20   2HG   PRO   2          2HG       PRO   2   8.347  -3.672   6.761
   21   1HD   PRO   2          1HD       PRO   2  10.509  -3.719   5.111
   22   2HD   PRO   2          2HD       PRO   2  10.633  -3.949   6.871
   23    H    ASP   3           H        ASP   3   8.246  -8.843   5.506
   24    HA   ASP   3           HA       ASP   3   8.714  -8.955   2.623
   25   1HB   ASP   3          1HB       ASP   3   7.605 -11.074   2.826
   26   2HB   ASP   3          2HB       ASP   3   8.551 -10.878   4.302
   27    H    PHE   4           H        PHE   4   6.147  -7.842   4.775
   28    HA   PHE   4           HA       PHE   4   4.047  -7.855   2.790
   29   1HB   PHE   4          1HB       PHE   4   2.810  -6.636   4.419
   30   2HB   PHE   4          2HB       PHE   4   3.871  -7.703   5.334
   31    HD1  PHE   4           1HD      PHE   4   3.670  -4.194   3.983
   32    HD2  PHE   4           2HD      PHE   4   5.317  -6.840   6.952
   33    HE1  PHE   4           1HE      PHE   4   4.619  -2.263   5.192
   34    HE2  PHE   4           2HE      PHE   4   6.269  -4.889   8.150
   35    HZ   PHE   4           HZ       PHE   4   5.910  -2.600   7.264
   36    H    CYS   5           H        CYS   5   6.767  -5.785   3.294
   37    HA   CYS   5           HA       CYS   5   5.625  -3.470   1.900
   38   1HB   CYS   5          1HB       CYS   5   8.233  -4.326   3.098
   39   2HB   CYS   5          2HB       CYS   5   8.263  -3.013   1.922
   40    H    LEU   6           H        LEU   6   7.423  -6.370   1.110
   41    HA   LEU   6           HA       LEU   6   8.186  -5.460  -1.580
   42   1HB   LEU   6          1HB       LEU   6   8.165  -8.262  -0.428
   43   2HB   LEU   6          2HB       LEU   6   9.202  -7.633  -1.709
   44    HG   LEU   6           HG       LEU   6   9.237  -6.802   1.210
   45   1HD1  LEU   6          1HD1      LEU   6  10.602  -8.605   1.348
   46   2HD1  LEU   6          2HD1      LEU   6  11.764  -7.629   0.449
   47   3HD1  LEU   6          3HD1      LEU   6  10.711  -8.758  -0.404
   48   1HD2  LEU   6          1HD2      LEU   6  10.230  -5.525  -1.244
   49   2HD2  LEU   6          2HD2      LEU   6  11.481  -5.759  -0.021
   50   3HD2  LEU   6          3HD2      LEU   6  10.024  -4.845   0.370
   51    H    GLU   7           H        GLU   7   5.449  -6.939  -0.077
   52    HA   GLU   7           HA       GLU   7   4.422  -8.338  -2.411
   53   1HB   GLU   7          1HB       GLU   7   3.682  -7.713   0.369
   54   2HB   GLU   7          2HB       GLU   7   2.298  -7.801  -0.721
   55   1HG   GLU   7          1HG       GLU   7   2.425 -10.048  -0.672
   56   2HG   GLU   7          2HG       GLU   7   4.042  -9.962  -1.370
   57    HA   PRO   8           HA       PRO   8   2.530  -4.970  -4.498
   58   1HB   PRO   8          1HB       PRO   8   0.292  -6.177  -5.520
   59   2HB   PRO   8          2HB       PRO   8   1.925  -6.462  -6.153
   60   1HG   PRO   8          1HG       PRO   8   0.263  -8.130  -4.329
   61   2HG   PRO   8          2HG       PRO   8   1.359  -8.627  -5.625
   62   1HD   PRO   8          1HD       PRO   8   1.978  -8.705  -2.947
   63   2HD   PRO   8          2HD       PRO   8   3.184  -8.585  -4.247
   64    HA   PRO   9           HA       PRO   9  -0.643  -3.170  -2.057
   65   1HB   PRO   9          1HB       PRO   9  -2.249  -1.943  -3.907
   66   2HB   PRO   9          2HB       PRO   9  -0.643  -1.340  -3.460
   67   1HG   PRO   9          1HG       PRO   9  -1.507  -2.916  -5.840
   68   2HG   PRO   9          2HG       PRO   9  -0.326  -1.601  -5.724
   69   1HD   PRO   9          1HD       PRO   9   0.336  -4.259  -5.870
   70   2HD   PRO   9          2HD       PRO   9   1.363  -3.021  -5.112
   71    H    TYR  10           H        TYR  10  -3.066  -3.208  -1.622
   72    HA   TYR  10           HA       TYR  10  -4.332  -5.662  -2.820
   73   1HB   TYR  10          1HB       TYR  10  -3.403  -5.521  -0.336
   74   2HB   TYR  10          2HB       TYR  10  -4.932  -4.686  -0.050
   75    HD1  TYR  10           1HD      TYR  10  -6.816  -5.969   0.433
   76    HD2  TYR  10           2HD      TYR  10  -3.602  -7.726  -1.809
   77    HE1  TYR  10           1HE      TYR  10  -8.015  -8.141   0.418
   78    HE2  TYR  10           2HE      TYR  10  -4.798  -9.898  -1.823
   79    HH   TYR  10           HH       TYR  10  -6.687 -10.968  -0.123
   80    H    THR  11           H        THR  11  -5.597  -4.503  -4.319
   81    HA   THR  11           HA       THR  11  -7.207  -2.209  -3.687
   82    HB   THR  11           HB       THR  11  -7.117  -4.359  -5.796
   83    HG1  THR  11           1HG      THR  11  -5.847  -2.801  -6.420
   84   1HG2  THR  11          1HG2      THR  11  -8.968  -2.672  -6.832
   85   2HG2  THR  11          2HG2      THR  11  -9.426  -2.621  -5.130
   86   3HG2  THR  11          3HG2      THR  11  -9.388  -4.162  -5.986
   87    H    GLY  12           H        GLY  12  -7.477  -5.608  -3.070
   88   1HA   GLY  12          1HA       GLY  12  -9.144  -6.881  -2.005
   89   2HA   GLY  12          2HA       GLY  12  -9.612  -5.371  -1.218
   90    HA   PRO  13           HA       PRO  13 -12.746  -6.766  -4.464
   91   1HB   PRO  13          1HB       PRO  13 -14.673  -7.776  -2.798
   92   2HB   PRO  13          2HB       PRO  13 -13.381  -8.770  -3.498
   93   1HG   PRO  13          1HG       PRO  13 -13.615  -7.589  -0.769
   94   2HG   PRO  13          2HG       PRO  13 -12.994  -9.172  -1.262
   95   1HD   PRO  13          1HD       PRO  13 -11.411  -7.025  -0.614
   96   2HD   PRO  13          2HD       PRO  13 -10.905  -8.340  -1.700
   97    H    CYS  14           H        CYS  14 -14.812  -6.317  -1.697
   98    HA   CYS  14           HA       CYS  14 -16.390  -4.575  -1.323
   99   1HB   CYS  14          1HB       CYS  14 -13.569  -3.583  -1.185
  100   2HB   CYS  14          2HB       CYS  14 -14.866  -2.403  -1.001
  101    H    LYS  15           H        LYS  15 -16.258  -1.850  -2.070
  102    HA   LYS  15           HA       LYS  15 -16.039  -1.798  -5.031
  103   1HB   LYS  15          1HB       LYS  15 -18.453  -2.226  -3.539
  104   2HB   LYS  15          2HB       LYS  15 -18.550  -0.646  -4.317
  105   1HG   LYS  15          1HG       LYS  15 -17.444  -2.780  -6.028
  106   2HG   LYS  15          2HG       LYS  15 -19.127  -3.026  -5.556
  107   1HD   LYS  15          1HD       LYS  15 -18.234  -0.328  -6.535
  108   2HD   LYS  15          2HD       LYS  15 -18.580  -1.608  -7.698
  109   1HE   LYS  15          1HE       LYS  15 -20.751  -1.781  -6.005
  110   2HE   LYS  15          2HE       LYS  15 -20.441  -0.034  -6.042
  111   1HZ   LYS  15          1HZ       LYS  15 -20.455  -0.058  -8.405
  112   2HZ   LYS  15          2HZ       LYS  15 -21.841  -0.911  -7.918
  113   3HZ   LYS  15          3HZ       LYS  15 -20.471  -1.753  -8.466
  114    H    ALA  16           H        ALA  16 -14.495  -0.426  -3.046
  115    HA   ALA  16           HA       ALA  16 -15.506   2.388  -3.297
  116   1HB   ALA  16          1HB       ALA  16 -14.291   2.806  -1.244
  117   2HB   ALA  16          2HB       ALA  16 -13.504   1.229  -1.335
  118   3HB   ALA  16          3HB       ALA  16 -15.235   1.334  -1.009
  119    H    ARG  17           H        ARG  17 -13.972   3.992  -3.966
  120    HA   ARG  17           HA       ARG  17 -11.471   2.884  -5.207
  121   1HB   ARG  17          1HB       ARG  17 -13.639   4.708  -6.114
  122   2HB   ARG  17          2HB       ARG  17 -12.002   5.135  -6.618
  123   1HG   ARG  17          1HG       ARG  17 -11.986   3.474  -8.143
  124   2HG   ARG  17          2HG       ARG  17 -12.442   2.288  -6.919
  125   1HD   ARG  17          1HD       ARG  17 -14.585   2.250  -7.679
  126   2HD   ARG  17          2HD       ARG  17 -14.688   4.022  -7.626
  127    HE   ARG  17           HE       ARG  17 -13.374   2.527  -9.876
  128   1HH1  ARG  17          1HH1      ARG  17 -15.997   4.424  -8.910
  129   2HH1  ARG  17          2HH1      ARG  17 -15.945   5.487 -10.277
  130   1HH2  ARG  17          1HH2      ARG  17 -12.974   4.192 -11.507
  131   2HH2  ARG  17          2HH2      ARG  17 -14.235   5.355 -11.748
  132    H    ILE  18           H        ILE  18 -10.361   3.410  -3.140
  133    HA   ILE  18           HA       ILE  18 -10.062   6.341  -2.614
  134    HB   ILE  18           HB       ILE  18  -9.383   3.866  -0.989
  135   1HG1  ILE  18          1HG1      ILE  18 -11.377   5.695   0.087
  136   2HG1  ILE  18          2HG1      ILE  18 -11.858   5.077  -1.495
  137   1HG2  ILE  18          1HG2      ILE  18  -8.988   5.430   0.855
  138   2HG2  ILE  18          2HG2      ILE  18  -9.361   6.795  -0.199
  139   3HG2  ILE  18          3HG2      ILE  18  -7.922   5.817  -0.497
  140   1HD1  ILE  18          1HD1      ILE  18 -10.711   3.100   0.409
  141   2HD1  ILE  18          2HD1      ILE  18 -12.036   2.917  -0.740
  142   3HD1  ILE  18          3HD1      ILE  18 -12.312   3.729   0.802
  143    H    ILE  19           H        ILE  19  -7.841   7.132  -2.246
  144    HA   ILE  19           HA       ILE  19  -5.863   5.716  -3.969
  145    HB   ILE  19           HB       ILE  19  -5.912   8.511  -2.780
  146   1HG1  ILE  19          1HG1      ILE  19  -7.775   8.281  -4.291
  147   2HG1  ILE  19          2HG1      ILE  19  -6.503   9.126  -5.173
  148   1HG2  ILE  19          1HG2      ILE  19  -4.361   7.737  -5.217
  149   2HG2  ILE  19          2HG2      ILE  19  -3.714   7.275  -3.643
  150   3HG2  ILE  19          3HG2      ILE  19  -4.008   8.974  -4.011
  151   1HD1  ILE  19          1HD1      ILE  19  -5.780   6.906  -6.113
  152   2HD1  ILE  19          2HD1      ILE  19  -7.402   7.389  -6.611
  153   3HD1  ILE  19          3HD1      ILE  19  -7.191   6.177  -5.346
  154    H    ARG  20           H        ARG  20  -5.189   4.115  -2.376
  155    HA   ARG  20           HA       ARG  20  -4.055   5.092   0.178
  156   1HB   ARG  20          1HB       ARG  20  -4.720   2.463  -1.106
  157   2HB   ARG  20          2HB       ARG  20  -3.588   2.489   0.248
  158   1HG   ARG  20          1HG       ARG  20  -6.386   3.664   0.268
  159   2HG   ARG  20          2HG       ARG  20  -5.910   2.146   1.028
  160   1HD   ARG  20          1HD       ARG  20  -5.173   3.265   2.861
  161   2HD   ARG  20          2HD       ARG  20  -4.128   4.288   1.855
  162    HE   ARG  20           HE       ARG  20  -7.068   4.830   2.106
  163   1HH1  ARG  20          1HH1      ARG  20  -5.367   6.524   0.311
  164   2HH1  ARG  20          2HH1      ARG  20  -4.996   7.874   1.331
  165   1HH2  ARG  20          1HH2      ARG  20  -5.904   6.250   4.258
  166   2HH2  ARG  20          2HH2      ARG  20  -5.300   7.719   3.566
  167    H    TYR  21           H        TYR  21  -1.825   4.031   0.746
  168    HA   TYR  21           HA       TYR  21  -0.003   4.413  -1.603
  169   1HB   TYR  21          1HB       TYR  21   0.103   5.099   1.321
  170   2HB   TYR  21          2HB       TYR  21   1.606   4.905   0.421
  171    HD1  TYR  21           1HD      TYR  21  -1.325   6.980   0.982
  172    HD2  TYR  21           2HD      TYR  21   2.084   6.357  -1.551
  173    HE1  TYR  21           1HE      TYR  21  -1.592   9.271   0.065
  174    HE2  TYR  21           2HE      TYR  21   1.818   8.646  -2.474
  175    HH   TYR  21           HH       TYR  21   0.567  10.958  -1.324
  176    H    PHE  22           H        PHE  22   1.772   2.984  -1.818
  177    HA   PHE  22           HA       PHE  22   2.114   0.783   0.116
  178   1HB   PHE  22          1HB       PHE  22   1.404  -0.933  -1.307
  179   2HB   PHE  22          2HB       PHE  22   0.243   0.329  -1.655
  180    HD1  PHE  22           1HD      PHE  22   0.365   1.630  -3.755
  181    HD2  PHE  22           2HD      PHE  22   3.101  -1.576  -2.919
  182    HE1  PHE  22           1HE      PHE  22   1.036   1.579  -6.142
  183    HE2  PHE  22           2HE      PHE  22   3.775  -1.624  -5.306
  184    HZ   PHE  22           HZ       PHE  22   2.742  -0.047  -6.917
  185    H    TYR  23           H        TYR  23   4.111  -0.343  -0.251
  186    HA   TYR  23           HA       TYR  23   6.154   1.342  -1.552
  187   1HB   TYR  23          1HB       TYR  23   6.466   0.336   0.666
  188   2HB   TYR  23          2HB       TYR  23   6.283  -1.278  -0.019
  189    HD1  TYR  23           1HD      TYR  23   8.228  -2.437  -0.583
  190    HD2  TYR  23           2HD      TYR  23   8.280   1.857  -0.592
  191    HE1  TYR  23           1HE      TYR  23  10.642  -2.470  -1.146
  192    HE2  TYR  23           2HE      TYR  23  10.694   1.826  -1.157
  193    HH   TYR  23           HH       TYR  23  12.652   0.018  -0.757
  194    H    ASN  24           H        ASN  24   6.550   1.058  -3.723
  195    HA   ASN  24           HA       ASN  24   5.909  -1.510  -5.045
  196   1HB   ASN  24          1HB       ASN  24   5.331   0.709  -6.012
  197   2HB   ASN  24          2HB       ASN  24   7.044   1.111  -6.077
  198   1HD2  ASN  24          1HD2      ASN  24   5.846   1.171  -8.514
  199   2HD2  ASN  24          2HD2      ASN  24   6.207  -0.211  -9.431
  200    H    ALA  25           H        ALA  25   7.573  -2.936  -4.257
  201    HA   ALA  25           HA       ALA  25  10.307  -2.416  -3.956
  202   1HB   ALA  25          1HB       ALA  25  10.256  -4.966  -4.952
  203   2HB   ALA  25          2HB       ALA  25   8.558  -4.735  -4.537
  204   3HB   ALA  25          3HB       ALA  25   9.801  -4.550  -3.300
  205    H    LYS  26           H        LYS  26   8.438  -2.592  -6.887
  206    HA   LYS  26           HA       LYS  26  10.734  -3.013  -8.661
  207   1HB   LYS  26          1HB       LYS  26   7.842  -2.926  -8.747
  208   2HB   LYS  26          2HB       LYS  26   8.514  -1.934 -10.042
  209   1HG   LYS  26          1HG       LYS  26  10.102  -3.994 -10.416
  210   2HG   LYS  26          2HG       LYS  26   8.856  -4.879  -9.535
  211   1HD   LYS  26          1HD       LYS  26   7.902  -3.066 -11.688
  212   2HD   LYS  26          2HD       LYS  26   8.780  -4.501 -12.215
  213   1HE   LYS  26          1HE       LYS  26   6.719  -4.923 -10.102
  214   2HE   LYS  26          2HE       LYS  26   6.124  -4.546 -11.731
  215   1HZ   LYS  26          1HZ       LYS  26   6.556  -6.944 -11.401
  216   2HZ   LYS  26          2HZ       LYS  26   8.189  -6.595 -11.087
  217   3HZ   LYS  26          3HZ       LYS  26   7.529  -6.278 -12.621
  218    H    ALA  27           H        ALA  27   9.099  -0.306  -7.173
  219    HA   ALA  27           HA       ALA  27  10.396   1.631  -9.027
  220   1HB   ALA  27          1HB       ALA  27   8.587   2.893  -8.509
  221   2HB   ALA  27          2HB       ALA  27   8.855   2.679  -6.779
  222   3HB   ALA  27          3HB       ALA  27   7.953   1.467  -7.688
  223    H    GLY  28           H        GLY  28  10.581   0.424  -5.727
  224   1HA   GLY  28          1HA       GLY  28  12.582   0.593  -4.387
  225   2HA   GLY  28          2HA       GLY  28  13.085   1.974  -5.362
  226    H    LEU  29           H        LEU  29  10.005   2.717  -4.925
  227    HA   LEU  29           HA       LEU  29  10.350   3.859  -2.184
  228   1HB   LEU  29          1HB       LEU  29   9.457   5.991  -3.152
  229   2HB   LEU  29          2HB       LEU  29  10.986   5.511  -3.889
  230    HG   LEU  29           HG       LEU  29   8.849   4.250  -5.323
  231   1HD1  LEU  29          1HD1      LEU  29   7.819   6.489  -4.196
  232   2HD1  LEU  29          2HD1      LEU  29   7.335   5.899  -5.785
  233   3HD1  LEU  29          3HD1      LEU  29   8.537   7.182  -5.650
  234   1HD2  LEU  29          1HD2      LEU  29  10.443   6.609  -6.306
  235   2HD2  LEU  29          2HD2      LEU  29   9.969   5.151  -7.178
  236   3HD2  LEU  29          3HD2      LEU  29  11.251   5.076  -5.969
  237    H    CYS  30           H        CYS  30   7.797   5.357  -2.694
  238    HA   CYS  30           HA       CYS  30   5.922   3.028  -2.473
  239   1HB   CYS  30          1HB       CYS  30   6.055   5.746  -1.149
  240   2HB   CYS  30          2HB       CYS  30   4.604   4.747  -1.087
  241    H    GLN  31           H        GLN  31   3.804   3.311  -3.386
  242    HA   GLN  31           HA       GLN  31   3.417   5.648  -5.198
  243   1HB   GLN  31          1HB       GLN  31   3.475   2.706  -5.899
  244   2HB   GLN  31          2HB       GLN  31   2.672   3.889  -6.929
  245   1HG   GLN  31          1HG       GLN  31   4.987   5.174  -6.650
  246   2HG   GLN  31          2HG       GLN  31   5.587   3.544  -6.340
  247   1HE2  GLN  31          1HE2      GLN  31   6.658   3.179  -8.355
  248   2HE2  GLN  31          2HE2      GLN  31   5.849   3.162  -9.847
  249    H    THR  32           H        THR  32   1.144   5.970  -5.719
  250    HA   THR  32           HA       THR  32  -0.657   5.013  -3.608
  251    HB   THR  32           HB       THR  32  -2.236   6.556  -4.912
  252    HG1  THR  32           1HG      THR  32  -1.448   6.684  -6.894
  253   1HG2  THR  32          1HG2      THR  32   0.425   7.756  -4.103
  254   2HG2  THR  32          2HG2      THR  32  -0.817   7.252  -2.957
  255   3HG2  THR  32          3HG2      THR  32  -1.146   8.557  -4.097
  256    H    PHE  33           H        PHE  33  -2.434   3.640  -3.928
  257    HA   PHE  33           HA       PHE  33  -2.843   2.501  -6.660
  258   1HB   PHE  33          1HB       PHE  33  -2.506   0.285  -5.882
  259   2HB   PHE  33          2HB       PHE  33  -1.207   1.203  -5.131
  260    HD1  PHE  33           1HD      PHE  33  -1.316   1.805  -2.710
  261    HD2  PHE  33           2HD      PHE  33  -4.315  -0.647  -4.577
  262    HE1  PHE  33           1HE      PHE  33  -2.120   1.104  -0.485
  263    HE2  PHE  33           2HE      PHE  33  -5.116  -1.359  -2.340
  264    HZ   PHE  33           HZ       PHE  33  -4.021  -0.484  -0.294
  265    H    VAL  34           H        VAL  34  -4.915   1.244  -6.764
  266    HA   VAL  34           HA       VAL  34  -7.068   2.680  -5.428
  267    HB   VAL  34           HB       VAL  34  -7.115   0.114  -7.054
  268   1HG1  VAL  34          1HG1      VAL  34  -9.382   1.254  -7.714
  269   2HG1  VAL  34          2HG1      VAL  34  -9.162   2.157  -6.216
  270   3HG1  VAL  34          3HG1      VAL  34  -9.270   0.397  -6.176
  271   1HG2  VAL  34          1HG2      VAL  34  -5.884   1.965  -8.194
  272   2HG2  VAL  34          2HG2      VAL  34  -7.302   2.995  -7.996
  273   3HG2  VAL  34          3HG2      VAL  34  -7.392   1.556  -9.013
  274    H    TYR  35           H        TYR  35  -7.887   2.168  -3.435
  275    HA   TYR  35           HA       TYR  35  -7.161  -0.483  -2.247
  276   1HB   TYR  35          1HB       TYR  35  -6.399   1.535  -1.103
  277   2HB   TYR  35          2HB       TYR  35  -8.036   2.185  -1.093
  278    HD1  TYR  35           1HD      TYR  35  -7.201  -1.377  -0.508
  279    HD2  TYR  35           2HD      TYR  35  -8.298   2.365   1.293
  280    HE1  TYR  35           1HE      TYR  35  -7.643  -2.538   1.640
  281    HE2  TYR  35           2HE      TYR  35  -8.740   1.205   3.438
  282    HH   TYR  35           HH       TYR  35  -7.682  -1.301   4.422
  283    H    GLY  36           H        GLY  36  -8.825  -1.796  -1.320
  284   1HA   GLY  36          1HA       GLY  36 -11.537  -1.275  -2.366
  285   2HA   GLY  36          2HA       GLY  36 -10.983  -2.783  -1.642
  286    H    ALA  37           H        ALA  37  -9.877  -0.517   0.434
  287    HA   ALA  37           HA       ALA  37 -10.707   0.436   2.447
  288   1HB   ALA  37          1HB       ALA  37 -12.612   0.972   0.718
  289   2HB   ALA  37          2HB       ALA  37 -12.943   1.130   2.444
  290   3HB   ALA  37          3HB       ALA  37 -13.484  -0.303   1.569
  291    H    CYS  38           H        CYS  38 -10.792  -2.741   1.591
  292    HA   CYS  38           HA       CYS  38 -11.325  -3.578   4.371
  293   1HB   CYS  38          1HB       CYS  38 -13.129  -5.113   3.702
  294   2HB   CYS  38          2HB       CYS  38 -13.548  -3.452   3.285
  295    H    ARG  39           H        ARG  39 -10.831  -5.928   4.664
  296    HA   ARG  39           HA       ARG  39  -9.305  -7.714   4.403
  297   1HB   ARG  39          1HB       ARG  39 -11.105  -7.711   2.414
  298   2HB   ARG  39          2HB       ARG  39  -9.651  -7.466   1.446
  299   1HG   ARG  39          1HG       ARG  39  -8.670  -9.493   2.231
  300   2HG   ARG  39          2HG       ARG  39  -9.842  -9.642   3.539
  301   1HD   ARG  39          1HD       ARG  39 -11.468  -9.557   1.300
  302   2HD   ARG  39          2HD       ARG  39 -10.067 -10.486   0.729
  303    HE   ARG  39           HE       ARG  39 -11.998 -11.398   2.673
  304   1HH1  ARG  39          1HH2      ARG  39  -9.110 -12.117   1.131
  305   2HH1  ARG  39          2HH2      ARG  39  -8.531 -13.216   2.339
  306   1HH2  ARG  39          1HH1      ARG  39 -11.052 -12.470   4.604
  307   2HH2  ARG  39          2HH1      ARG  39  -9.630 -13.414   4.308
  308    H    ALA  40           H        ALA  40  -8.172  -4.992   4.367
  309    HA   ALA  40           HA       ALA  40  -6.088  -4.979   2.291
  310   1HB   ALA  40          1HB       ALA  40  -5.668  -3.137   4.464
  311   2HB   ALA  40          2HB       ALA  40  -7.383  -3.169   4.057
  312   3HB   ALA  40          3HB       ALA  40  -6.190  -2.788   2.817
  313    H    LYS  41           H        LYS  41  -3.765  -4.815   2.948
  314    HA   LYS  41           HA       LYS  41  -3.155  -6.517   5.347
  315   1HB   LYS  41          1HB       LYS  41  -1.576  -6.300   2.769
  316   2HB   LYS  41          2HB       LYS  41  -1.427  -7.534   4.020
  317   1HG   LYS  41          1HG       LYS  41  -3.648  -8.390   3.498
  318   2HG   LYS  41          2HG       LYS  41  -3.915  -7.085   2.342
  319   1HD   LYS  41          1HD       LYS  41  -3.045  -8.443   0.764
  320   2HD   LYS  41          2HD       LYS  41  -1.484  -8.246   1.564
  321   1HE   LYS  41          1HE       LYS  41  -2.587 -10.143   3.167
  322   2HE   LYS  41          2HE       LYS  41  -3.363 -10.551   1.622
  323   1HZ   LYS  41          1HZ       LYS  41  -1.229 -11.630   1.728
  324   2HZ   LYS  41          2HZ       LYS  41  -0.454 -10.174   2.137
  325   3HZ   LYS  41          3HZ       LYS  41  -1.128 -10.375   0.591
  326    H    ARG  42           H        ARG  42  -0.326  -6.128   5.183
  327    HA   ARG  42           HA       ARG  42  -0.104  -3.476   6.393
  328   1HB   ARG  42          1HB       ARG  42   2.087  -5.421   5.610
  329   2HB   ARG  42          2HB       ARG  42   2.149  -4.193   6.871
  330   1HG   ARG  42          1HG       ARG  42   0.366  -5.381   8.108
  331   2HG   ARG  42          2HG       ARG  42   0.322  -6.618   6.852
  332   1HD   ARG  42          1HD       ARG  42   3.044  -6.173   7.822
  333   2HD   ARG  42          2HD       ARG  42   1.944  -6.666   9.125
  334    HE   ARG  42           HE       ARG  42   1.874  -8.156   6.540
  335   1HH1  ARG  42          1HH1      ARG  42   4.269  -8.795   8.295
  336   2HH1  ARG  42          2HH1      ARG  42   3.671 -10.138   9.213
  337   1HH2  ARG  42          1HH2      ARG  42   0.348  -9.539   8.419
  338   2HH2  ARG  42          2HH2      ARG  42   1.450 -10.559   9.283
  339    H    ASN  43           H        ASN  43  -0.009  -4.628   3.205
  340    HA   ASN  43           HA       ASN  43   1.895  -2.561   2.238
  341   1HB   ASN  43          1HB       ASN  43   1.701  -5.027   1.466
  342   2HB   ASN  43          2HB       ASN  43   0.248  -4.510   0.612
  343   1HD2  ASN  43          1HD2      ASN  43   3.697  -3.490   0.996
  344   2HD2  ASN  43          2HD2      ASN  43   3.881  -2.993  -0.617
  345    H    ASN  44           H        ASN  44  -0.054  -1.160   3.322
  346    HA   ASN  44           HA       ASN  44  -1.435   0.138   1.083
  347   1HB   ASN  44          1HB       ASN  44  -2.923  -1.743   1.439
  348   2HB   ASN  44          2HB       ASN  44  -2.867  -1.528   3.187
  349   1HD2  ASN  44          1HD2      ASN  44  -5.337  -1.541   1.721
  350   2HD2  ASN  44          2HD2      ASN  44  -6.035   0.012   1.852
  351    H    PHE  45           H        PHE  45  -0.076   1.857   2.069
  352    HA   PHE  45           HA       PHE  45  -0.773   2.708   4.821
  353   1HB   PHE  45          1HB       PHE  45   1.165   3.935   2.840
  354   2HB   PHE  45          2HB       PHE  45   1.195   4.065   4.600
  355    HD1  PHE  45           1HD      PHE  45   2.016   1.987   1.706
  356    HD2  PHE  45           2HD      PHE  45   1.784   2.085   5.995
  357    HE1  PHE  45           1HE      PHE  45   3.397  -0.072   1.827
  358    HE2  PHE  45           2HE      PHE  45   3.165   0.027   6.118
  359    HZ   PHE  45           HZ       PHE  45   3.970  -1.061   4.034
  360    H    LYS  46           H        LYS  46  -1.634   4.794   5.269
  361    HA   LYS  46           HA       LYS  46  -3.444   5.853   3.223
  362   1HB   LYS  46          1HB       LYS  46  -2.772   6.819   6.022
  363   2HB   LYS  46          2HB       LYS  46  -4.222   7.216   5.096
  364   1HG   LYS  46          1HG       LYS  46  -4.947   4.900   5.142
  365   2HG   LYS  46          2HG       LYS  46  -3.430   4.397   5.889
  366   1HD   LYS  46          1HD       LYS  46  -4.686   4.575   7.803
  367   2HD   LYS  46          2HD       LYS  46  -4.199   6.266   7.676
  368   1HE   LYS  46          1HE       LYS  46  -6.313   6.951   7.063
  369   2HE   LYS  46          2HE       LYS  46  -6.632   5.466   6.143
  370   1HZ   LYS  46          1HZ       LYS  46  -7.181   4.315   8.039
  371   2HZ   LYS  46          2HZ       LYS  46  -7.743   5.859   8.471
  372   3HZ   LYS  46          3HZ       LYS  46  -6.248   5.303   9.055
  373    H    SER  47           H        SER  47  -0.223   6.441   4.187
  374    HA   SER  47           HA       SER  47  -0.186   8.957   2.584
  375   1HB   SER  47          1HB       SER  47   1.096  10.058   4.351
  376   2HB   SER  47          2HB       SER  47  -0.418   9.462   5.021
  377    HG   SER  47           HG       SER  47   0.683   7.646   5.798
  378    H    ALA  48           H        ALA  48   1.954   9.432   1.742
  379    HA   ALA  48           HA       ALA  48   3.498   7.065   1.055
  380   1HB   ALA  48          1HB       ALA  48   4.685   9.731   0.628
  381   2HB   ALA  48          2HB       ALA  48   3.036   9.577   0.022
  382   3HB   ALA  48          3HB       ALA  48   4.291   8.479  -0.549
  383    H    GLU  49           H        GLU  49   3.670   9.490   3.551
  384    HA   GLU  49           HA       GLU  49   6.476   9.234   4.195
  385   1HB   GLU  49          1HB       GLU  49   4.931  11.119   4.790
  386   2HB   GLU  49          2HB       GLU  49   4.113  10.041   5.921
  387   1HG   GLU  49          1HG       GLU  49   5.628  10.935   7.393
  388   2HG   GLU  49          2HG       GLU  49   6.668   9.678   6.723
  389    H    ASP  50           H        ASP  50   3.536   7.568   5.293
  390    HA   ASP  50           HA       ASP  50   4.922   6.062   7.383
  391   1HB   ASP  50          1HB       ASP  50   2.289   6.699   6.615
  392   2HB   ASP  50          2HB       ASP  50   2.409   4.948   6.438
  393    H    CYS  51           H        CYS  51   3.909   5.514   4.034
  394    HA   CYS  51           HA       CYS  51   4.511   2.690   3.939
  395   1HB   CYS  51          1HB       CYS  51   3.085   3.725   2.290
  396   2HB   CYS  51          2HB       CYS  51   4.321   4.917   1.884
  397    H    MET  52           H        MET  52   6.340   5.633   3.076
  398    HA   MET  52           HA       MET  52   8.708   4.330   2.131
  399   1HB   MET  52          1HB       MET  52   8.130   6.666   1.690
  400   2HB   MET  52          2HB       MET  52   8.210   7.036   3.412
  401   1HG   MET  52          1HG       MET  52  10.276   7.676   2.093
  402   2HG   MET  52          2HG       MET  52  10.581   6.614   3.467
  403   1HE   MET  52          1HE       MET  52  10.606   5.598  -0.997
  404   2HE   MET  52          2HE       MET  52  11.015   7.162  -0.298
  405   3HE   MET  52          3HE       MET  52   9.371   6.544  -0.155
  406    H    ARG  53           H        ARG  53   8.239   6.019   5.271
  407    HA   ARG  53           HA       ARG  53  10.616   5.092   6.504
  408   1HB   ARG  53          1HB       ARG  53   9.529   5.835   8.545
  409   2HB   ARG  53          2HB       ARG  53   9.037   6.917   7.242
  410   1HG   ARG  53          1HG       ARG  53   6.898   6.444   7.780
  411   2HG   ARG  53          2HG       ARG  53   7.180   4.809   7.181
  412   1HD   ARG  53          1HD       ARG  53   6.561   4.288   9.357
  413   2HD   ARG  53          2HD       ARG  53   8.287   4.578   9.646
  414    HE   ARG  53           HE       ARG  53   7.575   7.003  10.113
  415   1HH1  ARG  53          1HH2      ARG  53   6.588   4.631  12.003
  416   2HH1  ARG  53          2HH2      ARG  53   5.043   5.280  12.446
  417   1HH2  ARG  53          1HH1      ARG  53   5.068   7.723   9.987
  418   2HH2  ARG  53          2HH1      ARG  53   4.182   7.028  11.303
  419    H    THR  54           H        THR  54   7.672   3.403   5.805
  420    HA   THR  54           HA       THR  54   8.129   1.302   7.829
  421    HB   THR  54           HB       THR  54   6.104   1.908   5.673
  422    HG1  THR  54           1HG      THR  54   4.893   1.475   7.833
  423   1HG2  THR  54          1HG2      THR  54   5.105  -0.270   7.062
  424   2HG2  THR  54          2HG2      THR  54   6.794  -0.704   6.797
  425   3HG2  THR  54          3HG2      THR  54   5.759  -0.309   5.424
  426    H    CYS  55           H        CYS  55   8.175   1.597   4.266
  427    HA   CYS  55           HA       CYS  55   9.452  -1.086   4.072
  428   1HB   CYS  55          1HB       CYS  55   8.405   0.824   1.958
  429   2HB   CYS  55          2HB       CYS  55   8.843  -0.868   1.710
  430    H    GLY  56           H        GLY  56   9.957   2.250   2.839
  431   1HA   GLY  56          1HA       GLY  56  11.921   3.258   2.010
  432   2HA   GLY  56          2HA       GLY  56  12.668   2.500   3.418
  433    H    GLY  57           H        GLY  57  14.583   2.263   1.976
  434   1HA   GLY  57          1HA       GLY  57  15.878   0.418   1.068
  435   2HA   GLY  57          2HA       GLY  57  14.385  -0.274   0.433
  436    H    ALA  58           H        ALA  58  16.236   2.784   0.119
  437    HA   ALA  58           HA       ALA  58  15.952   2.524  -2.850
  438   1HB   ALA  58          1HB       ALA  58  15.800   5.246  -1.712
  439   2HB   ALA  58          2HB       ALA  58  14.450   4.199  -1.274
  440   3HB   ALA  58          3HB       ALA  58  14.818   4.501  -2.973
  Start of MODEL   12
    1   1H    ARG   1          1H        ARG   1  14.322  -4.462   4.638
    2   2H    ARG   1          2H        ARG   1  14.215  -3.268   5.840
    3   3H    ARG   1          3H        ARG   1  14.601  -2.837   4.244
    4    HA   ARG   1           HA       ARG   1  12.173  -2.515   5.135
    5   1HB   ARG   1          1HB       ARG   1  11.511  -2.863   2.733
    6   2HB   ARG   1          2HB       ARG   1  13.019  -1.964   2.915
    7   1HG   ARG   1          1HG       ARG   1  14.332  -3.886   2.387
    8   2HG   ARG   1          2HG       ARG   1  12.949  -4.967   2.558
    9   1HD   ARG   1          1HD       ARG   1  13.089  -4.729   0.220
   10   2HD   ARG   1          2HD       ARG   1  11.931  -3.448   0.634
   11    HE   ARG   1           HE       ARG   1  13.855  -1.857   0.600
   12   1HH1  ARG   1          1HH2      ARG   1  15.265  -4.853   0.336
   13   2HH1  ARG   1          2HH2      ARG   1  16.206  -4.503  -1.075
   14   1HH2  ARG   1          1HH1      ARG   1  14.659  -1.460  -1.678
   15   2HH2  ARG   1          2HH1      ARG   1  15.866  -2.581  -2.211
   16    HA   PRO   2           HA       PRO   2  10.132  -6.316   6.015
   17   1HB   PRO   2          1HB       PRO   2   7.571  -5.617   5.427
   18   2HB   PRO   2          2HB       PRO   2   8.412  -5.059   6.883
   19   1HG   PRO   2          1HG       PRO   2   7.899  -3.644   4.305
   20   2HG   PRO   2          2HG       PRO   2   7.869  -3.014   5.958
   21   1HD   PRO   2          1HD       PRO   2   9.947  -2.653   4.209
   22   2HD   PRO   2          2HD       PRO   2  10.131  -2.653   5.978
   23    H    ASP   3           H        ASP   3   8.629  -7.942   4.971
   24    HA   ASP   3           HA       ASP   3   9.301  -8.188   2.098
   25   1HB   ASP   3          1HB       ASP   3   9.573  -9.980   3.921
   26   2HB   ASP   3          2HB       ASP   3   7.814 -10.115   3.903
   27    H    PHE   4           H        PHE   4   6.580  -7.463   4.192
   28    HA   PHE   4           HA       PHE   4   4.507  -8.153   2.291
   29   1HB   PHE   4          1HB       PHE   4   3.067  -6.771   3.756
   30   2HB   PHE   4          2HB       PHE   4   4.057  -7.896   4.671
   31    HD1  PHE   4           1HD      PHE   4   5.408  -7.160   6.406
   32    HD2  PHE   4           2HD      PHE   4   3.987  -4.296   3.523
   33    HE1  PHE   4           1HE      PHE   4   6.304  -5.312   7.786
   34    HE2  PHE   4           2HE      PHE   4   4.899  -2.468   4.908
   35    HZ   PHE   4           HZ       PHE   4   6.047  -2.967   7.035
   36    H    CYS   5           H        CYS   5   6.668  -5.451   2.530
   37    HA   CYS   5           HA       CYS   5   5.030  -3.638   0.909
   38   1HB   CYS   5          1HB       CYS   5   7.554  -3.679   2.388
   39   2HB   CYS   5          2HB       CYS   5   7.674  -2.776   0.878
   40    H    LEU   6           H        LEU   6   7.267  -6.217   0.308
   41    HA   LEU   6           HA       LEU   6   8.160  -5.351  -2.320
   42   1HB   LEU   6          1HB       LEU   6   8.021  -8.150  -1.158
   43   2HB   LEU   6          2HB       LEU   6   9.146  -7.554  -2.379
   44    HG   LEU   6           HG       LEU   6   9.012  -6.749   0.540
   45   1HD1  LEU   6          1HD1      LEU   6  10.218  -8.800   0.251
   46   2HD1  LEU   6          2HD1      LEU   6  11.431  -7.529   0.407
   47   3HD1  LEU   6          3HD1      LEU   6  11.043  -8.187  -1.182
   48   1HD2  LEU   6          1HD2      LEU   6   9.442  -4.754  -0.779
   49   2HD2  LEU   6          2HD2      LEU   6  10.637  -5.610  -1.754
   50   3HD2  LEU   6          3HD2      LEU   6  10.961  -5.276  -0.053
   51    H    GLU   7           H        GLU   7   5.358  -7.038  -1.076
   52    HA   GLU   7           HA       GLU   7   4.558  -8.189  -3.641
   53   1HB   GLU   7          1HB       GLU   7   3.046  -7.698  -1.054
   54   2HB   GLU   7          2HB       GLU   7   2.544  -8.784  -2.352
   55   1HG   GLU   7          1HG       GLU   7   4.011 -10.403  -1.715
   56   2HG   GLU   7          2HG       GLU   7   5.295  -9.237  -1.390
   57    HA   PRO   8           HA       PRO   8   2.375  -4.783  -5.326
   58   1HB   PRO   8          1HB       PRO   8   0.171  -6.025  -6.399
   59   2HB   PRO   8          2HB       PRO   8   1.795  -6.131  -7.110
   60   1HG   PRO   8          1HG       PRO   8   0.337  -8.074  -5.369
   61   2HG   PRO   8          2HG       PRO   8   1.352  -8.376  -6.789
   62   1HD   PRO   8          1HD       PRO   8   2.215  -8.716  -4.228
   63   2HD   PRO   8          2HD       PRO   8   3.297  -8.267  -5.567
   64    HA   PRO   9           HA       PRO   9  -0.740  -3.428  -2.558
   65   1HB   PRO   9          1HB       PRO   9  -2.420  -1.989  -4.175
   66   2HB   PRO   9          2HB       PRO   9  -0.811  -1.422  -3.687
   67   1HG   PRO   9          1HG       PRO   9  -1.706  -2.679  -6.240
   68   2HG   PRO   9          2HG       PRO   9  -0.559  -1.354  -5.974
   69   1HD   PRO   9          1HD       PRO   9   0.179  -3.936  -6.504
   70   2HD   PRO   9          2HD       PRO   9   1.184  -2.790  -5.589
   71    H    TYR  10           H        TYR  10  -2.979  -3.787  -1.894
   72    HA   TYR  10           HA       TYR  10  -4.389  -5.916  -3.492
   73   1HB   TYR  10          1HB       TYR  10  -3.224  -6.553  -1.317
   74   2HB   TYR  10          2HB       TYR  10  -4.392  -5.521  -0.488
   75    HD1  TYR  10           1HD      TYR  10  -6.404  -6.469   0.224
   76    HD2  TYR  10           2HD      TYR  10  -4.276  -8.266  -3.044
   77    HE1  TYR  10           1HE      TYR  10  -8.079  -8.294   0.137
   78    HE2  TYR  10           2HE      TYR  10  -5.950 -10.091  -3.131
   79    HH   TYR  10           HH       TYR  10  -8.446 -10.321  -2.433
   80    H    THR  11           H        THR  11  -5.827  -4.467  -4.528
   81    HA   THR  11           HA       THR  11  -7.298  -2.365  -3.321
   82    HB   THR  11           HB       THR  11  -7.630  -4.252  -5.639
   83    HG1  THR  11           1HG      THR  11  -6.452  -2.047  -5.337
   84   1HG2  THR  11          1HG2      THR  11  -9.692  -2.876  -6.265
   85   2HG2  THR  11          2HG2      THR  11  -9.736  -2.361  -4.579
   86   3HG2  THR  11          3HG2      THR  11  -9.916  -4.069  -4.986
   87    H    GLY  12           H        GLY  12  -7.550  -5.824  -3.065
   88   1HA   GLY  12          1HA       GLY  12  -8.940  -7.176  -1.729
   89   2HA   GLY  12          2HA       GLY  12  -9.316  -5.718  -0.811
   90    HA   PRO  13           HA       PRO  13 -13.057  -7.173  -3.220
   91   1HB   PRO  13          1HB       PRO  13 -14.655  -7.592  -1.028
   92   2HB   PRO  13          2HB       PRO  13 -13.609  -8.845  -1.722
   93   1HG   PRO  13          1HG       PRO  13 -13.183  -7.098   0.658
   94   2HG   PRO  13          2HG       PRO  13 -12.795  -8.810   0.434
   95   1HD   PRO  13          1HD       PRO  13 -10.956  -6.794   0.269
   96   2HD   PRO  13          2HD       PRO  13 -10.801  -8.343  -0.592
   97    H    CYS  14           H        CYS  14 -15.508  -6.292  -1.968
   98    HA   CYS  14           HA       CYS  14 -16.785  -4.334  -1.619
   99   1HB   CYS  14          1HB       CYS  14 -14.132  -3.082  -0.858
  100   2HB   CYS  14          2HB       CYS  14 -15.736  -2.657  -0.264
  101    H    LYS  15           H        LYS  15 -17.252  -2.319  -2.723
  102    HA   LYS  15           HA       LYS  15 -15.730  -2.017  -5.265
  103   1HB   LYS  15          1HB       LYS  15 -18.478  -1.348  -4.236
  104   2HB   LYS  15          2HB       LYS  15 -17.866  -0.545  -5.682
  105   1HG   LYS  15          1HG       LYS  15 -18.708  -2.377  -6.754
  106   2HG   LYS  15          2HG       LYS  15 -17.216  -3.147  -6.214
  107   1HD   LYS  15          1HD       LYS  15 -18.292  -4.136  -4.334
  108   2HD   LYS  15          2HD       LYS  15 -19.707  -3.098  -4.503
  109   1HE   LYS  15          1HE       LYS  15 -19.263  -4.575  -6.961
  110   2HE   LYS  15          2HE       LYS  15 -19.382  -5.685  -5.580
  111   1HZ   LYS  15          1HZ       LYS  15 -21.273  -3.506  -6.315
  112   2HZ   LYS  15          2HZ       LYS  15 -21.346  -4.366  -4.853
  113   3HZ   LYS  15          3HZ       LYS  15 -21.588  -5.173  -6.329
  114    H    ALA  16           H        ALA  16 -15.479  -0.758  -2.257
  115    HA   ALA  16           HA       ALA  16 -15.637   2.032  -2.393
  116   1HB   ALA  16          1HB       ALA  16 -13.210   0.835  -1.159
  117   2HB   ALA  16          2HB       ALA  16 -14.755   0.162  -0.638
  118   3HB   ALA  16          3HB       ALA  16 -14.433   1.884  -0.440
  119    H    ARG  17           H        ARG  17 -13.703   3.557  -2.613
  120    HA   ARG  17           HA       ARG  17 -11.615   2.692  -4.528
  121   1HB   ARG  17          1HB       ARG  17 -12.362   4.628  -6.040
  122   2HB   ARG  17          2HB       ARG  17 -13.419   3.215  -6.013
  123   1HG   ARG  17          1HG       ARG  17 -14.120   5.058  -3.888
  124   2HG   ARG  17          2HG       ARG  17 -14.143   5.876  -5.451
  125   1HD   ARG  17          1HD       ARG  17 -15.543   3.235  -4.881
  126   2HD   ARG  17          2HD       ARG  17 -16.347   4.817  -4.910
  127    HE   ARG  17           HE       ARG  17 -15.081   3.464  -7.254
  128   1HH1  ARG  17          1HH2      ARG  17 -17.720   5.188  -6.116
  129   2HH1  ARG  17          2HH2      ARG  17 -17.870   6.223  -7.496
  130   1HH2  ARG  17          1HH1      ARG  17 -14.898   5.169  -8.943
  131   2HH2  ARG  17          2HH1      ARG  17 -16.278   6.202  -9.103
  132    H    ILE  18           H        ILE  18  -9.970   3.370  -3.155
  133    HA   ILE  18           HA       ILE  18  -9.898   6.292  -2.498
  134    HB   ILE  18           HB       ILE  18  -9.289   3.875  -0.774
  135   1HG1  ILE  18          1HG1      ILE  18 -11.277   6.158  -0.572
  136   2HG1  ILE  18          2HG1      ILE  18 -11.647   4.456  -0.859
  137   1HG2  ILE  18          1HG2      ILE  18  -7.945   6.339  -0.747
  138   2HG2  ILE  18          2HG2      ILE  18  -7.950   5.130   0.538
  139   3HG2  ILE  18          3HG2      ILE  18  -9.121   6.448   0.563
  140   1HD1  ILE  18          1HD1      ILE  18 -11.393   5.778   1.641
  141   2HD1  ILE  18          2HD1      ILE  18 -10.013   4.688   1.497
  142   3HD1  ILE  18          3HD1      ILE  18 -11.653   4.057   1.356
  143    H    ILE  19           H        ILE  19  -7.811   7.214  -2.655
  144    HA   ILE  19           HA       ILE  19  -5.827   5.603  -4.144
  145    HB   ILE  19           HB       ILE  19  -6.000   8.528  -3.350
  146   1HG1  ILE  19          1HG1      ILE  19  -7.762   7.697  -4.922
  147   2HG1  ILE  19          2HG1      ILE  19  -6.684   8.872  -5.674
  148   1HG2  ILE  19          1HG2      ILE  19  -3.750   7.092  -4.163
  149   2HG2  ILE  19          2HG2      ILE  19  -3.948   8.842  -4.242
  150   3HG2  ILE  19          3HG2      ILE  19  -4.335   7.848  -5.645
  151   1HD1  ILE  19          1HD1      ILE  19  -6.354   5.864  -5.896
  152   2HD1  ILE  19          2HD1      ILE  19  -5.420   7.091  -6.750
  153   3HD1  ILE  19          3HD1      ILE  19  -7.131   6.869  -7.117
  154    H    ARG  20           H        ARG  20  -5.164   4.222  -2.349
  155    HA   ARG  20           HA       ARG  20  -3.860   5.499  -0.016
  156   1HB   ARG  20          1HB       ARG  20  -4.540   2.692  -0.906
  157   2HB   ARG  20          2HB       ARG  20  -3.524   2.984   0.506
  158   1HG   ARG  20          1HG       ARG  20  -6.071   4.524   0.326
  159   2HG   ARG  20          2HG       ARG  20  -6.201   2.801   0.678
  160   1HD   ARG  20          1HD       ARG  20  -5.017   3.001   2.701
  161   2HD   ARG  20          2HD       ARG  20  -4.238   4.514   2.205
  162    HE   ARG  20           HE       ARG  20  -6.893   4.258   3.387
  163   1HH1  ARG  20          1HH1      ARG  20  -4.578   6.296   1.922
  164   2HH1  ARG  20          2HH1      ARG  20  -5.658   7.638   1.749
  165   1HH2  ARG  20          1HH2      ARG  20  -8.439   5.898   2.866
  166   2HH2  ARG  20          2HH2      ARG  20  -7.839   7.415   2.286
  167    H    TYR  21           H        TYR  21  -1.636   4.340   0.559
  168    HA   TYR  21           HA       TYR  21   0.045   4.430  -1.920
  169   1HB   TYR  21          1HB       TYR  21   0.495   5.195   0.968
  170   2HB   TYR  21          2HB       TYR  21   1.830   5.044  -0.176
  171    HD1  TYR  21           1HD      TYR  21  -1.256   6.905   0.643
  172    HD2  TYR  21           2HD      TYR  21   2.156   6.649  -1.957
  173    HE1  TYR  21           1HE      TYR  21  -1.736   9.183  -0.210
  174    HE2  TYR  21           2HE      TYR  21   1.675   8.927  -2.810
  175    HH   TYR  21           HH       TYR  21   0.489  10.977  -2.005
  176    H    PHE  22           H        PHE  22   1.812   2.954  -2.076
  177    HA   PHE  22           HA       PHE  22   2.078   0.803  -0.076
  178   1HB   PHE  22          1HB       PHE  22   1.329  -0.935  -1.475
  179   2HB   PHE  22          2HB       PHE  22   0.173   0.345  -1.777
  180    HD1  PHE  22           1HD      PHE  22   2.918  -1.628  -3.156
  181    HD2  PHE  22           2HD      PHE  22   0.259   1.671  -3.869
  182    HE1  PHE  22           1HE      PHE  22   3.487  -1.692  -5.568
  183    HE2  PHE  22           2HE      PHE  22   0.833   1.609  -6.282
  184    HZ   PHE  22           HZ       PHE  22   2.447  -0.074  -7.130
  185    H    TYR  23           H        TYR  23   4.042  -0.409  -0.414
  186    HA   TYR  23           HA       TYR  23   6.143   1.170  -1.745
  187   1HB   TYR  23          1HB       TYR  23   6.430   0.149   0.477
  188   2HB   TYR  23          2HB       TYR  23   6.179  -1.453  -0.215
  189    HD1  TYR  23           1HD      TYR  23   7.987  -2.649  -1.152
  190    HD2  TYR  23           2HD      TYR  23   8.374   1.569  -0.449
  191    HE1  TYR  23           1HE      TYR  23  10.388  -2.770  -1.750
  192    HE2  TYR  23           2HE      TYR  23  10.779   1.448  -1.044
  193    HH   TYR  23           HH       TYR  23  12.179  -0.378  -2.656
  194    H    ASN  24           H        ASN  24   6.212   0.899  -3.987
  195    HA   ASN  24           HA       ASN  24   5.628  -1.676  -5.266
  196   1HB   ASN  24          1HB       ASN  24   5.130   0.568  -6.243
  197   2HB   ASN  24          2HB       ASN  24   6.862   0.883  -6.336
  198   1HD2  ASN  24          1HD2      ASN  24   5.082   0.722  -8.660
  199   2HD2  ASN  24          2HD2      ASN  24   5.596  -0.601  -9.593
  200    H    ALA  25           H        ALA  25   7.238  -3.190  -4.610
  201    HA   ALA  25           HA       ALA  25   9.981  -2.755  -4.225
  202   1HB   ALA  25          1HB       ALA  25   9.616  -5.242  -5.564
  203   2HB   ALA  25          2HB       ALA  25   8.139  -4.924  -4.653
  204   3HB   ALA  25          3HB       ALA  25   9.697  -4.962  -3.825
  205    H    LYS  26           H        LYS  26   8.144  -2.776  -7.178
  206    HA   LYS  26           HA       LYS  26  10.399  -3.165  -8.989
  207   1HB   LYS  26          1HB       LYS  26   7.679  -3.367  -9.116
  208   2HB   LYS  26          2HB       LYS  26   7.925  -1.801  -9.887
  209   1HG   LYS  26          1HG       LYS  26   9.719  -2.958 -11.307
  210   2HG   LYS  26          2HG       LYS  26   9.064  -4.480 -10.703
  211   1HD   LYS  26          1HD       LYS  26   7.148  -2.465 -11.806
  212   2HD   LYS  26          2HD       LYS  26   8.144  -3.370 -12.947
  213   1HE   LYS  26          1HE       LYS  26   6.519  -4.973 -12.764
  214   2HE   LYS  26          2HE       LYS  26   7.271  -5.343 -11.200
  215   1HZ   LYS  26          1HZ       LYS  26   5.867  -3.609 -10.206
  216   2HZ   LYS  26          2HZ       LYS  26   4.925  -4.835 -10.912
  217   3HZ   LYS  26          3HZ       LYS  26   5.119  -3.345 -11.705
  218    H    ALA  27           H        ALA  27   8.908  -0.451  -7.353
  219    HA   ALA  27           HA       ALA  27  10.334   1.492  -9.108
  220   1HB   ALA  27          1HB       ALA  27   7.836   1.502  -8.206
  221   2HB   ALA  27          2HB       ALA  27   8.740   3.011  -8.344
  222   3HB   ALA  27          3HB       ALA  27   8.588   2.213  -6.778
  223    H    GLY  28           H        GLY  28  10.677  -0.086  -6.056
  224   1HA   GLY  28          1HA       GLY  28  12.483   0.107  -4.527
  225   2HA   GLY  28          2HA       GLY  28  13.114   1.439  -5.499
  226    H    LEU  29           H        LEU  29   9.900   2.061  -4.993
  227    HA   LEU  29           HA       LEU  29  10.260   3.357  -2.350
  228   1HB   LEU  29          1HB       LEU  29   9.373   5.479  -3.441
  229   2HB   LEU  29          2HB       LEU  29  10.988   5.009  -3.959
  230    HG   LEU  29           HG       LEU  29   9.459   3.652  -5.770
  231   1HD1  LEU  29          1HD1      LEU  29   7.329   4.458  -5.291
  232   2HD1  LEU  29          2HD1      LEU  29   7.861   5.595  -6.529
  233   3HD1  LEU  29          3HD1      LEU  29   7.925   6.052  -4.828
  234   1HD2  LEU  29          1HD2      LEU  29  10.590   4.975  -7.230
  235   2HD2  LEU  29          2HD2      LEU  29  11.321   5.682  -5.790
  236   3HD2  LEU  29          3HD2      LEU  29   9.924   6.454  -6.540
  237    H    CYS  30           H        CYS  30   7.750   4.898  -2.929
  238    HA   CYS  30           HA       CYS  30   5.818   2.609  -2.890
  239   1HB   CYS  30          1HB       CYS  30   5.860   5.219  -1.344
  240   2HB   CYS  30          2HB       CYS  30   4.547   4.046  -1.278
  241    H    GLN  31           H        GLN  31   3.623   3.205  -3.604
  242    HA   GLN  31           HA       GLN  31   3.423   5.650  -5.290
  243   1HB   GLN  31          1HB       GLN  31   3.080   2.769  -6.180
  244   2HB   GLN  31          2HB       GLN  31   2.564   4.155  -7.144
  245   1HG   GLN  31          1HG       GLN  31   4.878   5.009  -7.153
  246   2HG   GLN  31          2HG       GLN  31   5.393   3.633  -6.175
  247   1HE2  GLN  31          1HE2      GLN  31   5.691   4.614  -9.228
  248   2HE2  GLN  31          2HE2      GLN  31   5.516   3.152 -10.071
  249    H    THR  32           H        THR  32   0.977   5.415  -6.327
  250    HA   THR  32           HA       THR  32  -0.757   4.962  -3.944
  251    HB   THR  32           HB       THR  32  -2.329   6.394  -5.343
  252    HG1  THR  32           1HG      THR  32  -0.154   7.160  -6.875
  253   1HG2  THR  32          1HG2      THR  32  -0.758   8.459  -5.145
  254   2HG2  THR  32          2HG2      THR  32   0.389   7.319  -4.441
  255   3HG2  THR  32          3HG2      THR  32  -1.179   7.578  -3.675
  256    H    PHE  33           H        PHE  33  -2.559   3.572  -4.079
  257    HA   PHE  33           HA       PHE  33  -3.113   2.245  -6.692
  258   1HB   PHE  33          1HB       PHE  33  -2.796   0.072  -5.806
  259   2HB   PHE  33          2HB       PHE  33  -1.427   0.991  -5.199
  260    HD1  PHE  33           1HD      PHE  33  -4.465  -0.820  -4.324
  261    HD2  PHE  33           2HD      PHE  33  -1.414   1.806  -2.806
  262    HE1  PHE  33           1HE      PHE  33  -5.106  -1.404  -2.002
  263    HE2  PHE  33           2HE      PHE  33  -2.065   1.233  -0.499
  264    HZ   PHE  33           HZ       PHE  33  -3.908  -0.379  -0.088
  265    H    VAL  34           H        VAL  34  -5.227   1.129  -6.674
  266    HA   VAL  34           HA       VAL  34  -7.245   2.686  -5.273
  267    HB   VAL  34           HB       VAL  34  -7.315   0.178  -6.979
  268   1HG1  VAL  34          1HG1      VAL  34  -9.734   0.530  -7.131
  269   2HG1  VAL  34          2HG1      VAL  34  -9.617   1.932  -6.067
  270   3HG1  VAL  34          3HG1      VAL  34  -9.270   0.321  -5.443
  271   1HG2  VAL  34          1HG2      VAL  34  -6.627   2.569  -7.853
  272   2HG2  VAL  34          2HG2      VAL  34  -8.358   2.890  -7.749
  273   3HG2  VAL  34          3HG2      VAL  34  -7.763   1.592  -8.784
  274    H    TYR  35           H        TYR  35  -7.908   2.298  -3.207
  275    HA   TYR  35           HA       TYR  35  -7.319  -0.361  -1.985
  276   1HB   TYR  35          1HB       TYR  35  -6.458   1.667  -0.917
  277   2HB   TYR  35          2HB       TYR  35  -8.076   2.363  -0.877
  278    HD1  TYR  35           1HD      TYR  35  -7.331  -1.205  -0.273
  279    HD2  TYR  35           2HD      TYR  35  -8.262   2.588   1.518
  280    HE1  TYR  35           1HE      TYR  35  -7.750  -2.331   1.896
  281    HE2  TYR  35           2HE      TYR  35  -8.680   1.462   3.690
  282    HH   TYR  35           HH       TYR  35  -9.111  -0.612   4.634
  283    H    GLY  36           H        GLY  36  -9.013  -1.664  -1.198
  284   1HA   GLY  36          1HA       GLY  36 -11.730  -0.949  -2.099
  285   2HA   GLY  36          2HA       GLY  36 -11.226  -2.523  -1.488
  286    H    ALA  37           H        ALA  37  -9.997  -0.322   0.660
  287    HA   ALA  37           HA       ALA  37 -10.762   0.534   2.739
  288   1HB   ALA  37          1HB       ALA  37 -13.006   1.213   2.836
  289   2HB   ALA  37          2HB       ALA  37 -13.567  -0.180   1.910
  290   3HB   ALA  37          3HB       ALA  37 -12.724   1.136   1.097
  291    H    CYS  38           H        CYS  38 -11.075  -2.637   1.685
  292    HA   CYS  38           HA       CYS  38 -11.601  -3.546   4.484
  293   1HB   CYS  38          1HB       CYS  38 -13.069  -5.335   3.490
  294   2HB   CYS  38          2HB       CYS  38 -13.712  -3.706   3.305
  295    H    ARG  39           H        ARG  39 -10.878  -5.813   4.834
  296    HA   ARG  39           HA       ARG  39  -9.056  -7.333   4.785
  297   1HB   ARG  39          1HB       ARG  39 -10.067  -7.203   1.929
  298   2HB   ARG  39          2HB       ARG  39  -9.063  -8.507   2.567
  299   1HG   ARG  39          1HG       ARG  39 -11.299  -7.991   4.336
  300   2HG   ARG  39          2HG       ARG  39 -11.877  -8.301   2.699
  301   1HD   ARG  39          1HD       ARG  39 -11.539 -10.514   3.074
  302   2HD   ARG  39          2HD       ARG  39  -9.800 -10.183   3.201
  303    HE   ARG  39           HE       ARG  39 -11.417  -9.567   5.599
  304   1HH1  ARG  39          1HH1      ARG  39 -11.428 -12.550   4.979
  305   2HH1  ARG  39          2HH1      ARG  39 -10.067 -13.091   5.904
  306   1HH2  ARG  39          1HH2      ARG  39  -8.765  -9.907   6.338
  307   2HH2  ARG  39          2HH2      ARG  39  -8.560 -11.594   6.675
  308    H    ALA  40           H        ALA  40  -8.057  -4.692   4.691
  309    HA   ALA  40           HA       ALA  40  -6.259  -4.276   2.447
  310   1HB   ALA  40          1HB       ALA  40  -6.749  -3.128   5.178
  311   2HB   ALA  40          2HB       ALA  40  -6.877  -2.349   3.603
  312   3HB   ALA  40          3HB       ALA  40  -5.292  -2.661   4.302
  313    H    LYS  41           H        LYS  41  -4.009  -4.680   2.367
  314    HA   LYS  41           HA       LYS  41  -3.010  -6.749   4.257
  315   1HB   LYS  41          1HB       LYS  41  -2.063  -5.620   1.608
  316   2HB   LYS  41          2HB       LYS  41  -1.166  -6.837   2.511
  317   1HG   LYS  41          1HG       LYS  41  -3.169  -8.315   2.449
  318   2HG   LYS  41          2HG       LYS  41  -3.996  -7.112   1.458
  319   1HD   LYS  41          1HD       LYS  41  -3.114  -8.581  -0.150
  320   2HD   LYS  41          2HD       LYS  41  -1.892  -7.309  -0.083
  321   1HE   LYS  41          1HE       LYS  41  -0.634  -8.715   1.602
  322   2HE   LYS  41          2HE       LYS  41  -1.795 -10.021   1.289
  323   1HZ   LYS  41          1HZ       LYS  41   0.422  -9.607  -0.166
  324   2HZ   LYS  41          2HZ       LYS  41  -0.702  -8.699  -1.060
  325   3HZ   LYS  41          3HZ       LYS  41  -0.974 -10.351  -0.775
  326    H    ARG  42           H        ARG  42  -0.236  -6.152   3.987
  327    HA   ARG  42           HA       ARG  42  -0.022  -3.921   5.907
  328   1HB   ARG  42          1HB       ARG  42   2.307  -5.408   4.721
  329   2HB   ARG  42          2HB       ARG  42   2.084  -4.823   6.367
  330   1HG   ARG  42          1HG       ARG  42   0.073  -6.559   6.351
  331   2HG   ARG  42          2HG       ARG  42   1.041  -7.318   5.086
  332   1HD   ARG  42          1HD       ARG  42   3.022  -7.042   6.785
  333   2HD   ARG  42          2HD       ARG  42   1.728  -6.875   7.990
  334    HE   ARG  42           HE       ARG  42   2.468  -9.331   6.658
  335   1HH1  ARG  42          1HH2      ARG  42   0.449  -8.137   8.964
  336   2HH1  ARG  42          2HH2      ARG  42  -0.894  -9.176   8.629
  337   1HH2  ARG  42          1HH1      ARG  42   0.446 -10.392   5.667
  338   2HH2  ARG  42          2HH1      ARG  42  -0.894 -10.460   6.763
  339    H    ASN  43           H        ASN  43   0.486  -4.485   2.497
  340    HA   ASN  43           HA       ASN  43   2.166  -2.072   2.179
  341   1HB   ASN  43          1HB       ASN  43   2.244  -4.370   0.910
  342   2HB   ASN  43          2HB       ASN  43   0.928  -3.683  -0.046
  343   1HD2  ASN  43          1HD2      ASN  43   3.033  -4.031  -1.634
  344   2HD2  ASN  43          2HD2      ASN  43   3.952  -2.621  -1.852
  345    H    ASN  44           H        ASN  44  -0.123  -1.241   3.303
  346    HA   ASN  44           HA       ASN  44  -1.479   0.271   1.109
  347   1HB   ASN  44          1HB       ASN  44  -2.935  -1.621   1.503
  348   2HB   ASN  44          2HB       ASN  44  -2.737  -1.492   3.248
  349   1HD2  ASN  44          1HD2      ASN  44  -5.208  -1.245   1.362
  350   2HD2  ASN  44          2HD2      ASN  44  -5.970   0.187   1.901
  351    H    PHE  45           H        PHE  45  -0.107   1.995   2.023
  352    HA   PHE  45           HA       PHE  45  -0.689   2.789   4.829
  353   1HB   PHE  45          1HB       PHE  45   1.299   3.915   2.835
  354   2HB   PHE  45          2HB       PHE  45   1.332   4.096   4.590
  355    HD1  PHE  45           1HD      PHE  45   1.770   1.728   1.779
  356    HD2  PHE  45           2HD      PHE  45   2.132   2.296   6.023
  357    HE1  PHE  45           1HE      PHE  45   3.067  -0.379   1.948
  358    HE2  PHE  45           2HE      PHE  45   3.432   0.185   6.192
  359    HZ   PHE  45           HZ       PHE  45   3.899  -1.159   4.153
  360    H    LYS  46           H        LYS  46  -1.381   4.949   5.310
  361    HA   LYS  46           HA       LYS  46  -3.301   6.061   3.426
  362   1HB   LYS  46          1HB       LYS  46  -3.563   5.970   5.897
  363   2HB   LYS  46          2HB       LYS  46  -2.200   7.075   6.069
  364   1HG   LYS  46          1HG       LYS  46  -3.406   8.831   4.912
  365   2HG   LYS  46          2HG       LYS  46  -4.718   7.723   4.504
  366   1HD   LYS  46          1HD       LYS  46  -5.672   7.951   6.548
  367   2HD   LYS  46          2HD       LYS  46  -4.122   7.800   7.376
  368   1HE   LYS  46          1HE       LYS  46  -4.219  10.309   5.938
  369   2HE   LYS  46          2HE       LYS  46  -5.624  10.167   7.015
  370   1HZ   LYS  46          1HZ       LYS  46  -4.288   9.910   8.850
  371   2HZ   LYS  46          2HZ       LYS  46  -3.309  10.950   7.930
  372   3HZ   LYS  46          3HZ       LYS  46  -2.984   9.283   7.964
  373    H    SER  47           H        SER  47   0.044   6.664   4.178
  374    HA   SER  47           HA       SER  47   0.004   8.997   2.301
  375   1HB   SER  47          1HB       SER  47   1.410  10.225   3.854
  376   2HB   SER  47          2HB       SER  47  -0.013   9.667   4.723
  377    HG   SER  47           HG       SER  47   1.143   8.071   5.664
  378    H    ALA  48           H        ALA  48   2.060   9.362   1.257
  379    HA   ALA  48           HA       ALA  48   3.478   6.984   0.500
  380   1HB   ALA  48          1HB       ALA  48   5.094   8.964  -0.302
  381   2HB   ALA  48          2HB       ALA  48   3.695   9.945   0.137
  382   3HB   ALA  48          3HB       ALA  48   3.537   8.680  -1.081
  383    H    GLU  49           H        GLU  49   3.947   9.368   3.035
  384    HA   GLU  49           HA       GLU  49   6.713   8.690   3.633
  385   1HB   GLU  49          1HB       GLU  49   5.016  10.735   4.192
  386   2HB   GLU  49          2HB       GLU  49   4.928   9.841   5.709
  387   1HG   GLU  49          1HG       GLU  49   7.618   9.799   5.239
  388   2HG   GLU  49          2HG       GLU  49   7.183  11.354   4.530
  389    H    ASP  50           H        ASP  50   3.551   7.691   4.925
  390    HA   ASP  50           HA       ASP  50   4.504   6.159   7.149
  391   1HB   ASP  50          1HB       ASP  50   2.169   6.788   6.888
  392   2HB   ASP  50          2HB       ASP  50   2.070   5.944   5.343
  393    H    CYS  51           H        CYS  51   4.098   5.477   3.729
  394    HA   CYS  51           HA       CYS  51   4.636   2.629   3.844
  395   1HB   CYS  51          1HB       CYS  51   3.439   3.814   2.021
  396   2HB   CYS  51          2HB       CYS  51   4.912   4.705   1.635
  397    H    MET  52           H        MET  52   6.585   5.551   3.163
  398    HA   MET  52           HA       MET  52   9.059   4.119   2.679
  399   1HB   MET  52          1HB       MET  52   8.019   6.749   2.532
  400   2HB   MET  52          2HB       MET  52   9.408   6.832   3.618
  401   1HG   MET  52          1HG       MET  52  10.867   6.481   1.922
  402   2HG   MET  52          2HG       MET  52   9.908   5.149   1.274
  403   1HE   MET  52          1HE       MET  52  10.665   7.329  -1.643
  404   2HE   MET  52          2HE       MET  52   9.636   5.900  -1.644
  405   3HE   MET  52          3HE       MET  52  11.063   5.946  -0.615
  406    H    ARG  53           H        ARG  53   7.879   6.000   5.509
  407    HA   ARG  53           HA       ARG  53  10.087   5.547   7.223
  408   1HB   ARG  53          1HB       ARG  53   8.059   7.052   7.537
  409   2HB   ARG  53          2HB       ARG  53   7.156   5.611   8.008
  410   1HG   ARG  53          1HG       ARG  53   9.664   5.708   9.436
  411   2HG   ARG  53          2HG       ARG  53   8.793   7.226   9.659
  412   1HD   ARG  53          1HD       ARG  53   7.243   4.667   9.893
  413   2HD   ARG  53          2HD       ARG  53   8.289   5.143  11.243
  414    HE   ARG  53           HE       ARG  53   5.978   6.703  10.185
  415   1HH1  ARG  53          1HH2      ARG  53   8.808   6.640  12.147
  416   2HH1  ARG  53          2HH2      ARG  53   8.175   7.737  13.326
  417   1HH2  ARG  53          1HH1      ARG  53   5.074   8.013  11.801
  418   2HH2  ARG  53          2HH1      ARG  53   6.064   8.517  13.130
  419    H    THR  54           H        THR  54   7.576   3.392   6.153
  420    HA   THR  54           HA       THR  54   8.172   1.376   8.252
  421    HB   THR  54           HB       THR  54   6.180   1.634   5.975
  422    HG1  THR  54           1HG      THR  54   6.156   2.603   8.310
  423   1HG2  THR  54          1HG2      THR  54   7.016  -0.748   6.402
  424   2HG2  THR  54          2HG2      THR  54   5.277  -0.485   6.521
  425   3HG2  THR  54          3HG2      THR  54   6.250  -0.614   7.985
  426    H    CYS  55           H        CYS  55   8.257   1.710   4.702
  427    HA   CYS  55           HA       CYS  55  10.109  -0.648   4.592
  428   1HB   CYS  55          1HB       CYS  55   8.253   0.517   2.494
  429   2HB   CYS  55          2HB       CYS  55   9.149  -0.998   2.371
  430    H    GLY  56           H        GLY  56  11.020   2.083   5.108
  431   1HA   GLY  56          1HA       GLY  56  12.138   2.987   2.520
  432   2HA   GLY  56          2HA       GLY  56  12.272   3.846   4.057
  433    H    GLY  57           H        GLY  57  12.942   0.428   3.909
  434   1HA   GLY  57          1HA       GLY  57  15.423   0.510   5.162
  435   2HA   GLY  57          2HA       GLY  57  14.964  -0.765   4.034
  436    H    ALA  58           H        ALA  58  15.155  -0.026   1.632
  437    HA   ALA  58           HA       ALA  58  17.888   1.020   1.268
  438   1HB   ALA  58          1HB       ALA  58  17.278  -0.934   0.043
  439   2HB   ALA  58          2HB       ALA  58  17.270   0.371  -1.144
  440   3HB   ALA  58          3HB       ALA  58  15.749  -0.221  -0.474
  Start of MODEL   13
    1   1H    ARG   1          1H        ARG   1  15.107  -4.158   5.929
    2   2H    ARG   1          2H        ARG   1  15.687  -2.785   5.115
    3   3H    ARG   1          3H        ARG   1  15.621  -4.282   4.317
    4    HA   ARG   1           HA       ARG   1  13.343  -2.563   5.137
    5   1HB   ARG   1          1HB       ARG   1  14.082  -1.826   3.075
    6   2HB   ARG   1          2HB       ARG   1  14.804  -3.378   2.662
    7   1HG   ARG   1          1HG       ARG   1  12.555  -4.317   2.261
    8   2HG   ARG   1          2HG       ARG   1  11.831  -2.768   2.685
    9   1HD   ARG   1          1HD       ARG   1  11.937  -2.548   0.365
   10   2HD   ARG   1          2HD       ARG   1  13.524  -1.887   0.803
   11    HE   ARG   1           HE       ARG   1  13.050  -4.420  -0.546
   12   1HH1  ARG   1          1HH2      ARG   1  15.523  -2.509  -0.413
   13   2HH1  ARG   1          2HH2      ARG   1  16.698  -3.597   0.247
   14   1HH2  ARG   1          1HH1      ARG   1  14.347  -5.947   1.241
   15   2HH2  ARG   1          2HH1      ARG   1  16.031  -5.546   1.185
   16    HA   PRO   2           HA       PRO   2  11.010  -6.247   5.735
   17   1HB   PRO   2          1HB       PRO   2   8.531  -5.283   5.057
   18   2HB   PRO   2          2HB       PRO   2   9.325  -4.931   6.602
   19   1HG   PRO   2          1HG       PRO   2   9.159  -3.279   4.111
   20   2HG   PRO   2          2HG       PRO   2   8.987  -2.778   5.803
   21   1HD   PRO   2          1HD       PRO   2  11.268  -2.395   4.386
   22   2HD   PRO   2          2HD       PRO   2  11.274  -2.711   6.136
   23    H    ASP   3           H        ASP   3   9.650  -7.769   4.477
   24    HA   ASP   3           HA       ASP   3  10.211  -7.534   1.552
   25   1HB   ASP   3          1HB       ASP   3   9.732 -10.061   1.724
   26   2HB   ASP   3          2HB       ASP   3  11.191  -9.477   2.524
   27    H    PHE   4           H        PHE   4   7.656  -7.459   3.878
   28    HA   PHE   4           HA       PHE   4   5.530  -8.530   2.254
   29   1HB   PHE   4          1HB       PHE   4   4.092  -7.438   3.905
   30   2HB   PHE   4          2HB       PHE   4   5.470  -8.181   4.712
   31    HD1  PHE   4           1HD      PHE   4   6.800  -6.913   6.159
   32    HD2  PHE   4           2HD      PHE   4   4.310  -4.903   3.288
   33    HE1  PHE   4           1HE      PHE   4   7.316  -4.727   7.214
   34    HE2  PHE   4           2HE      PHE   4   4.807  -2.776   4.323
   35    HZ   PHE   4           HZ       PHE   4   6.330  -2.648   6.294
   36    H    CYS   5           H        CYS   5   7.301  -5.583   2.082
   37    HA   CYS   5           HA       CYS   5   5.196  -4.080   0.670
   38   1HB   CYS   5          1HB       CYS   5   7.870  -3.667   1.823
   39   2HB   CYS   5          2HB       CYS   5   7.589  -2.759   0.337
   40    H    LEU   6           H        LEU   6   7.441  -6.482  -0.134
   41    HA   LEU   6           HA       LEU   6   8.165  -5.560  -2.804
   42   1HB   LEU   6          1HB       LEU   6   8.181  -8.365  -1.644
   43   2HB   LEU   6          2HB       LEU   6   9.200  -7.740  -2.942
   44    HG   LEU   6           HG       LEU   6   9.241  -6.866  -0.036
   45   1HD1  LEU   6          1HD1      LEU   6  10.918  -8.656  -1.742
   46   2HD1  LEU   6          2HD1      LEU   6  10.505  -8.797  -0.034
   47   3HD1  LEU   6          3HD1      LEU   6  11.742  -7.649  -0.550
   48   1HD2  LEU   6          1HD2      LEU   6  11.265  -5.538  -0.867
   49   2HD2  LEU   6          2HD2      LEU   6   9.687  -4.921  -1.355
   50   3HD2  LEU   6          3HD2      LEU   6  10.668  -5.837  -2.498
   51    H    GLU   7           H        GLU   7   5.483  -7.279  -1.383
   52    HA   GLU   7           HA       GLU   7   4.536  -8.449  -3.901
   53   1HB   GLU   7          1HB       GLU   7   3.939  -8.483  -1.038
   54   2HB   GLU   7          2HB       GLU   7   2.475  -8.446  -2.021
   55   1HG   GLU   7          1HG       GLU   7   2.973 -10.474  -3.066
   56   2HG   GLU   7          2HG       GLU   7   4.702 -10.323  -2.757
   57    HA   PRO   8           HA       PRO   8   1.906  -5.191  -5.219
   58   1HB   PRO   8          1HB       PRO   8  -0.463  -6.440  -5.784
   59   2HB   PRO   8          2HB       PRO   8   0.994  -6.631  -6.780
   60   1HG   PRO   8          1HG       PRO   8  -0.171  -8.448  -4.726
   61   2HG   PRO   8          2HG       PRO   8   0.622  -8.839  -6.259
   62   1HD   PRO   8          1HD       PRO   8   1.820  -9.011  -3.785
   63   2HD   PRO   8          2HD       PRO   8   2.701  -8.803  -5.314
   64    HA   PRO   9           HA       PRO   9  -0.600  -3.706  -1.931
   65   1HB   PRO   9          1HB       PRO   9  -2.478  -2.213  -3.262
   66   2HB   PRO   9          2HB       PRO   9  -0.794  -1.696  -3.052
   67   1HG   PRO   9          1HG       PRO   9  -2.143  -2.909  -5.415
   68   2HG   PRO   9          2HG       PRO   9  -0.901  -1.649  -5.345
   69   1HD   PRO   9          1HD       PRO   9  -0.405  -4.277  -5.967
   70   2HD   PRO   9          2HD       PRO   9   0.802  -3.176  -5.271
   71    H    TYR  10           H        TYR  10  -3.188  -3.414  -1.453
   72    HA   TYR  10           HA       TYR  10  -4.533  -5.940  -2.382
   73   1HB   TYR  10          1HB       TYR  10  -3.528  -6.024  -0.087
   74   2HB   TYR  10          2HB       TYR  10  -4.561  -4.672   0.375
   75    HD1  TYR  10           1HD      TYR  10  -6.898  -4.978   0.823
   76    HD2  TYR  10           2HD      TYR  10  -4.546  -8.210  -0.749
   77    HE1  TYR  10           1HE      TYR  10  -8.753  -6.555   1.291
   78    HE2  TYR  10           2HE      TYR  10  -6.402  -9.788  -0.283
   79    HH   TYR  10           HH       TYR  10  -8.347  -9.985   1.077
   80    H    THR  11           H        THR  11  -5.858  -4.827  -3.873
   81    HA   THR  11           HA       THR  11  -7.382  -2.462  -3.257
   82    HB   THR  11           HB       THR  11  -7.427  -4.684  -5.293
   83    HG1  THR  11           1HG      THR  11  -7.423  -2.492  -6.505
   84   1HG2  THR  11          1HG2      THR  11  -9.731  -4.422  -5.241
   85   2HG2  THR  11          2HG2      THR  11  -9.293  -3.135  -6.364
   86   3HG2  THR  11          3HG2      THR  11  -9.631  -2.754  -4.676
   87    H    GLY  12           H        GLY  12  -7.689  -5.837  -2.522
   88   1HA   GLY  12          1HA       GLY  12  -9.295  -7.023  -1.281
   89   2HA   GLY  12          2HA       GLY  12  -9.760  -5.464  -0.598
   90    HA   PRO  13           HA       PRO  13 -12.830  -7.107  -3.851
   91   1HB   PRO  13          1HB       PRO  13 -14.494  -8.637  -2.306
   92   2HB   PRO  13          2HB       PRO  13 -13.102  -9.300  -3.187
   93   1HG   PRO  13          1HG       PRO  13 -13.393  -8.614  -0.303
   94   2HG   PRO  13          2HG       PRO  13 -12.526  -9.958  -1.062
   95   1HD   PRO  13          1HD       PRO  13 -11.335  -7.667  -0.096
   96   2HD   PRO  13          2HD       PRO  13 -10.632  -8.713  -1.351
   97    H    CYS  14           H        CYS  14 -13.243  -4.750  -3.488
   98    HA   CYS  14           HA       CYS  14 -15.788  -4.349  -1.997
   99   1HB   CYS  14          1HB       CYS  14 -13.099  -3.243  -1.384
  100   2HB   CYS  14          2HB       CYS  14 -14.432  -2.089  -1.322
  101    H    LYS  15           H        LYS  15 -16.540  -1.957  -2.481
  102    HA   LYS  15           HA       LYS  15 -16.080  -1.463  -5.399
  103   1HB   LYS  15          1HB       LYS  15 -18.365  -0.808  -3.510
  104   2HB   LYS  15          2HB       LYS  15 -18.328  -0.361  -5.216
  105   1HG   LYS  15          1HG       LYS  15 -18.719  -2.504  -5.918
  106   2HG   LYS  15          2HG       LYS  15 -17.770  -3.214  -4.613
  107   1HD   LYS  15          1HD       LYS  15 -19.813  -3.792  -3.776
  108   2HD   LYS  15          2HD       LYS  15 -19.842  -2.122  -3.209
  109   1HE   LYS  15          1HE       LYS  15 -20.782  -2.716  -6.004
  110   2HE   LYS  15          2HE       LYS  15 -21.866  -3.046  -4.637
  111   1HZ   LYS  15          1HZ       LYS  15 -20.668  -0.494  -5.507
  112   2HZ   LYS  15          2HZ       LYS  15 -21.040  -0.720  -3.864
  113   3HZ   LYS  15          3HZ       LYS  15 -22.265  -0.819  -5.035
  114    H    ALA  16           H        ALA  16 -15.151  -0.288  -2.423
  115    HA   ALA  16           HA       ALA  16 -15.487   2.556  -2.739
  116   1HB   ALA  16          1HB       ALA  16 -14.767   2.326  -0.611
  117   2HB   ALA  16          2HB       ALA  16 -13.160   1.929  -1.218
  118   3HB   ALA  16          3HB       ALA  16 -14.334   0.646  -0.926
  119    H    ARG  17           H        ARG  17 -13.709   4.091  -3.211
  120    HA   ARG  17           HA       ARG  17 -11.547   2.964  -4.947
  121   1HB   ARG  17          1HB       ARG  17 -13.822   4.717  -5.592
  122   2HB   ARG  17          2HB       ARG  17 -12.271   5.355  -6.135
  123   1HG   ARG  17          1HG       ARG  17 -12.924   2.467  -6.634
  124   2HG   ARG  17          2HG       ARG  17 -13.632   3.701  -7.678
  125   1HD   ARG  17          1HD       ARG  17 -10.933   4.442  -7.455
  126   2HD   ARG  17          2HD       ARG  17 -10.904   2.677  -7.644
  127    HE   ARG  17           HE       ARG  17 -12.151   2.946  -9.730
  128   1HH1  ARG  17          1HH1      ARG  17  -9.908   4.893 -10.131
  129   2HH1  ARG  17          2HH1      ARG  17 -10.752   6.319 -10.637
  130   1HH2  ARG  17          1HH2      ARG  17 -13.843   5.205  -9.529
  131   2HH2  ARG  17          2HH2      ARG  17 -12.979   6.496 -10.295
  132    H    ILE  18           H        ILE  18 -10.562   3.469  -2.660
  133    HA   ILE  18           HA       ILE  18  -9.957   6.359  -2.297
  134    HB   ILE  18           HB       ILE  18  -9.220   3.929  -0.635
  135   1HG1  ILE  18          1HG1      ILE  18 -11.574   5.824  -0.354
  136   2HG1  ILE  18          2HG1      ILE  18 -11.679   4.166  -0.946
  137   1HG2  ILE  18          1HG2      ILE  18  -9.600   6.693   0.444
  138   2HG2  ILE  18          2HG2      ILE  18  -8.109   6.340  -0.429
  139   3HG2  ILE  18          3HG2      ILE  18  -8.531   5.408   1.007
  140   1HD1  ILE  18          1HD1      ILE  18 -12.136   3.783   1.283
  141   2HD1  ILE  18          2HD1      ILE  18 -11.193   5.172   1.823
  142   3HD1  ILE  18          3HD1      ILE  18 -10.375   3.683   1.345
  143    H    ILE  19           H        ILE  19  -7.746   7.089  -2.217
  144    HA   ILE  19           HA       ILE  19  -5.908   5.468  -3.903
  145    HB   ILE  19           HB       ILE  19  -5.831   8.346  -2.940
  146   1HG1  ILE  19          1HG1      ILE  19  -7.775   7.701  -4.427
  147   2HG1  ILE  19          2HG1      ILE  19  -6.707   8.924  -5.118
  148   1HG2  ILE  19          1HG2      ILE  19  -4.343   8.322  -5.173
  149   2HG2  ILE  19          2HG2      ILE  19  -4.059   6.663  -4.646
  150   3HG2  ILE  19          3HG2      ILE  19  -3.646   8.009  -3.584
  151   1HD1  ILE  19          1HD1      ILE  19  -5.808   7.449  -6.672
  152   2HD1  ILE  19          2HD1      ILE  19  -7.449   6.817  -6.548
  153   3HD1  ILE  19          3HD1      ILE  19  -6.134   6.033  -5.673
  154    H    ARG  20           H        ARG  20  -5.270   3.968  -2.173
  155    HA   ARG  20           HA       ARG  20  -3.942   5.068   0.219
  156   1HB   ARG  20          1HB       ARG  20  -4.623   2.354  -0.900
  157   2HB   ARG  20          2HB       ARG  20  -3.535   2.500   0.481
  158   1HG   ARG  20          1HG       ARG  20  -6.285   3.770   0.374
  159   2HG   ARG  20          2HG       ARG  20  -5.970   2.192   1.096
  160   1HD   ARG  20          1HD       ARG  20  -4.863   3.107   2.911
  161   2HD   ARG  20          2HD       ARG  20  -4.236   4.472   1.967
  162    HE   ARG  20           HE       ARG  20  -7.142   4.247   2.682
  163   1HH1  ARG  20          1HH1      ARG  20  -5.008   6.271   1.185
  164   2HH1  ARG  20          2HH1      ARG  20  -5.304   7.654   2.184
  165   1HH2  ARG  20          1HH2      ARG  20  -7.180   5.903   4.515
  166   2HH2  ARG  20          2HH2      ARG  20  -6.532   7.446   4.069
  167    H    TYR  21           H        TYR  21  -1.683   4.038   0.718
  168    HA   TYR  21           HA       TYR  21  -0.004   4.284  -1.754
  169   1HB   TYR  21          1HB       TYR  21   0.396   4.963   1.161
  170   2HB   TYR  21          2HB       TYR  21   1.756   4.864   0.042
  171    HD1  TYR  21           1HD      TYR  21  -1.366   6.645   0.861
  172    HD2  TYR  21           2HD      TYR  21   2.069   6.501  -1.711
  173    HE1  TYR  21           1HE      TYR  21  -1.887   8.931   0.043
  174    HE2  TYR  21           2HE      TYR  21   1.549   8.784  -2.536
  175    HH   TYR  21           HH       TYR  21  -0.372  10.282  -2.709
  176    H    PHE  22           H        PHE  22   1.735   2.822  -2.023
  177    HA   PHE  22           HA       PHE  22   2.059   0.596  -0.097
  178   1HB   PHE  22          1HB       PHE  22   1.325  -1.067  -1.592
  179   2HB   PHE  22          2HB       PHE  22   0.169   0.225  -1.859
  180    HD1  PHE  22           1HD      PHE  22   3.100  -1.539  -3.230
  181    HD2  PHE  22           2HD      PHE  22   0.170   1.528  -3.914
  182    HE1  PHE  22           1HE      PHE  22   3.740  -1.461  -5.626
  183    HE2  PHE  22           2HE      PHE  22   0.811   1.606  -6.309
  184    HZ   PHE  22           HZ       PHE  22   2.595   0.111  -7.165
  185    H    TYR  23           H        TYR  23   3.983  -0.744  -0.733
  186    HA   TYR  23           HA       TYR  23   6.098   1.005  -1.829
  187   1HB   TYR  23          1HB       TYR  23   6.338  -0.377   0.241
  188   2HB   TYR  23          2HB       TYR  23   6.195  -1.833  -0.749
  189    HD1  TYR  23           1HD      TYR  23   8.117  -2.755  -1.738
  190    HD2  TYR  23           2HD      TYR  23   8.150   1.354  -0.484
  191    HE1  TYR  23           1HE      TYR  23  10.521  -2.594  -2.326
  192    HE2  TYR  23           2HE      TYR  23  10.556   1.515  -1.071
  193    HH   TYR  23           HH       TYR  23  12.515  -0.201  -1.267
  194    H    ASN  24           H        ASN  24   6.925   0.801  -3.895
  195    HA   ASN  24           HA       ASN  24   5.926  -1.448  -5.592
  196   1HB   ASN  24          1HB       ASN  24   5.527   0.909  -6.276
  197   2HB   ASN  24          2HB       ASN  24   7.266   1.190  -6.281
  198   1HD2  ASN  24          1HD2      ASN  24   4.910   0.810  -8.449
  199   2HD2  ASN  24          2HD2      ASN  24   5.691  -0.125  -9.631
  200    H    ALA  25           H        ALA  25   7.513  -3.022  -4.789
  201    HA   ALA  25           HA       ALA  25  10.257  -2.760  -4.490
  202   1HB   ALA  25          1HB       ALA  25  10.160  -5.174  -5.616
  203   2HB   ALA  25          2HB       ALA  25   8.421  -4.897  -5.515
  204   3HB   ALA  25          3HB       ALA  25   9.403  -4.881  -4.051
  205    H    LYS  26           H        LYS  26   8.424  -2.838  -7.506
  206    HA   LYS  26           HA       LYS  26  10.728  -3.074  -9.254
  207   1HB   LYS  26          1HB       LYS  26   7.805  -2.511  -9.425
  208   2HB   LYS  26          2HB       LYS  26   8.793  -1.998 -10.794
  209   1HG   LYS  26          1HG       LYS  26   8.833  -4.125 -11.531
  210   2HG   LYS  26          2HG       LYS  26   9.665  -4.605 -10.050
  211   1HD   LYS  26          1HD       LYS  26   7.523  -4.924  -8.915
  212   2HD   LYS  26          2HD       LYS  26   6.655  -4.338 -10.335
  213   1HE   LYS  26          1HE       LYS  26   6.770  -6.880 -10.123
  214   2HE   LYS  26          2HE       LYS  26   7.410  -6.243 -11.650
  215   1HZ   LYS  26          1HZ       LYS  26   8.858  -7.866 -10.287
  216   2HZ   LYS  26          2HZ       LYS  26   9.142  -6.535  -9.270
  217   3HZ   LYS  26          3HZ       LYS  26   9.588  -6.467 -10.909
  218    H    ALA  27           H        ALA  27   9.133  -0.430  -7.602
  219    HA   ALA  27           HA       ALA  27  10.594   1.588  -9.239
  220   1HB   ALA  27          1HB       ALA  27   8.749   2.145  -6.927
  221   2HB   ALA  27          2HB       ALA  27   8.085   1.594  -8.465
  222   3HB   ALA  27          3HB       ALA  27   9.007   3.096  -8.389
  223    H    GLY  28           H        GLY  28  10.425   0.262  -5.958
  224   1HA   GLY  28          1HA       GLY  28  12.398   0.194  -4.530
  225   2HA   GLY  28          2HA       GLY  28  13.009   1.620  -5.367
  226    H    LEU  29           H        LEU  29   9.982   2.514  -5.072
  227    HA   LEU  29           HA       LEU  29  10.230   3.474  -2.249
  228   1HB   LEU  29          1HB       LEU  29   9.029   5.078  -4.506
  229   2HB   LEU  29          2HB       LEU  29   9.696   5.658  -2.982
  230    HG   LEU  29           HG       LEU  29  11.918   4.537  -3.955
  231   1HD1  LEU  29          1HD1      LEU  29  11.968   4.175  -6.200
  232   2HD1  LEU  29          2HD1      LEU  29  10.997   5.609  -6.541
  233   3HD1  LEU  29          3HD1      LEU  29  10.210   4.103  -6.068
  234   1HD2  LEU  29          1HD2      LEU  29  12.644   6.700  -4.309
  235   2HD2  LEU  29          2HD2      LEU  29  11.126   7.057  -3.484
  236   3HD2  LEU  29          3HD2      LEU  29  11.214   7.137  -5.244
  237    H    CYS  30           H        CYS  30   7.680   4.983  -2.800
  238    HA   CYS  30           HA       CYS  30   5.793   2.651  -2.755
  239   1HB   CYS  30          1HB       CYS  30   5.872   5.237  -1.176
  240   2HB   CYS  30          2HB       CYS  30   4.488   4.145  -1.173
  241    H    GLN  31           H        GLN  31   3.646   3.108  -3.592
  242    HA   GLN  31           HA       GLN  31   3.378   5.596  -5.219
  243   1HB   GLN  31          1HB       GLN  31   2.905   2.754  -6.182
  244   2HB   GLN  31          2HB       GLN  31   2.713   4.220  -7.144
  245   1HG   GLN  31          1HG       GLN  31   5.272   4.504  -6.167
  246   2HG   GLN  31          2HG       GLN  31   5.164   2.759  -6.411
  247   1HE2  GLN  31          1HE2      GLN  31   6.701   3.035  -8.262
  248   2HE2  GLN  31          2HE2      GLN  31   6.128   3.613  -9.752
  249    H    THR  32           H        THR  32   0.955   5.384  -6.251
  250    HA   THR  32           HA       THR  32  -0.805   4.849  -3.902
  251    HB   THR  32           HB       THR  32  -2.368   6.300  -5.319
  252    HG1  THR  32           1HG      THR  32  -0.718   7.522  -6.812
  253   1HG2  THR  32          1HG2      THR  32  -1.091   7.248  -3.469
  254   2HG2  THR  32          2HG2      THR  32  -1.090   8.379  -4.823
  255   3HG2  THR  32          3HG2      THR  32   0.336   7.392  -4.495
  256    H    PHE  33           H        PHE  33  -2.589   3.469  -4.089
  257    HA   PHE  33           HA       PHE  33  -3.102   2.177  -6.726
  258   1HB   PHE  33          1HB       PHE  33  -2.778  -0.003  -5.855
  259   2HB   PHE  33          2HB       PHE  33  -1.429   0.922  -5.213
  260    HD1  PHE  33           1HD      PHE  33  -1.447   1.695  -2.828
  261    HD2  PHE  33           2HD      PHE  33  -4.492  -0.886  -4.424
  262    HE1  PHE  33           1HE      PHE  33  -2.151   1.107  -0.532
  263    HE2  PHE  33           2HE      PHE  33  -5.192  -1.478  -2.121
  264    HZ   PHE  33           HZ       PHE  33  -4.023  -0.483  -0.173
  265    H    VAL  34           H        VAL  34  -5.214   1.067  -6.750
  266    HA   VAL  34           HA       VAL  34  -7.248   2.614  -5.366
  267    HB   VAL  34           HB       VAL  34  -7.213   0.216  -7.206
  268   1HG1  VAL  34          1HG1      VAL  34  -9.652   1.697  -6.170
  269   2HG1  VAL  34          2HG1      VAL  34  -9.165   0.085  -5.643
  270   3HG1  VAL  34          3HG1      VAL  34  -9.646   0.357  -7.318
  271   1HG2  VAL  34          1HG2      VAL  34  -6.687   2.652  -7.927
  272   2HG2  VAL  34          2HG2      VAL  34  -8.406   2.952  -7.664
  273   3HG2  VAL  34          3HG2      VAL  34  -7.890   1.766  -8.863
  274    H    TYR  35           H        TYR  35  -7.518   2.254  -3.196
  275    HA   TYR  35           HA       TYR  35  -7.224  -0.447  -2.044
  276   1HB   TYR  35          1HB       TYR  35  -6.345   1.522  -0.899
  277   2HB   TYR  35          2HB       TYR  35  -7.931   2.291  -0.936
  278    HD1  TYR  35           1HD      TYR  35  -7.363  -1.313  -0.309
  279    HD2  TYR  35           2HD      TYR  35  -8.250   2.507   1.445
  280    HE1  TYR  35           1HE      TYR  35  -7.945  -2.428   1.827
  281    HE2  TYR  35           2HE      TYR  35  -8.832   1.390   3.582
  282    HH   TYR  35           HH       TYR  35  -9.387  -1.905   3.838
  283    H    GLY  36           H        GLY  36  -8.987  -1.645  -1.166
  284   1HA   GLY  36          1HA       GLY  36 -11.625  -0.980  -2.282
  285   2HA   GLY  36          2HA       GLY  36 -11.208  -2.465  -1.429
  286    H    ALA  37           H        ALA  37  -9.996  -0.142   0.515
  287    HA   ALA  37           HA       ALA  37 -10.798   0.990   2.443
  288   1HB   ALA  37          1HB       ALA  37 -12.550   1.629   0.598
  289   2HB   ALA  37          2HB       ALA  37 -12.953   1.903   2.294
  290   3HB   ALA  37          3HB       ALA  37 -13.594   0.491   1.452
  291    H    CYS  38           H        CYS  38 -10.965  -2.154   1.842
  292    HA   CYS  38           HA       CYS  38 -12.021  -2.786   4.546
  293   1HB   CYS  38          1HB       CYS  38 -13.506  -4.523   3.570
  294   2HB   CYS  38          2HB       CYS  38 -13.937  -2.911   2.998
  295    H    ARG  39           H        ARG  39 -11.444  -5.047   5.170
  296    HA   ARG  39           HA       ARG  39  -9.678  -6.611   5.465
  297   1HB   ARG  39          1HB       ARG  39 -10.785  -6.711   2.695
  298   2HB   ARG  39          2HB       ARG  39  -9.360  -7.696   3.027
  299   1HG   ARG  39          1HG       ARG  39 -10.548  -9.159   4.280
  300   2HG   ARG  39          2HG       ARG  39 -11.374  -7.864   5.148
  301   1HD   ARG  39          1HD       ARG  39 -12.721  -7.559   2.925
  302   2HD   ARG  39          2HD       ARG  39 -12.149  -9.197   2.553
  303    HE   ARG  39           HE       ARG  39 -13.882  -8.436   4.856
  304   1HH1  ARG  39          1HH1      ARG  39 -11.561 -10.683   4.781
  305   2HH1  ARG  39          2HH1      ARG  39 -12.583 -12.081   4.746
  306   1HH2  ARG  39          1HH2      ARG  39 -15.467 -10.283   4.060
  307   2HH2  ARG  39          2HH2      ARG  39 -14.793 -11.854   4.338
  308    H    ALA  40           H        ALA  40  -8.602  -3.997   5.215
  309    HA   ALA  40           HA       ALA  40  -6.635  -3.691   3.166
  310   1HB   ALA  40          1HB       ALA  40  -6.450  -1.733   4.277
  311   2HB   ALA  40          2HB       ALA  40  -5.845  -2.564   5.711
  312   3HB   ALA  40          3HB       ALA  40  -7.581  -2.362   5.474
  313    H    LYS  41           H        LYS  41  -4.323  -4.042   3.301
  314    HA   LYS  41           HA       LYS  41  -3.521  -6.183   5.248
  315   1HB   LYS  41          1HB       LYS  41  -2.766  -5.697   2.345
  316   2HB   LYS  41          2HB       LYS  41  -2.034  -6.940   3.362
  317   1HG   LYS  41          1HG       LYS  41  -4.578  -7.586   3.797
  318   2HG   LYS  41          2HG       LYS  41  -4.809  -6.786   2.243
  319   1HD   LYS  41          1HD       LYS  41  -4.347  -8.930   1.508
  320   2HD   LYS  41          2HD       LYS  41  -2.706  -8.289   1.576
  321   1HE   LYS  41          1HE       LYS  41  -2.215  -9.988   3.007
  322   2HE   LYS  41          2HE       LYS  41  -3.277  -9.203   4.193
  323   1HZ   LYS  41          1HZ       LYS  41  -3.981 -11.495   3.626
  324   2HZ   LYS  41          2HZ       LYS  41  -4.193 -11.012   2.010
  325   3HZ   LYS  41          3HZ       LYS  41  -5.158 -10.338   3.235
  326    H    ARG  42           H        ARG  42  -0.740  -6.081   4.479
  327    HA   ARG  42           HA       ARG  42   0.052  -3.675   5.970
  328   1HB   ARG  42          1HB       ARG  42   1.940  -4.899   6.367
  329   2HB   ARG  42          2HB       ARG  42   0.970  -6.233   5.822
  330   1HG   ARG  42          1HG       ARG  42   2.727  -4.597   4.043
  331   2HG   ARG  42          2HG       ARG  42   3.200  -6.124   4.782
  332   1HD   ARG  42          1HD       ARG  42   0.656  -6.111   3.259
  333   2HD   ARG  42          2HD       ARG  42   2.164  -6.012   2.335
  334    HE   ARG  42           HE       ARG  42   2.387  -8.007   4.402
  335   1HH1  ARG  42          1HH1      ARG  42   2.081  -7.527   1.102
  336   2HH1  ARG  42          2HH1      ARG  42   1.458  -9.105   0.747
  337   1HH2  ARG  42          1HH2      ARG  42   1.063  -9.988   4.077
  338   2HH2  ARG  42          2HH2      ARG  42   0.883 -10.499   2.432
  339    H    ASN  43           H        ASN  43  -0.137  -4.703   2.687
  340    HA   ASN  43           HA       ASN  43   1.698  -2.616   1.684
  341   1HB   ASN  43          1HB       ASN  43   1.127  -5.115   0.864
  342   2HB   ASN  43          2HB       ASN  43  -0.088  -4.249  -0.076
  343   1HD2  ASN  43          1HD2      ASN  43   3.419  -4.512   0.502
  344   2HD2  ASN  43          2HD2      ASN  43   3.885  -3.754  -0.943
  345    H    ASN  44           H        ASN  44  -0.238  -1.355   3.050
  346    HA   ASN  44           HA       ASN  44  -1.748   0.090   0.965
  347   1HB   ASN  44          1HB       ASN  44  -3.215  -1.781   1.465
  348   2HB   ASN  44          2HB       ASN  44  -2.988  -1.556   3.198
  349   1HD2  ASN  44          1HD2      ASN  44  -5.581  -1.516   1.941
  350   2HD2  ASN  44          2HD2      ASN  44  -6.223   0.055   2.122
  351    H    PHE  45           H        PHE  45  -0.073   1.611   1.930
  352    HA   PHE  45           HA       PHE  45  -0.542   2.501   4.701
  353   1HB   PHE  45          1HB       PHE  45   1.276   3.658   2.567
  354   2HB   PHE  45          2HB       PHE  45   1.471   3.757   4.318
  355    HD1  PHE  45           1HD      PHE  45   2.105   1.793   1.336
  356    HD2  PHE  45           2HD      PHE  45   1.907   1.596   5.625
  357    HE1  PHE  45           1HE      PHE  45   3.370  -0.345   1.294
  358    HE2  PHE  45           2HE      PHE  45   3.174  -0.540   5.585
  359    HZ   PHE  45           HZ       PHE  45   3.904  -1.532   3.419
  360    H    LYS  46           H        LYS  46  -1.732   4.303   5.238
  361    HA   LYS  46           HA       LYS  46  -3.537   5.495   3.364
  362   1HB   LYS  46          1HB       LYS  46  -2.616   6.539   6.056
  363   2HB   LYS  46          2HB       LYS  46  -4.170   6.838   5.277
  364   1HG   LYS  46          1HG       LYS  46  -4.077   4.094   5.290
  365   2HG   LYS  46          2HG       LYS  46  -3.244   4.483   6.795
  366   1HD   LYS  46          1HD       LYS  46  -5.135   5.312   7.769
  367   2HD   LYS  46          2HD       LYS  46  -5.701   6.051   6.270
  368   1HE   LYS  46          1HE       LYS  46  -7.108   4.301   5.940
  369   2HE   LYS  46          2HE       LYS  46  -5.734   3.177   5.982
  370   1HZ   LYS  46          1HZ       LYS  46  -7.611   3.195   7.849
  371   2HZ   LYS  46          2HZ       LYS  46  -6.583   4.375   8.511
  372   3HZ   LYS  46          3HZ       LYS  46  -5.997   2.812   8.200
  373    H    SER  47           H        SER  47  -0.237   6.239   4.096
  374    HA   SER  47           HA       SER  47  -0.451   8.664   2.369
  375   1HB   SER  47          1HB       SER  47   0.821   9.951   4.011
  376   2HB   SER  47          2HB       SER  47  -0.622   9.295   4.776
  377    HG   SER  47           HG       SER  47   0.768   8.550   6.161
  378    H    ALA  48           H        ALA  48   1.628   9.279   1.439
  379    HA   ALA  48           HA       ALA  48   3.268   7.060   0.638
  380   1HB   ALA  48          1HB       ALA  48   4.518   9.697   0.472
  381   2HB   ALA  48          2HB       ALA  48   2.833   9.742  -0.050
  382   3HB   ALA  48          3HB       ALA  48   3.970   8.644  -0.833
  383    H    GLU  49           H        GLU  49   3.432   9.385   3.256
  384    HA   GLU  49           HA       GLU  49   6.189   8.833   4.014
  385   1HB   GLU  49          1HB       GLU  49   3.849  10.054   5.518
  386   2HB   GLU  49          2HB       GLU  49   5.548  10.207   5.965
  387   1HG   GLU  49          1HG       GLU  49   5.739  11.977   4.586
  388   2HG   GLU  49          2HG       GLU  49   5.308  10.948   3.221
  389    H    ASP  50           H        ASP  50   3.058   7.432   4.695
  390    HA   ASP  50           HA       ASP  50   3.905   5.968   7.080
  391   1HB   ASP  50          1HB       ASP  50   1.572   6.733   6.533
  392   2HB   ASP  50          2HB       ASP  50   1.541   5.559   5.217
  393    H    CYS  51           H        CYS  51   3.750   5.391   3.611
  394    HA   CYS  51           HA       CYS  51   4.260   2.507   3.799
  395   1HB   CYS  51          1HB       CYS  51   3.038   3.499   1.924
  396   2HB   CYS  51          2HB       CYS  51   4.406   4.548   1.549
  397    H    MET  52           H        MET  52   6.143   5.432   2.998
  398    HA   MET  52           HA       MET  52   8.638   4.093   2.503
  399   1HB   MET  52          1HB       MET  52   7.912   6.902   3.389
  400   2HB   MET  52          2HB       MET  52   9.521   6.427   2.844
  401   1HG   MET  52          1HG       MET  52   6.954   6.257   1.231
  402   2HG   MET  52          2HG       MET  52   8.272   7.402   0.976
  403   1HE   MET  52          1HE       MET  52  10.461   6.936   0.685
  404   2HE   MET  52          2HE       MET  52  10.250   6.661  -1.042
  405   3HE   MET  52          3HE       MET  52  11.218   5.539  -0.089
  406    H    ARG  53           H        ARG  53   7.413   5.795   5.422
  407    HA   ARG  53           HA       ARG  53   9.686   5.246   7.068
  408   1HB   ARG  53          1HB       ARG  53   8.312   6.103   8.791
  409   2HB   ARG  53          2HB       ARG  53   7.647   6.848   7.340
  410   1HG   ARG  53          1HG       ARG  53   5.656   6.004   8.014
  411   2HG   ARG  53          2HG       ARG  53   6.279   4.439   7.493
  412   1HD   ARG  53          1HD       ARG  53   6.288   3.714   9.642
  413   2HD   ARG  53          2HD       ARG  53   7.319   5.077  10.119
  414    HE   ARG  53           HE       ARG  53   4.512   5.798   9.649
  415   1HH1  ARG  53          1HH1      ARG  53   6.667   4.329  11.888
  416   2HH1  ARG  53          2HH1      ARG  53   5.908   5.019  13.283
  417   1HH2  ARG  53          1HH2      ARG  53   3.614   6.863  11.450
  418   2HH2  ARG  53          2HH2      ARG  53   4.181   6.456  13.036
  419    H    THR  54           H        THR  54   7.230   3.173   5.869
  420    HA   THR  54           HA       THR  54   7.498   1.199   8.061
  421    HB   THR  54           HB       THR  54   5.906   1.322   5.474
  422    HG1  THR  54           1HG      THR  54   5.046   2.694   6.935
  423   1HG2  THR  54          1HG2      THR  54   6.358  -0.849   7.437
  424   2HG2  THR  54          2HG2      THR  54   5.900  -0.936   5.736
  425   3HG2  THR  54          3HG2      THR  54   4.682  -0.572   6.960
  426    H    CYS  55           H        CYS  55   7.958   1.246   4.503
  427    HA   CYS  55           HA       CYS  55   9.869  -1.043   4.801
  428   1HB   CYS  55          1HB       CYS  55   8.341  -0.009   2.393
  429   2HB   CYS  55          2HB       CYS  55   9.254  -1.516   2.482
  430    H    GLY  56           H        GLY  56  10.311   2.053   4.962
  431   1HA   GLY  56          1HA       GLY  56  11.840   2.784   2.639
  432   2HA   GLY  56          2HA       GLY  56  11.934   3.577   4.214
  433    H    GLY  57           H        GLY  57  14.317   3.487   3.220
  434   1HA   GLY  57          1HA       GLY  57  16.321   2.634   4.471
  435   2HA   GLY  57          2HA       GLY  57  15.609   1.025   4.333
  436    H    ALA  58           H        ALA  58  16.774  -0.130   2.864
  437    HA   ALA  58           HA       ALA  58  17.876  -0.675   0.845
  438   1HB   ALA  58          1HB       ALA  58  15.796   1.348   0.274
  439   2HB   ALA  58          2HB       ALA  58  16.087  -0.209  -0.501
  440   3HB   ALA  58          3HB       ALA  58  17.038   1.201  -0.969
  Start of MODEL   14
    1   1H    ARG   1          1H        ARG   1  14.922  -6.666   4.561
    2   2H    ARG   1          2H        ARG   1  14.533  -6.238   6.160
    3   3H    ARG   1          3H        ARG   1  15.468  -5.193   5.199
    4    HA   ARG   1           HA       ARG   1  13.213  -4.356   5.330
    5   1HB   ARG   1          1HB       ARG   1  14.151  -3.735   3.320
    6   2HB   ARG   1          2HB       ARG   1  14.535  -5.394   2.870
    7   1HG   ARG   1          1HG       ARG   1  12.507  -5.728   1.854
    8   2HG   ARG   1          2HG       ARG   1  11.645  -4.702   3.001
    9   1HD   ARG   1          1HD       ARG   1  11.601  -3.444   0.982
   10   2HD   ARG   1          2HD       ARG   1  12.975  -2.746   1.862
   11    HE   ARG   1           HE       ARG   1  13.251  -4.874  -0.241
   12   1HH1  ARG   1          1HH1      ARG   1  15.510  -4.219   1.747
   13   2HH1  ARG   1          2HH1      ARG   1  16.487  -3.164   0.780
   14   1HH2  ARG   1          1HH2      ARG   1  14.017  -2.617  -1.590
   15   2HH2  ARG   1          2HH2      ARG   1  15.641  -2.254  -1.108
   16    HA   PRO   2           HA       PRO   2   9.984  -7.327   5.730
   17   1HB   PRO   2          1HB       PRO   2   7.873  -5.755   4.979
   18   2HB   PRO   2          2HB       PRO   2   8.659  -5.641   6.563
   19   1HG   PRO   2          1HG       PRO   2   9.021  -3.962   4.115
   20   2HG   PRO   2          2HG       PRO   2   8.919  -3.463   5.812
   21   1HD   PRO   2          1HD       PRO   2  11.270  -3.651   4.475
   22   2HD   PRO   2          2HD       PRO   2  11.133  -3.980   6.218
   23    H    ASP   3           H        ASP   3   8.181  -8.300   4.409
   24    HA   ASP   3           HA       ASP   3   8.931  -8.293   1.515
   25   1HB   ASP   3          1HB       ASP   3   7.909 -10.316   3.489
   26   2HB   ASP   3          2HB       ASP   3   7.602 -10.561   1.769
   27    H    PHE   4           H        PHE   4   6.386  -7.556   3.779
   28    HA   PHE   4           HA       PHE   4   4.154  -7.949   1.985
   29   1HB   PHE   4          1HB       PHE   4   2.961  -6.473   3.586
   30   2HB   PHE   4          2HB       PHE   4   3.880  -7.731   4.402
   31    HD1  PHE   4           1HD      PHE   4   3.914  -4.102   3.484
   32    HD2  PHE   4           2HD      PHE   4   5.625  -7.215   5.912
   33    HE1  PHE   4           1HE      PHE   4   5.096  -2.406   4.835
   34    HE2  PHE   4           2HE      PHE   4   6.805  -5.503   7.261
   35    HZ   PHE   4           HZ       PHE   4   6.531  -3.099   6.720
   36    H    CYS   5           H        CYS   5   6.570  -5.462   2.256
   37    HA   CYS   5           HA       CYS   5   5.054  -3.505   0.650
   38   1HB   CYS   5          1HB       CYS   5   7.687  -3.729   2.051
   39   2HB   CYS   5          2HB       CYS   5   7.562  -2.551   0.746
   40    H    LEU   6           H        LEU   6   7.231  -6.156   0.128
   41    HA   LEU   6           HA       LEU   6   8.190  -5.240  -2.487
   42   1HB   LEU   6          1HB       LEU   6   8.313  -8.006  -1.265
   43   2HB   LEU   6          2HB       LEU   6   9.432  -7.287  -2.424
   44    HG   LEU   6           HG       LEU   6   9.012  -6.464   0.464
   45   1HD1  LEU   6          1HD1      LEU   6  10.844  -7.696   0.910
   46   2HD1  LEU   6          2HD1      LEU   6  11.724  -6.992  -0.446
   47   3HD1  LEU   6          3HD1      LEU   6  10.676  -8.386  -0.704
   48   1HD2  LEU   6          1HD2      LEU   6   9.977  -4.965  -1.843
   49   2HD2  LEU   6          2HD2      LEU   6  11.214  -5.099  -0.594
   50   3HD2  LEU   6          3HD2      LEU   6   9.641  -4.399  -0.207
   51    H    GLU   7           H        GLU   7   5.435  -6.991  -1.299
   52    HA   GLU   7           HA       GLU   7   4.901  -8.323  -3.877
   53   1HB   GLU   7          1HB       GLU   7   3.926  -8.341  -1.103
   54   2HB   GLU   7          2HB       GLU   7   2.638  -8.511  -2.297
   55   1HG   GLU   7          1HG       GLU   7   3.932 -10.348  -3.375
   56   2HG   GLU   7          2HG       GLU   7   5.149 -10.205  -2.108
   57    HA   PRO   8           HA       PRO   8   2.315  -5.261  -5.641
   58   1HB   PRO   8          1HB       PRO   8   0.087  -6.661  -6.424
   59   2HB   PRO   8          2HB       PRO   8   1.653  -6.776  -7.252
   60   1HG   PRO   8          1HG       PRO   8   0.421  -8.605  -5.231
   61   2HG   PRO   8          2HG       PRO   8   1.309  -9.001  -6.712
   62   1HD   PRO   8          1HD       PRO   8   2.427  -9.099  -4.235
   63   2HD   PRO   8          2HD       PRO   8   3.359  -8.706  -5.698
   64    HA   PRO   9           HA       PRO   9  -0.540  -3.803  -2.658
   65   1HB   PRO   9          1HB       PRO   9  -2.296  -2.357  -4.197
   66   2HB   PRO   9          2HB       PRO   9  -0.649  -1.813  -3.816
   67   1HG   PRO   9          1HG       PRO   9  -1.721  -3.071  -6.296
   68   2HG   PRO   9          2HG       PRO   9  -0.512  -1.790  -6.108
   69   1HD   PRO   9          1HD       PRO   9   0.083  -4.420  -6.641
   70   2HD   PRO   9          2HD       PRO   9   1.194  -3.289  -5.838
   71    H    TYR  10           H        TYR  10  -2.849  -3.941  -1.963
   72    HA   TYR  10           HA       TYR  10  -4.301  -6.219  -3.300
   73   1HB   TYR  10          1HB       TYR  10  -3.128  -6.513  -1.009
   74   2HB   TYR  10          2HB       TYR  10  -4.397  -5.470  -0.371
   75    HD1  TYR  10           1HD      TYR  10  -6.235  -6.556   0.543
   76    HD2  TYR  10           2HD      TYR  10  -4.131  -8.403  -2.717
   77    HE1  TYR  10           1HE      TYR  10  -7.780  -8.499   0.643
   78    HE2  TYR  10           2HE      TYR  10  -5.675 -10.342  -2.616
   79    HH   TYR  10           HH       TYR  10  -7.759 -10.990  -1.810
   80    H    THR  11           H        THR  11  -5.686  -4.857  -4.525
   81    HA   THR  11           HA       THR  11  -7.075  -2.571  -3.677
   82    HB   THR  11           HB       THR  11  -7.582  -4.851  -5.567
   83    HG1  THR  11           1HG      THR  11  -6.295  -3.270  -6.343
   84   1HG2  THR  11          1HG2      THR  11  -9.804  -4.257  -4.585
   85   2HG2  THR  11          2HG2      THR  11  -9.688  -3.876  -6.302
   86   3HG2  THR  11          3HG2      THR  11  -9.548  -2.591  -5.103
   87    H    GLY  12           H        GLY  12  -7.414  -5.898  -2.743
   88   1HA   GLY  12          1HA       GLY  12  -8.743  -6.879  -1.069
   89   2HA   GLY  12          2HA       GLY  12  -9.118  -5.245  -0.517
   90    HA   PRO  13           HA       PRO  13 -12.843  -7.072  -2.585
   91   1HB   PRO  13          1HB       PRO  13 -14.442  -7.211  -0.365
   92   2HB   PRO  13          2HB       PRO  13 -13.365  -8.524  -0.868
   93   1HG   PRO  13          1HG       PRO  13 -13.071  -6.544   1.311
   94   2HG   PRO  13          2HG       PRO  13 -12.488  -8.209   1.210
   95   1HD   PRO  13          1HD       PRO  13 -10.967  -5.893   0.811
   96   2HD   PRO  13          2HD       PRO  13 -10.496  -7.545   0.363
   97    H    CYS  14           H        CYS  14 -15.305  -6.017  -1.406
   98    HA   CYS  14           HA       CYS  14 -16.575  -4.028  -1.351
   99   1HB   CYS  14          1HB       CYS  14 -13.883  -2.755  -0.759
  100   2HB   CYS  14          2HB       CYS  14 -15.473  -2.136  -0.315
  101    H    LYS  15           H        LYS  15 -16.727  -1.832  -2.498
  102    HA   LYS  15           HA       LYS  15 -15.360  -2.002  -5.165
  103   1HB   LYS  15          1HB       LYS  15 -18.079  -0.947  -4.318
  104   2HB   LYS  15          2HB       LYS  15 -17.449  -0.876  -5.965
  105   1HG   LYS  15          1HG       LYS  15 -17.124  -3.429  -5.744
  106   2HG   LYS  15          2HG       LYS  15 -18.182  -3.313  -4.338
  107   1HD   LYS  15          1HD       LYS  15 -19.656  -1.897  -6.083
  108   2HD   LYS  15          2HD       LYS  15 -18.807  -2.937  -7.228
  109   1HE   LYS  15          1HE       LYS  15 -20.142  -4.683  -6.668
  110   2HE   LYS  15          2HE       LYS  15 -19.717  -4.495  -4.955
  111   1HZ   LYS  15          1HZ       LYS  15 -22.029  -4.043  -5.150
  112   2HZ   LYS  15          2HZ       LYS  15 -21.798  -3.032  -6.496
  113   3HZ   LYS  15          3HZ       LYS  15 -21.269  -2.538  -4.958
  114    H    ALA  16           H        ALA  16 -15.019  -0.376  -2.393
  115    HA   ALA  16           HA       ALA  16 -15.297   2.390  -2.966
  116   1HB   ALA  16          1HB       ALA  16 -13.420   0.757  -1.244
  117   2HB   ALA  16          2HB       ALA  16 -14.863   1.637  -0.740
  118   3HB   ALA  16          3HB       ALA  16 -13.413   2.521  -1.218
  119    H    ARG  17           H        ARG  17 -13.602   3.942  -3.544
  120    HA   ARG  17           HA       ARG  17 -11.373   2.790  -5.186
  121   1HB   ARG  17          1HB       ARG  17 -13.433   4.916  -5.806
  122   2HB   ARG  17          2HB       ARG  17 -11.900   4.855  -6.677
  123   1HG   ARG  17          1HG       ARG  17 -12.518   3.009  -7.855
  124   2HG   ARG  17          2HG       ARG  17 -13.252   2.246  -6.444
  125   1HD   ARG  17          1HD       ARG  17 -15.319   3.331  -6.788
  126   2HD   ARG  17          2HD       ARG  17 -14.588   4.603  -7.787
  127    HE   ARG  17           HE       ARG  17 -14.036   2.544  -9.356
  128   1HH1  ARG  17          1HH2      ARG  17 -15.833   0.819  -7.545
  129   2HH1  ARG  17          2HH2      ARG  17 -17.299   0.810  -8.467
  130   1HH2  ARG  17          1HH1      ARG  17 -16.361   3.469 -10.484
  131   2HH2  ARG  17          2HH1      ARG  17 -17.598   2.309 -10.129
  132    H    ILE  18           H        ILE  18 -10.168   3.259  -3.120
  133    HA   ILE  18           HA       ILE  18  -9.733   6.166  -2.587
  134    HB   ILE  18           HB       ILE  18  -8.899   3.681  -1.057
  135   1HG1  ILE  18          1HG1      ILE  18 -11.076   5.405  -0.035
  136   2HG1  ILE  18          2HG1      ILE  18 -11.477   4.483  -1.486
  137   1HG2  ILE  18          1HG2      ILE  18  -8.558   6.594  -0.676
  138   2HG2  ILE  18          2HG2      ILE  18  -7.616   5.253  -0.021
  139   3HG2  ILE  18          3HG2      ILE  18  -9.135   5.721   0.744
  140   1HD1  ILE  18          1HD1      ILE  18 -10.640   2.422  -0.342
  141   2HD1  ILE  18          2HD1      ILE  18 -12.019   3.147   0.481
  142   3HD1  ILE  18          3HD1      ILE  18 -10.392   3.374   1.121
  143    H    ILE  19           H        ILE  19  -7.523   6.949  -2.401
  144    HA   ILE  19           HA       ILE  19  -5.617   5.492  -4.171
  145    HB   ILE  19           HB       ILE  19  -5.714   8.323  -3.074
  146   1HG1  ILE  19          1HG1      ILE  19  -7.473   7.788  -4.735
  147   2HG1  ILE  19          2HG1      ILE  19  -6.290   8.919  -5.392
  148   1HG2  ILE  19          1HG2      ILE  19  -4.030   8.290  -5.269
  149   2HG2  ILE  19          2HG2      ILE  19  -3.624   6.783  -4.444
  150   3HG2  ILE  19          3HG2      ILE  19  -3.507   8.320  -3.583
  151   1HD1  ILE  19          1HD1      ILE  19  -6.502   5.946  -5.919
  152   2HD1  ILE  19          2HD1      ILE  19  -5.083   6.894  -6.360
  153   3HD1  ILE  19          3HD1      ILE  19  -6.647   7.260  -7.086
  154    H    ARG  20           H        ARG  20  -5.109   3.932  -2.368
  155    HA   ARG  20           HA       ARG  20  -3.751   5.027   0.008
  156   1HB   ARG  20          1HB       ARG  20  -4.493   2.306  -1.065
  157   2HB   ARG  20          2HB       ARG  20  -3.429   2.460   0.334
  158   1HG   ARG  20          1HG       ARG  20  -6.161   3.763   0.132
  159   2HG   ARG  20          2HG       ARG  20  -5.866   2.219   0.930
  160   1HD   ARG  20          1HD       ARG  20  -4.321   3.305   2.509
  161   2HD   ARG  20          2HD       ARG  20  -4.537   4.852   1.670
  162    HE   ARG  20           HE       ARG  20  -6.995   4.642   2.283
  163   1HH1  ARG  20          1HH1      ARG  20  -6.288   1.769   3.371
  164   2HH1  ARG  20          2HH1      ARG  20  -6.463   2.061   5.069
  165   1HH2  ARG  20          1HH2      ARG  20  -6.487   5.513   4.745
  166   2HH2  ARG  20          2HH2      ARG  20  -6.575   4.180   5.847
  167    H    TYR  21           H        TYR  21  -1.523   3.890   0.514
  168    HA   TYR  21           HA       TYR  21   0.142   4.084  -1.973
  169   1HB   TYR  21          1HB       TYR  21   0.535   4.813   0.924
  170   2HB   TYR  21          2HB       TYR  21   1.924   4.595  -0.141
  171    HD1  TYR  21           1HD      TYR  21  -0.995   6.668   0.639
  172    HD2  TYR  21           2HD      TYR  21   2.286   6.084  -2.068
  173    HE1  TYR  21           1HE      TYR  21  -1.330   8.956  -0.260
  174    HE2  TYR  21           2HE      TYR  21   1.952   8.369  -2.969
  175    HH   TYR  21           HH       TYR  21   0.717  10.206  -2.902
  176    H    PHE  22           H        PHE  22   1.641   2.471  -2.380
  177    HA   PHE  22           HA       PHE  22   1.954   0.268  -0.387
  178   1HB   PHE  22          1HB       PHE  22   1.372  -1.373  -2.005
  179   2HB   PHE  22          2HB       PHE  22   0.172  -0.116  -2.212
  180    HD1  PHE  22           1HD      PHE  22   0.313   1.470  -4.129
  181    HD2  PHE  22           2HD      PHE  22   3.035  -1.826  -3.688
  182    HE1  PHE  22           1HE      PHE  22   1.010   1.731  -6.495
  183    HE2  PHE  22           2HE      PHE  22   3.737  -1.564  -6.053
  184    HZ   PHE  22           HZ       PHE  22   2.729   0.216  -7.456
  185    H    TYR  23           H        TYR  23   3.988  -0.828  -0.640
  186    HA   TYR  23           HA       TYR  23   6.108   0.870  -1.741
  187   1HB   TYR  23          1HB       TYR  23   6.216  -0.446   0.394
  188   2HB   TYR  23          2HB       TYR  23   6.239  -1.925  -0.569
  189    HD1  TYR  23           1HD      TYR  23   8.292  -2.757  -1.361
  190    HD2  TYR  23           2HD      TYR  23   7.982   1.370  -0.216
  191    HE1  TYR  23           1HE      TYR  23  10.729  -2.472  -1.732
  192    HE2  TYR  23           2HE      TYR  23  10.418   1.659  -0.580
  193    HH   TYR  23           HH       TYR  23  12.260   0.708  -1.497
  194    H    ASN  24           H        ASN  24   6.267   0.869  -3.976
  195    HA   ASN  24           HA       ASN  24   5.820  -1.541  -5.579
  196   1HB   ASN  24          1HB       ASN  24   5.350   0.831  -6.274
  197   2HB   ASN  24          2HB       ASN  24   7.083   1.130  -6.271
  198   1HD2  ASN  24          1HD2      ASN  24   6.297   1.578  -8.710
  199   2HD2  ASN  24          2HD2      ASN  24   6.446   0.255  -9.761
  200    H    ALA  25           H        ALA  25   7.492  -2.957  -4.558
  201    HA   ALA  25           HA       ALA  25  10.195  -2.446  -4.201
  202   1HB   ALA  25          1HB       ALA  25   9.725  -4.977  -5.589
  203   2HB   ALA  25          2HB       ALA  25   8.497  -4.658  -4.364
  204   3HB   ALA  25          3HB       ALA  25  10.201  -4.697  -3.914
  205    H    LYS  26           H        LYS  26   8.436  -2.677  -7.215
  206    HA   LYS  26           HA       LYS  26  10.724  -3.005  -8.963
  207   1HB   LYS  26          1HB       LYS  26   7.954  -3.056  -9.130
  208   2HB   LYS  26          2HB       LYS  26   8.373  -1.584 -10.009
  209   1HG   LYS  26          1HG       LYS  26  10.195  -3.123 -11.131
  210   2HG   LYS  26          2HG       LYS  26   9.137  -4.431 -10.599
  211   1HD   LYS  26          1HD       LYS  26   7.273  -3.506 -11.836
  212   2HD   LYS  26          2HD       LYS  26   8.188  -2.047 -12.218
  213   1HE   LYS  26          1HE       LYS  26   9.790  -4.206 -13.101
  214   2HE   LYS  26          2HE       LYS  26   8.137  -4.565 -13.641
  215   1HZ   LYS  26          1HZ       LYS  26   7.997  -2.575 -14.780
  216   2HZ   LYS  26          2HZ       LYS  26   9.633  -2.964 -15.028
  217   3HZ   LYS  26          3HZ       LYS  26   9.197  -1.821 -13.850
  218    H    ALA  27           H        ALA  27   9.119  -0.264  -7.432
  219    HA   ALA  27           HA       ALA  27  10.715   1.663  -9.048
  220   1HB   ALA  27          1HB       ALA  27   8.810   2.836  -8.760
  221   2HB   ALA  27          2HB       ALA  27   9.136   2.905  -7.030
  222   3HB   ALA  27          3HB       ALA  27   8.182   1.581  -7.695
  223    H    GLY  28           H        GLY  28  10.616   0.218  -5.853
  224   1HA   GLY  28          1HA       GLY  28  12.529   0.239  -4.366
  225   2HA   GLY  28          2HA       GLY  28  13.094   1.710  -5.162
  226    H    LEU  29           H        LEU  29   9.843   2.082  -4.708
  227    HA   LEU  29           HA       LEU  29   9.986   3.028  -1.907
  228   1HB   LEU  29          1HB       LEU  29   9.254   5.298  -2.681
  229   2HB   LEU  29          2HB       LEU  29  10.856   4.865  -3.274
  230    HG   LEU  29           HG       LEU  29   8.781   3.929  -5.084
  231   1HD1  LEU  29          1HD1      LEU  29   8.887   6.827  -5.380
  232   2HD1  LEU  29          2HD1      LEU  29   8.142   6.359  -3.851
  233   3HD1  LEU  29          3HD1      LEU  29   7.485   5.756  -5.374
  234   1HD2  LEU  29          1HD2      LEU  29  11.408   4.616  -5.226
  235   2HD2  LEU  29          2HD2      LEU  29  10.669   6.093  -5.844
  236   3HD2  LEU  29          3HD2      LEU  29  10.350   4.550  -6.636
  237    H    CYS  30           H        CYS  30   7.535   4.695  -2.633
  238    HA   CYS  30           HA       CYS  30   5.634   2.403  -2.862
  239   1HB   CYS  30          1HB       CYS  30   5.880   4.720  -1.055
  240   2HB   CYS  30          2HB       CYS  30   4.240   4.393  -1.611
  241    H    GLN  31           H        GLN  31   3.500   2.960  -3.721
  242    HA   GLN  31           HA       GLN  31   3.330   5.351  -5.466
  243   1HB   GLN  31          1HB       GLN  31   3.295   2.448  -6.347
  244   2HB   GLN  31          2HB       GLN  31   2.668   3.754  -7.354
  245   1HG   GLN  31          1HG       GLN  31   5.041   4.835  -6.765
  246   2HG   GLN  31          2HG       GLN  31   5.486   3.140  -6.570
  247   1HE2  GLN  31          1HE2      GLN  31   6.856   3.846  -8.602
  248   2HE2  GLN  31          2HE2      GLN  31   6.114   3.623 -10.112
  249    H    THR  32           H        THR  32   1.035   5.628  -6.211
  250    HA   THR  32           HA       THR  32  -0.830   4.829  -4.109
  251    HB   THR  32           HB       THR  32  -2.384   6.108  -5.796
  252    HG1  THR  32           1HG      THR  32  -1.342   6.339  -7.611
  253   1HG2  THR  32          1HG2      THR  32  -1.729   8.148  -4.813
  254   2HG2  THR  32          2HG2      THR  32  -0.033   7.670  -4.741
  255   3HG2  THR  32          3HG2      THR  32  -1.205   6.935  -3.648
  256    H    PHE  33           H        PHE  33  -2.540   3.408  -4.282
  257    HA   PHE  33           HA       PHE  33  -3.016   2.027  -6.866
  258   1HB   PHE  33          1HB       PHE  33  -2.568  -0.119  -5.994
  259   2HB   PHE  33          2HB       PHE  33  -1.274   0.863  -5.329
  260    HD1  PHE  33           1HD      PHE  33  -4.284  -1.066  -4.580
  261    HD2  PHE  33           2HD      PHE  33  -1.330   1.590  -2.946
  262    HE1  PHE  33           1HE      PHE  33  -4.976  -1.703  -2.288
  263    HE2  PHE  33           2HE      PHE  33  -2.028   0.961  -0.660
  264    HZ   PHE  33           HZ       PHE  33  -3.848  -0.690  -0.325
  265    H    VAL  34           H        VAL  34  -5.093   0.832  -6.802
  266    HA   VAL  34           HA       VAL  34  -7.131   2.351  -5.396
  267    HB   VAL  34           HB       VAL  34  -7.393  -0.289  -6.860
  268   1HG1  VAL  34          1HG1      VAL  34  -9.212   1.956  -6.072
  269   2HG1  VAL  34          2HG1      VAL  34  -9.508   0.218  -6.054
  270   3HG1  VAL  34          3HG1      VAL  34  -9.541   1.102  -7.579
  271   1HG2  VAL  34          1HG2      VAL  34  -6.186   0.975  -8.418
  272   2HG2  VAL  34          2HG2      VAL  34  -6.879   2.500  -7.865
  273   3HG2  VAL  34          3HG2      VAL  34  -7.851   1.388  -8.829
  274    H    TYR  35           H        TYR  35  -7.966   1.923  -3.412
  275    HA   TYR  35           HA       TYR  35  -7.326  -0.718  -2.129
  276   1HB   TYR  35          1HB       TYR  35  -6.259   1.190  -1.078
  277   2HB   TYR  35          2HB       TYR  35  -7.774   2.090  -1.065
  278    HD1  TYR  35           1HD      TYR  35  -7.371  -1.523  -0.258
  279    HD2  TYR  35           2HD      TYR  35  -8.040   2.435   1.270
  280    HE1  TYR  35           1HE      TYR  35  -7.917  -2.474   1.971
  281    HE2  TYR  35           2HE      TYR  35  -8.584   1.488   3.494
  282    HH   TYR  35           HH       TYR  35  -8.247  -0.477   4.783
  283    H    GLY  36           H        GLY  36  -9.077  -1.811  -1.085
  284   1HA   GLY  36          1HA       GLY  36 -11.752  -0.991  -2.015
  285   2HA   GLY  36          2HA       GLY  36 -11.350  -2.527  -1.251
  286    H    ALA  37           H        ALA  37  -9.967  -0.071   0.565
  287    HA   ALA  37           HA       ALA  37 -10.631   1.005   2.578
  288   1HB   ALA  37          1HB       ALA  37 -12.808   1.825   2.597
  289   2HB   ALA  37          2HB       ALA  37 -13.485   0.317   1.980
  290   3HB   ALA  37          3HB       ALA  37 -12.648   1.420   0.888
  291    H    CYS  38           H        CYS  38 -10.892  -2.201   1.889
  292    HA   CYS  38           HA       CYS  38 -11.481  -2.875   4.733
  293   1HB   CYS  38          1HB       CYS  38 -12.956  -4.741   3.825
  294   2HB   CYS  38          2HB       CYS  38 -13.599  -3.113   3.605
  295    H    ARG  39           H        ARG  39 -10.669  -5.043   5.303
  296    HA   ARG  39           HA       ARG  39  -8.961  -6.675   5.284
  297   1HB   ARG  39          1HB       ARG  39  -9.550  -6.574   2.311
  298   2HB   ARG  39          2HB       ARG  39  -8.950  -7.956   3.228
  299   1HG   ARG  39          1HG       ARG  39 -11.291  -7.122   4.555
  300   2HG   ARG  39          2HG       ARG  39 -11.680  -7.077   2.834
  301   1HD   ARG  39          1HD       ARG  39 -11.184  -9.380   2.554
  302   2HD   ARG  39          2HD       ARG  39 -10.265  -9.452   4.070
  303    HE   ARG  39           HE       ARG  39 -12.646  -8.766   5.061
  304   1HH1  ARG  39          1HH1      ARG  39 -13.628  -9.515   2.190
  305   2HH1  ARG  39          2HH1      ARG  39 -14.286 -11.086   2.505
  306   1HH2  ARG  39          1HH2      ARG  39 -12.754 -11.394   5.601
  307   2HH2  ARG  39          2HH2      ARG  39 -13.791 -12.149   4.438
  308    H    ALA  40           H        ALA  40  -8.116  -3.835   4.942
  309    HA   ALA  40           HA       ALA  40  -6.136  -3.520   2.922
  310   1HB   ALA  40          1HB       ALA  40  -7.049  -2.249   5.365
  311   2HB   ALA  40          2HB       ALA  40  -6.309  -1.514   3.943
  312   3HB   ALA  40          3HB       ALA  40  -5.292  -2.154   5.233
  313    H    LYS  41           H        LYS  41  -3.956  -4.093   2.843
  314    HA   LYS  41           HA       LYS  41  -3.033  -6.059   4.896
  315   1HB   LYS  41          1HB       LYS  41  -1.854  -5.406   2.183
  316   2HB   LYS  41          2HB       LYS  41  -1.610  -6.871   3.137
  317   1HG   LYS  41          1HG       LYS  41  -4.387  -6.676   2.854
  318   2HG   LYS  41          2HG       LYS  41  -3.753  -6.217   1.273
  319   1HD   LYS  41          1HD       LYS  41  -3.755  -8.500   0.984
  320   2HD   LYS  41          2HD       LYS  41  -2.176  -8.345   1.757
  321   1HE   LYS  41          1HE       LYS  41  -2.908  -9.312   3.714
  322   2HE   LYS  41          2HE       LYS  41  -4.522  -8.585   3.585
  323   1HZ   LYS  41          1HZ       LYS  41  -4.695 -10.924   3.124
  324   2HZ   LYS  41          2HZ       LYS  41  -3.429 -10.853   1.992
  325   3HZ   LYS  41          3HZ       LYS  41  -4.910 -10.090   1.663
  326    H    ARG  42           H        ARG  42  -0.325  -5.888   4.691
  327    HA   ARG  42           HA       ARG  42   0.303  -3.466   6.164
  328   1HB   ARG  42          1HB       ARG  42   2.351  -5.272   4.884
  329   2HB   ARG  42          2HB       ARG  42   2.407  -4.476   6.454
  330   1HG   ARG  42          1HG       ARG  42   0.406  -5.979   7.087
  331   2HG   ARG  42          2HG       ARG  42   0.823  -6.920   5.655
  332   1HD   ARG  42          1HD       ARG  42   3.281  -6.609   6.870
  333   2HD   ARG  42          2HD       ARG  42   2.187  -6.785   8.258
  334    HE   ARG  42           HE       ARG  42   2.292  -8.717   5.960
  335   1HH1  ARG  42          1HH1      ARG  42   0.007  -8.454   8.101
  336   2HH1  ARG  42          2HH1      ARG  42   0.401  -9.809   9.105
  337   1HH2  ARG  42          1HH2      ARG  42   3.567 -10.226   7.752
  338   2HH2  ARG  42          2HH2      ARG  42   2.418 -10.813   8.908
  339    H    ASN  43           H        ASN  43   0.461  -4.417   2.797
  340    HA   ASN  43           HA       ASN  43   2.168  -2.094   2.092
  341   1HB   ASN  43          1HB       ASN  43   2.081  -4.592   1.153
  342   2HB   ASN  43          2HB       ASN  43   0.856  -3.892   0.092
  343   1HD2  ASN  43          1HD2      ASN  43   3.338  -4.762  -0.996
  344   2HD2  ASN  43          2HD2      ASN  43   4.227  -3.405  -1.493
  345    H    ASN  44           H        ASN  44  -0.070  -1.103   3.193
  346    HA   ASN  44           HA       ASN  44  -1.441   0.182   0.909
  347   1HB   ASN  44          1HB       ASN  44  -2.809  -1.774   1.281
  348   2HB   ASN  44          2HB       ASN  44  -2.759  -1.546   3.028
  349   1HD2  ASN  44          1HD2      ASN  44  -5.280  -1.701   2.219
  350   2HD2  ASN  44          2HD2      ASN  44  -6.028  -0.174   2.058
  351    H    PHE  45           H        PHE  45   0.091   1.765   2.114
  352    HA   PHE  45           HA       PHE  45  -0.909   2.747   4.711
  353   1HB   PHE  45          1HB       PHE  45   1.236   3.928   2.932
  354   2HB   PHE  45          2HB       PHE  45   1.098   4.043   4.685
  355    HD1  PHE  45           1HD      PHE  45   1.676   2.138   6.132
  356    HD2  PHE  45           2HD      PHE  45   2.075   1.901   1.859
  357    HE1  PHE  45           1HE      PHE  45   3.056   0.088   6.373
  358    HE2  PHE  45           2HE      PHE  45   3.452  -0.149   2.098
  359    HZ   PHE  45           HZ       PHE  45   3.940  -1.068   4.355
  360    H    LYS  46           H        LYS  46  -1.904   4.780   4.999
  361    HA   LYS  46           HA       LYS  46  -3.421   5.811   2.737
  362   1HB   LYS  46          1HB       LYS  46  -4.378   5.717   4.958
  363   2HB   LYS  46          2HB       LYS  46  -3.045   6.666   5.619
  364   1HG   LYS  46          1HG       LYS  46  -3.738   8.515   4.003
  365   2HG   LYS  46          2HG       LYS  46  -5.197   7.575   3.693
  366   1HD   LYS  46          1HD       LYS  46  -4.393   8.201   6.522
  367   2HD   LYS  46          2HD       LYS  46  -5.234   9.417   5.557
  368   1HE   LYS  46          1HE       LYS  46  -6.924   7.496   5.029
  369   2HE   LYS  46          2HE       LYS  46  -6.212   6.702   6.448
  370   1HZ   LYS  46          1HZ       LYS  46  -7.672   9.255   6.259
  371   2HZ   LYS  46          2HZ       LYS  46  -6.480   9.079   7.460
  372   3HZ   LYS  46          3HZ       LYS  46  -7.812   8.025   7.419
  373    H    SER  47           H        SER  47  -0.363   6.564   4.177
  374    HA   SER  47           HA       SER  47  -0.179   8.965   2.399
  375   1HB   SER  47          1HB       SER  47   0.902  10.170   4.230
  376   2HB   SER  47          2HB       SER  47  -0.666   9.581   4.762
  377    HG   SER  47           HG       SER  47   1.637   9.107   5.885
  378    H    ALA  48           H        ALA  48   1.953   9.393   1.650
  379    HA   ALA  48           HA       ALA  48   3.615   7.092   1.200
  380   1HB   ALA  48          1HB       ALA  48   5.200   9.057   0.462
  381   2HB   ALA  48          2HB       ALA  48   3.790  10.067   0.787
  382   3HB   ALA  48          3HB       ALA  48   3.698   8.783  -0.421
  383    H    GLU  49           H        GLU  49   3.564   9.569   3.681
  384    HA   GLU  49           HA       GLU  49   6.262   9.124   4.664
  385   1HB   GLU  49          1HB       GLU  49   3.813  10.635   5.363
  386   2HB   GLU  49          2HB       GLU  49   4.824  10.194   6.740
  387   1HG   GLU  49          1HG       GLU  49   5.602  12.332   5.943
  388   2HG   GLU  49          2HG       GLU  49   6.800  11.131   5.459
  389    H    ASP  50           H        ASP  50   3.229   7.496   5.015
  390    HA   ASP  50           HA       ASP  50   3.930   6.140   7.529
  391   1HB   ASP  50          1HB       ASP  50   1.602   6.771   6.783
  392   2HB   ASP  50          2HB       ASP  50   1.752   5.585   5.486
  393    H    CYS  51           H        CYS  51   4.087   5.601   4.075
  394    HA   CYS  51           HA       CYS  51   4.642   2.746   4.149
  395   1HB   CYS  51          1HB       CYS  51   3.837   3.568   2.111
  396   2HB   CYS  51          2HB       CYS  51   4.786   5.049   2.212
  397    H    MET  52           H        MET  52   6.668   5.695   3.812
  398    HA   MET  52           HA       MET  52   9.190   4.391   3.567
  399   1HB   MET  52          1HB       MET  52   8.120   6.993   3.703
  400   2HB   MET  52          2HB       MET  52   9.309   6.910   5.005
  401   1HG   MET  52          1HG       MET  52  10.896   7.235   3.429
  402   2HG   MET  52          2HG       MET  52  10.532   5.612   2.843
  403   1HE   MET  52          1HE       MET  52   9.984   6.360  -0.642
  404   2HE   MET  52          2HE       MET  52   9.638   5.103   0.543
  405   3HE   MET  52          3HE       MET  52  11.197   5.923   0.570
  406    H    ARG  53           H        ARG  53   7.734   5.868   6.514
  407    HA   ARG  53           HA       ARG  53   9.721   5.105   8.357
  408   1HB   ARG  53          1HB       ARG  53   7.530   6.517   8.553
  409   2HB   ARG  53          2HB       ARG  53   6.777   4.981   8.990
  410   1HG   ARG  53          1HG       ARG  53   8.670   4.730  10.708
  411   2HG   ARG  53          2HG       ARG  53   9.030   6.429  10.401
  412   1HD   ARG  53          1HD       ARG  53   6.347   5.337  11.334
  413   2HD   ARG  53          2HD       ARG  53   7.513   6.223  12.338
  414    HE   ARG  53           HE       ARG  53   6.290   7.410   9.863
  415   1HH1  ARG  53          1HH1      ARG  53   6.308   7.413  13.239
  416   2HH1  ARG  53          2HH1      ARG  53   6.407   9.134  13.405
  417   1HH2  ARG  53          1HH2      ARG  53   6.863   9.698  10.013
  418   2HH2  ARG  53          2HH2      ARG  53   6.722  10.430  11.577
  419    H    THR  54           H        THR  54   7.457   3.107   6.657
  420    HA   THR  54           HA       THR  54   7.821   0.832   8.541
  421    HB   THR  54           HB       THR  54   6.132   1.319   6.066
  422    HG1  THR  54           1HG      THR  54   5.173   2.345   7.682
  423   1HG2  THR  54          1HG2      THR  54   5.485  -0.964   7.809
  424   2HG2  THR  54          2HG2      THR  54   6.997  -1.143   6.918
  425   3HG2  THR  54          3HG2      THR  54   5.488  -0.856   6.049
  426    H    CYS  55           H        CYS  55   7.992   1.311   4.991
  427    HA   CYS  55           HA       CYS  55  10.160  -0.760   4.892
  428   1HB   CYS  55          1HB       CYS  55   8.241   0.220   2.742
  429   2HB   CYS  55          2HB       CYS  55   9.328  -1.164   2.623
  430    H    GLY  56           H        GLY  56   9.075   2.170   3.117
  431   1HA   GLY  56          1HA       GLY  56  10.319   3.864   2.075
  432   2HA   GLY  56          2HA       GLY  56  11.436   3.674   3.426
  433    H    GLY  57           H        GLY  57  12.451   4.326   0.955
  434   1HA   GLY  57          1HA       GLY  57  13.163   2.320  -0.848
  435   2HA   GLY  57          2HA       GLY  57  14.228   3.664  -0.430
  436    H    ALA  58           H        ALA  58  15.917   3.293   1.050
  437    HA   ALA  58           HA       ALA  58  16.179   1.084   2.808
  438   1HB   ALA  58          1HB       ALA  58  16.126  -0.480   1.101
  439   2HB   ALA  58          2HB       ALA  58  17.856  -0.133   1.116
  440   3HB   ALA  58          3HB       ALA  58  16.812   0.637  -0.080
  Start of MODEL   15
    1   1H    ARG   1          1H        ARG   1  15.133  -5.109   4.550
    2   2H    ARG   1          2H        ARG   1  14.393  -6.567   5.008
    3   3H    ARG   1          3H        ARG   1  14.625  -5.333   6.152
    4    HA   ARG   1           HA       ARG   1  12.866  -4.097   5.413
    5   1HB   ARG   1          1HB       ARG   1  14.084  -4.988   2.920
    6   2HB   ARG   1          2HB       ARG   1  12.325  -4.966   2.801
    7   1HG   ARG   1          1HG       ARG   1  12.612  -2.611   3.995
    8   2HG   ARG   1          2HG       ARG   1  14.227  -2.704   3.291
    9   1HD   ARG   1          1HD       ARG   1  11.566  -2.793   1.825
   10   2HD   ARG   1          2HD       ARG   1  12.875  -1.609   1.635
   11    HE   ARG   1           HE       ARG   1  12.980  -4.466   0.756
   12   1HH1  ARG   1          1HH2      ARG   1  13.253  -1.626  -0.692
   13   2HH1  ARG   1          2HH2      ARG   1  14.909  -1.749  -1.184
   14   1HH2  ARG   1          1HH1      ARG   1  15.577  -4.493   0.828
   15   2HH2  ARG   1          2HH1      ARG   1  16.226  -3.373  -0.322
   16    HA   PRO   2           HA       PRO   2   9.864  -7.215   6.261
   17   1HB   PRO   2          1HB       PRO   2   7.597  -5.818   5.629
   18   2HB   PRO   2          2HB       PRO   2   8.516  -5.554   7.122
   19   1HG   PRO   2          1HG       PRO   2   8.552  -4.031   4.553
   20   2HG   PRO   2          2HG       PRO   2   8.562  -3.417   6.213
   21   1HD   PRO   2          1HD       PRO   2  10.791  -3.558   4.680
   22   2HD   PRO   2          2HD       PRO   2  10.835  -3.772   6.446
   23    H    ASP   3           H        ASP   3   8.188  -8.496   5.155
   24    HA   ASP   3           HA       ASP   3   8.755  -8.728   2.266
   25   1HB   ASP   3          1HB       ASP   3   8.377 -10.495   4.315
   26   2HB   ASP   3          2HB       ASP   3   6.762 -10.465   3.606
   27    H    PHE   4           H        PHE   4   6.204  -7.607   4.427
   28    HA   PHE   4           HA       PHE   4   4.069  -7.769   2.485
   29   1HB   PHE   4          1HB       PHE   4   2.838  -6.404   4.062
   30   2HB   PHE   4          2HB       PHE   4   3.780  -7.596   4.945
   31    HD1  PHE   4           1HD      PHE   4   5.543  -6.966   6.430
   32    HD2  PHE   4           2HD      PHE   4   3.581  -3.993   4.016
   33    HE1  PHE   4           1HE      PHE   4   6.572  -5.166   7.793
   34    HE2  PHE   4           2HE      PHE   4   4.619  -2.214   5.379
   35    HZ   PHE   4           HZ       PHE   4   6.101  -2.790   7.258
   36    H    CYS   5           H        CYS   5   6.713  -5.553   2.808
   37    HA   CYS   5           HA       CYS   5   5.373  -3.391   1.324
   38   1HB   CYS   5          1HB       CYS   5   8.222  -3.938   2.216
   39   2HB   CYS   5          2HB       CYS   5   7.741  -2.465   1.373
   40    H    LEU   6           H        LEU   6   7.311  -6.214   0.655
   41    HA   LEU   6           HA       LEU   6   8.049  -5.411  -2.067
   42   1HB   LEU   6          1HB       LEU   6   8.037  -8.185  -0.854
   43   2HB   LEU   6          2HB       LEU   6   9.110  -7.553  -2.103
   44    HG   LEU   6           HG       LEU   6   9.060  -6.833   0.837
   45   1HD1  LEU   6          1HD1      LEU   6  11.044  -7.963   0.976
   46   2HD1  LEU   6          2HD1      LEU   6  11.544  -7.490  -0.648
   47   3HD1  LEU   6          3HD1      LEU   6  10.402  -8.816  -0.428
   48   1HD2  LEU   6          1HD2      LEU   6  10.091  -5.341  -1.536
   49   2HD2  LEU   6          2HD2      LEU   6  11.107  -5.376  -0.096
   50   3HD2  LEU   6          3HD2      LEU   6   9.472  -4.723  -0.006
   51    H    GLU   7           H        GLU   7   5.378  -6.996  -0.489
   52    HA   GLU   7           HA       GLU   7   4.329  -8.377  -2.820
   53   1HB   GLU   7          1HB       GLU   7   3.172  -7.459  -0.169
   54   2HB   GLU   7          2HB       GLU   7   2.285  -8.461  -1.316
   55   1HG   GLU   7          1HG       GLU   7   5.034  -9.296  -0.437
   56   2HG   GLU   7          2HG       GLU   7   3.655  -9.602   0.618
   57    HA   PRO   8           HA       PRO   8   2.429  -4.986  -4.859
   58   1HB   PRO   8          1HB       PRO   8   0.197  -6.201  -5.899
   59   2HB   PRO   8          2HB       PRO   8   1.833  -6.443  -6.549
   60   1HG   PRO   8          1HG       PRO   8   0.237  -8.162  -4.694
   61   2HG   PRO   8          2HG       PRO   8   1.253  -8.632  -6.069
   62   1HD   PRO   8          1HD       PRO   8   2.069  -8.817  -3.480
   63   2HD   PRO   8          2HD       PRO   8   3.191  -8.508  -4.824
   64    HA   PRO   9           HA       PRO   9  -0.666  -3.269  -2.283
   65   1HB   PRO   9          1HB       PRO   9  -2.243  -1.897  -4.065
   66   2HB   PRO   9          2HB       PRO   9  -0.630  -1.351  -3.564
   67   1HG   PRO   9          1HG       PRO   9  -1.484  -2.776  -6.044
   68   2HG   PRO   9          2HG       PRO   9  -0.303  -1.471  -5.841
   69   1HD   PRO   9          1HD       PRO   9   0.379  -4.100  -6.142
   70   2HD   PRO   9          2HD       PRO   9   1.376  -2.925  -5.251
   71    H    TYR  10           H        TYR  10  -2.974  -3.449  -1.701
   72    HA   TYR  10           HA       TYR  10  -4.359  -5.692  -3.151
   73   1HB   TYR  10          1HB       TYR  10  -3.271  -6.065  -0.846
   74   2HB   TYR  10          2HB       TYR  10  -4.557  -5.039  -0.209
   75    HD1  TYR  10           1HD      TYR  10  -3.857  -8.175  -2.078
   76    HD2  TYR  10           2HD      TYR  10  -6.793  -5.843   0.016
   77    HE1  TYR  10           1HE      TYR  10  -5.415 -10.104  -2.117
   78    HE2  TYR  10           2HE      TYR  10  -8.353  -7.772  -0.025
   79    HH   TYR  10           HH       TYR  10  -8.614  -9.911  -0.555
   80    H    THR  11           H        THR  11  -5.716  -4.316  -4.374
   81    HA   THR  11           HA       THR  11  -7.244  -2.136  -3.300
   82    HB   THR  11           HB       THR  11  -7.335  -3.971  -5.685
   83    HG1  THR  11           1HG      THR  11  -7.224  -1.825  -6.669
   84   1HG2  THR  11          1HG2      THR  11  -9.668  -3.762  -5.319
   85   2HG2  THR  11          2HG2      THR  11  -9.284  -2.503  -6.494
   86   3HG2  THR  11          3HG2      THR  11  -9.517  -2.084  -4.797
   87    H    GLY  12           H        GLY  12  -7.508  -5.593  -3.159
   88   1HA   GLY  12          1HA       GLY  12  -9.044  -6.985  -2.048
   89   2HA   GLY  12          2HA       GLY  12  -9.540  -5.554  -1.140
   90    HA   PRO  13           HA       PRO  13 -12.791  -6.863  -4.276
   91   1HB   PRO  13          1HB       PRO  13 -14.665  -7.800  -2.508
   92   2HB   PRO  13          2HB       PRO  13 -13.428  -8.832  -3.251
   93   1HG   PRO  13          1HG       PRO  13 -13.518  -7.612  -0.532
   94   2HG   PRO  13          2HG       PRO  13 -12.942  -9.209  -1.033
   95   1HD   PRO  13          1HD       PRO  13 -11.304  -7.077  -0.481
   96   2HD   PRO  13          2HD       PRO  13 -10.862  -8.415  -1.567
   97    H    CYS  14           H        CYS  14 -14.683  -6.311  -1.396
   98    HA   CYS  14           HA       CYS  14 -16.227  -4.552  -0.966
   99   1HB   CYS  14          1HB       CYS  14 -13.419  -3.552  -1.132
  100   2HB   CYS  14          2HB       CYS  14 -14.695  -2.347  -0.965
  101    H    LYS  15           H        LYS  15 -16.258  -1.898  -1.872
  102    HA   LYS  15           HA       LYS  15 -16.367  -2.072  -4.850
  103   1HB   LYS  15          1HB       LYS  15 -18.677  -0.748  -4.337
  104   2HB   LYS  15          2HB       LYS  15 -18.605  -2.496  -4.536
  105   1HG   LYS  15          1HG       LYS  15 -18.618  -2.865  -2.180
  106   2HG   LYS  15          2HG       LYS  15 -18.266  -1.171  -1.837
  107   1HD   LYS  15          1HD       LYS  15 -20.697  -1.889  -1.512
  108   2HD   LYS  15          2HD       LYS  15 -20.446  -0.484  -2.548
  109   1HE   LYS  15          1HE       LYS  15 -20.521  -2.036  -4.542
  110   2HE   LYS  15          2HE       LYS  15 -20.980  -3.343  -3.433
  111   1HZ   LYS  15          1HZ       LYS  15 -22.920  -2.218  -2.819
  112   2HZ   LYS  15          2HZ       LYS  15 -22.846  -1.968  -4.499
  113   3HZ   LYS  15          3HZ       LYS  15 -22.379  -0.731  -3.431
  114    H    ALA  16           H        ALA  16 -15.104  -0.497  -2.326
  115    HA   ALA  16           HA       ALA  16 -15.669   2.275  -3.218
  116   1HB   ALA  16          1HB       ALA  16 -14.101   2.704  -1.218
  117   2HB   ALA  16          2HB       ALA  16 -14.165   0.963  -0.945
  118   3HB   ALA  16          3HB       ALA  16 -15.641   1.924  -0.859
  119    H    ARG  17           H        ARG  17 -13.587   3.707  -3.339
  120    HA   ARG  17           HA       ARG  17 -11.243   2.270  -4.463
  121   1HB   ARG  17          1HB       ARG  17 -13.328   3.734  -5.945
  122   2HB   ARG  17          2HB       ARG  17 -11.683   4.225  -6.350
  123   1HG   ARG  17          1HG       ARG  17 -11.949   2.436  -7.804
  124   2HG   ARG  17          2HG       ARG  17 -11.281   1.598  -6.404
  125   1HD   ARG  17          1HD       ARG  17 -13.175   0.364  -6.225
  126   2HD   ARG  17          2HD       ARG  17 -14.153   1.843  -6.115
  127    HE   ARG  17           HE       ARG  17 -13.497   0.359  -8.603
  128   1HH1  ARG  17          1HH2      ARG  17 -16.294   1.071  -7.956
  129   2HH1  ARG  17          2HH2      ARG  17 -16.562   2.488  -8.916
  130   1HH2  ARG  17          1HH1      ARG  17 -13.189   3.083  -9.456
  131   2HH2  ARG  17          2HH1      ARG  17 -14.804   3.627  -9.765
  132    H    ILE  18           H        ILE  18 -10.315   3.261  -2.464
  133    HA   ILE  18           HA       ILE  18 -10.065   6.223  -2.495
  134    HB   ILE  18           HB       ILE  18  -8.980   4.188  -0.526
  135   1HG1  ILE  18          1HG1      ILE  18 -11.253   5.237   0.612
  136   2HG1  ILE  18          2HG1      ILE  18 -11.740   5.074  -1.075
  137   1HG2  ILE  18          1HG2      ILE  18  -8.028   6.278  -0.036
  138   2HG2  ILE  18          2HG2      ILE  18  -9.461   6.261   0.990
  139   3HG2  ILE  18          3HG2      ILE  18  -9.475   7.159  -0.527
  140   1HD1  ILE  18          1HD1      ILE  18 -12.182   2.916  -0.501
  141   2HD1  ILE  18          2HD1      ILE  18 -11.156   2.987   0.931
  142   3HD1  ILE  18          3HD1      ILE  18 -10.439   2.700  -0.654
  143    H    ILE  19           H        ILE  19  -7.825   7.118  -2.160
  144    HA   ILE  19           HA       ILE  19  -5.875   5.661  -3.883
  145    HB   ILE  19           HB       ILE  19  -5.905   8.519  -2.863
  146   1HG1  ILE  19          1HG1      ILE  19  -7.907   8.215  -4.158
  147   2HG1  ILE  19          2HG1      ILE  19  -6.738   8.996  -5.221
  148   1HG2  ILE  19          1HG2      ILE  19  -4.634   8.315  -5.356
  149   2HG2  ILE  19          2HG2      ILE  19  -4.052   6.928  -4.436
  150   3HG2  ILE  19          3HG2      ILE  19  -3.852   8.557  -3.794
  151   1HD1  ILE  19          1HD1      ILE  19  -7.430   7.292  -6.619
  152   2HD1  ILE  19          2HD1      ILE  19  -7.796   6.203  -5.281
  153   3HD1  ILE  19          3HD1      ILE  19  -6.123   6.454  -5.781
  154    H    ARG  20           H        ARG  20  -5.081   4.190  -2.214
  155    HA   ARG  20           HA       ARG  20  -3.812   5.425   0.176
  156   1HB   ARG  20          1HB       ARG  20  -4.340   2.586  -0.749
  157   2HB   ARG  20          2HB       ARG  20  -3.496   2.976   0.750
  158   1HG   ARG  20          1HG       ARG  20  -6.122   4.309   0.238
  159   2HG   ARG  20          2HG       ARG  20  -6.142   2.606   0.696
  160   1HD   ARG  20          1HD       ARG  20  -5.345   3.043   2.827
  161   2HD   ARG  20          2HD       ARG  20  -4.394   4.444   2.290
  162    HE   ARG  20           HE       ARG  20  -6.516   5.719   2.171
  163   1HH1  ARG  20          1HH2      ARG  20  -6.148   3.898   4.814
  164   2HH1  ARG  20          2HH2      ARG  20  -7.825   3.607   5.138
  165   1HH2  ARG  20          1HH1      ARG  20  -8.897   4.791   2.062
  166   2HH2  ARG  20          2HH1      ARG  20  -9.381   4.114   3.580
  167    H    TYR  21           H        TYR  21  -1.564   4.264   0.694
  168    HA   TYR  21           HA       TYR  21   0.083   4.427  -1.809
  169   1HB   TYR  21          1HB       TYR  21   0.490   5.256   1.059
  170   2HB   TYR  21          2HB       TYR  21   1.870   5.032  -0.016
  171    HD1  TYR  21           1HD      TYR  21  -1.128   7.036   0.688
  172    HD2  TYR  21           2HD      TYR  21   2.230   6.503  -1.937
  173    HE1  TYR  21           1HE      TYR  21  -1.522   9.288  -0.272
  174    HE2  TYR  21           2HE      TYR  21   1.833   8.754  -2.900
  175    HH   TYR  21           HH       TYR  21   0.643  10.625  -2.768
  176    H    PHE  22           H        PHE  22   1.806   2.927  -2.047
  177    HA   PHE  22           HA       PHE  22   2.112   0.777  -0.023
  178   1HB   PHE  22          1HB       PHE  22   1.438  -0.942  -1.489
  179   2HB   PHE  22          2HB       PHE  22   0.268   0.325  -1.800
  180    HD1  PHE  22           1HD      PHE  22   0.379   1.682  -3.858
  181    HD2  PHE  22           2HD      PHE  22   3.140  -1.526  -3.119
  182    HE1  PHE  22           1HE      PHE  22   1.061   1.721  -6.242
  183    HE2  PHE  22           2HE      PHE  22   3.825  -1.487  -5.502
  184    HZ   PHE  22           HZ       PHE  22   2.788   0.138  -7.064
  185    H    TYR  23           H        TYR  23   4.084  -0.491  -0.441
  186    HA   TYR  23           HA       TYR  23   6.200   1.173  -1.683
  187   1HB   TYR  23          1HB       TYR  23   6.454   0.146   0.546
  188   2HB   TYR  23          2HB       TYR  23   6.255  -1.457  -0.164
  189    HD1  TYR  23           1HD      TYR  23   8.183  -2.639  -0.741
  190    HD2  TYR  23           2HD      TYR  23   8.312   1.653  -0.655
  191    HE1  TYR  23           1HE      TYR  23  10.601  -2.704  -1.279
  192    HE2  TYR  23           2HE      TYR  23  10.733   1.589  -1.196
  193    HH   TYR  23           HH       TYR  23  12.274  -1.078  -2.402
  194    H    ASN  24           H        ASN  24   6.325   0.907  -3.924
  195    HA   ASN  24           HA       ASN  24   5.811  -1.704  -5.185
  196   1HB   ASN  24          1HB       ASN  24   5.152   0.464  -6.194
  197   2HB   ASN  24          2HB       ASN  24   6.846   0.943  -6.263
  198   1HD2  ASN  24          1HD2      ASN  24   5.527   0.861  -8.696
  199   2HD2  ASN  24          2HD2      ASN  24   6.008  -0.498  -9.592
  200    H    ALA  25           H        ALA  25   7.561  -3.007  -4.269
  201    HA   ALA  25           HA       ALA  25  10.274  -2.419  -4.087
  202   1HB   ALA  25          1HB       ALA  25  10.580  -4.860  -4.457
  203   2HB   ALA  25          2HB       ALA  25   8.944  -4.954  -5.107
  204   3HB   ALA  25          3HB       ALA  25   9.197  -4.535  -3.412
  205    H    LYS  26           H        LYS  26   8.348  -2.837  -6.969
  206    HA   LYS  26           HA       LYS  26  10.575  -3.210  -8.808
  207   1HB   LYS  26          1HB       LYS  26   7.756  -3.337  -8.793
  208   2HB   LYS  26          2HB       LYS  26   8.163  -2.068  -9.948
  209   1HG   LYS  26          1HG       LYS  26  10.014  -4.057 -10.512
  210   2HG   LYS  26          2HG       LYS  26   8.547  -4.966 -10.147
  211   1HD   LYS  26          1HD       LYS  26   7.985  -4.523 -12.305
  212   2HD   LYS  26          2HD       LYS  26   7.576  -2.916 -11.704
  213   1HE   LYS  26          1HE       LYS  26  10.067  -2.333 -12.113
  214   2HE   LYS  26          2HE       LYS  26  10.113  -3.816 -13.086
  215   1HZ   LYS  26          1HZ       LYS  26   9.278  -2.482 -14.686
  216   2HZ   LYS  26          2HZ       LYS  26   8.745  -1.304 -13.584
  217   3HZ   LYS  26          3HZ       LYS  26   7.804  -2.687 -13.874
  218    H    ALA  27           H        ALA  27   8.921  -0.472  -7.361
  219    HA   ALA  27           HA       ALA  27  10.196   1.440  -9.248
  220   1HB   ALA  27          1HB       ALA  27   8.530   2.865  -8.547
  221   2HB   ALA  27          2HB       ALA  27   8.622   2.311  -6.874
  222   3HB   ALA  27          3HB       ALA  27   7.761   1.349  -8.077
  223    H    GLY  28           H        GLY  28  10.459   0.283  -5.931
  224   1HA   GLY  28          1HA       GLY  28  12.561   0.443  -4.717
  225   2HA   GLY  28          2HA       GLY  28  12.953   1.884  -5.654
  226    H    LEU  29           H        LEU  29   9.866   2.479  -5.025
  227    HA   LEU  29           HA       LEU  29  10.262   3.421  -2.227
  228   1HB   LEU  29          1HB       LEU  29   9.605   5.669  -2.900
  229   2HB   LEU  29          2HB       LEU  29  10.955   5.156  -3.910
  230    HG   LEU  29           HG       LEU  29   8.184   4.572  -4.877
  231   1HD1  LEU  29          1HD1      LEU  29   9.453   7.267  -5.343
  232   2HD1  LEU  29          2HD1      LEU  29   8.342   7.000  -4.002
  233   3HD1  LEU  29          3HD1      LEU  29   7.793   6.766  -5.661
  234   1HD2  LEU  29          1HD2      LEU  29  10.447   3.961  -5.996
  235   2HD2  LEU  29          2HD2      LEU  29  10.547   5.674  -6.399
  236   3HD2  LEU  29          3HD2      LEU  29   9.207   4.701  -7.006
  237    H    CYS  30           H        CYS  30   7.805   5.059  -2.578
  238    HA   CYS  30           HA       CYS  30   5.817   2.820  -2.595
  239   1HB   CYS  30          1HB       CYS  30   6.012   5.411  -1.036
  240   2HB   CYS  30          2HB       CYS  30   4.580   4.383  -1.017
  241    H    GLN  31           H        GLN  31   3.686   3.346  -3.425
  242    HA   GLN  31           HA       GLN  31   3.455   5.852  -5.022
  243   1HB   GLN  31          1HB       GLN  31   3.487   2.998  -5.976
  244   2HB   GLN  31          2HB       GLN  31   2.540   4.198  -6.856
  245   1HG   GLN  31          1HG       GLN  31   4.448   5.471  -7.403
  246   2HG   GLN  31          2HG       GLN  31   5.421   4.725  -6.134
  247   1HE2  GLN  31          1HE2      GLN  31   6.982   4.246  -7.986
  248   2HE2  GLN  31          2HE2      GLN  31   6.699   2.873  -8.943
  249    H    THR  32           H        THR  32   1.077   5.762  -6.055
  250    HA   THR  32           HA       THR  32  -0.737   5.120  -3.794
  251    HB   THR  32           HB       THR  32  -2.299   6.479  -5.384
  252    HG1  THR  32           1HG      THR  32  -1.337   7.459  -7.030
  253   1HG2  THR  32          1HG2      THR  32  -1.111   7.277  -3.282
  254   2HG2  THR  32          2HG2      THR  32  -1.473   8.531  -4.469
  255   3HG2  THR  32          3HG2      THR  32   0.164   7.887  -4.337
  256    H    PHE  33           H        PHE  33  -2.482   3.714  -4.017
  257    HA   PHE  33           HA       PHE  33  -2.908   2.383  -6.647
  258   1HB   PHE  33          1HB       PHE  33  -2.486   0.228  -5.771
  259   2HB   PHE  33          2HB       PHE  33  -1.202   1.212  -5.078
  260    HD1  PHE  33           1HD      PHE  33  -1.277   1.899  -2.696
  261    HD2  PHE  33           2HD      PHE  33  -4.277  -0.660  -4.403
  262    HE1  PHE  33           1HE      PHE  33  -2.038   1.281  -0.427
  263    HE2  PHE  33           2HE      PHE  33  -5.033  -1.287  -2.126
  264    HZ   PHE  33           HZ       PHE  33  -3.915  -0.316  -0.137
  265    H    VAL  34           H        VAL  34  -4.956   1.067  -6.587
  266    HA   VAL  34           HA       VAL  34  -7.088   2.565  -5.293
  267    HB   VAL  34           HB       VAL  34  -6.934   0.009  -6.918
  268   1HG1  VAL  34          1HG1      VAL  34  -9.332   0.043  -7.075
  269   2HG1  VAL  34          2HG1      VAL  34  -9.424   1.588  -6.229
  270   3HG1  VAL  34          3HG1      VAL  34  -8.935   0.133  -5.360
  271   1HG2  VAL  34          1HG2      VAL  34  -7.211   1.343  -8.754
  272   2HG2  VAL  34          2HG2      VAL  34  -6.544   2.590  -7.701
  273   3HG2  VAL  34          3HG2      VAL  34  -8.289   2.452  -7.906
  274    H    TYR  35           H        TYR  35  -8.046   2.105  -3.339
  275    HA   TYR  35           HA       TYR  35  -7.239  -0.438  -1.959
  276   1HB   TYR  35          1HB       TYR  35  -6.447   1.641  -0.938
  277   2HB   TYR  35          2HB       TYR  35  -8.083   2.299  -0.946
  278    HD1  TYR  35           1HD      TYR  35  -7.276  -1.234  -0.209
  279    HD2  TYR  35           2HD      TYR  35  -8.302   2.596   1.444
  280    HE1  TYR  35           1HE      TYR  35  -7.702  -2.297   1.990
  281    HE2  TYR  35           2HE      TYR  35  -8.728   1.532   3.645
  282    HH   TYR  35           HH       TYR  35  -8.827  -0.372   4.775
  283    H    GLY  36           H        GLY  36  -8.918  -1.685  -0.967
  284   1HA   GLY  36          1HA       GLY  36 -11.655  -1.041  -1.931
  285   2HA   GLY  36          2HA       GLY  36 -11.110  -2.629  -1.395
  286    H    ALA  37           H        ALA  37  -9.917  -0.421   0.801
  287    HA   ALA  37           HA       ALA  37 -10.661   0.313   2.934
  288   1HB   ALA  37          1HB       ALA  37 -12.703   1.251   2.729
  289   2HB   ALA  37          2HB       ALA  37 -13.462  -0.339   2.676
  290   3HB   ALA  37          3HB       ALA  37 -12.889   0.413   1.188
  291    H    CYS  38           H        CYS  38 -10.795  -2.805   1.789
  292    HA   CYS  38           HA       CYS  38 -11.173  -3.866   4.539
  293   1HB   CYS  38          1HB       CYS  38 -12.797  -5.549   3.635
  294   2HB   CYS  38          2HB       CYS  38 -13.398  -3.893   3.541
  295    H    ARG  39           H        ARG  39 -10.676  -6.324   4.503
  296    HA   ARG  39           HA       ARG  39  -8.908  -7.883   4.177
  297   1HB   ARG  39          1HB       ARG  39 -10.179  -7.234   1.521
  298   2HB   ARG  39          2HB       ARG  39  -8.896  -8.440   1.619
  299   1HG   ARG  39          1HG       ARG  39 -10.482  -9.929   2.220
  300   2HG   ARG  39          2HG       ARG  39 -10.612  -9.056   3.746
  301   1HD   ARG  39          1HD       ARG  39 -12.227  -7.471   2.453
  302   2HD   ARG  39          2HD       ARG  39 -12.320  -8.788   1.268
  303    HE   ARG  39           HE       ARG  39 -12.997  -9.083   4.178
  304   1HH1  ARG  39          1HH1      ARG  39 -15.077  -8.939   1.928
  305   2HH1  ARG  39          2HH1      ARG  39 -15.454 -10.618   1.728
  306   1HH2  ARG  39          1HH2      ARG  39 -12.668 -11.722   3.473
  307   2HH2  ARG  39          2HH2      ARG  39 -14.089 -12.195   2.605
  308    H    ALA  40           H        ALA  40  -8.106  -5.003   4.198
  309    HA   ALA  40           HA       ALA  40  -6.128  -4.555   2.130
  310   1HB   ALA  40          1HB       ALA  40  -7.436  -3.147   4.155
  311   2HB   ALA  40          2HB       ALA  40  -6.196  -2.502   3.082
  312   3HB   ALA  40          3HB       ALA  40  -5.746  -3.149   4.659
  313    H    LYS  41           H        LYS  41  -3.803  -4.509   2.458
  314    HA   LYS  41           HA       LYS  41  -2.854  -6.495   4.492
  315   1HB   LYS  41          1HB       LYS  41  -1.533  -5.558   1.926
  316   2HB   LYS  41          2HB       LYS  41  -1.099  -6.969   2.892
  317   1HG   LYS  41          1HG       LYS  41  -3.384  -7.904   2.429
  318   2HG   LYS  41          2HG       LYS  41  -3.672  -6.545   1.341
  319   1HD   LYS  41          1HD       LYS  41  -2.678  -7.745  -0.291
  320   2HD   LYS  41          2HD       LYS  41  -1.162  -7.588   0.598
  321   1HE   LYS  41          1HE       LYS  41  -2.225  -9.616   2.003
  322   2HE   LYS  41          2HE       LYS  41  -3.051  -9.901   0.458
  323   1HZ   LYS  41          1HZ       LYS  41  -0.143  -9.742   1.010
  324   2HZ   LYS  41          2HZ       LYS  41  -0.754  -9.497  -0.557
  325   3HZ   LYS  41          3HZ       LYS  41  -1.000 -10.982   0.232
  326    H    ARG  42           H        ARG  42  -0.190  -5.886   4.600
  327    HA   ARG  42           HA       ARG  42  -0.164  -3.408   6.138
  328   1HB   ARG  42          1HB       ARG  42   2.139  -5.160   5.240
  329   2HB   ARG  42          2HB       ARG  42   2.098  -4.093   6.642
  330   1HG   ARG  42          1HG       ARG  42   0.102  -5.511   7.439
  331   2HG   ARG  42          2HG       ARG  42   0.587  -6.675   6.206
  332   1HD   ARG  42          1HD       ARG  42   2.952  -5.931   7.612
  333   2HD   ARG  42          2HD       ARG  42   1.709  -6.293   8.827
  334    HE   ARG  42           HE       ARG  42   2.590  -8.155   6.654
  335   1HH1  ARG  42          1HH2      ARG  42  -0.099  -7.723   8.539
  336   2HH1  ARG  42          2HH2      ARG  42  -0.007  -9.241   9.367
  337   1HH2  ARG  42          1HH1      ARG  42   3.154 -10.005   8.162
  338   2HH2  ARG  42          2HH1      ARG  42   1.838 -10.533   9.155
  339    H    ASN  43           H        ASN  43   0.383  -4.208   2.825
  340    HA   ASN  43           HA       ASN  43   2.127  -1.861   2.333
  341   1HB   ASN  43          1HB       ASN  43   2.102  -4.272   1.232
  342   2HB   ASN  43          2HB       ASN  43   0.855  -3.559   0.206
  343   1HD2  ASN  43          1HD2      ASN  43   3.025  -4.182  -1.243
  344   2HD2  ASN  43          2HD2      ASN  43   4.013  -2.839  -1.554
  345    H    ASN  44           H        ASN  44  -0.157  -0.928   3.412
  346    HA   ASN  44           HA       ASN  44  -1.481   0.455   1.135
  347   1HB   ASN  44          1HB       ASN  44  -2.906  -1.451   1.531
  348   2HB   ASN  44          2HB       ASN  44  -2.792  -1.250   3.278
  349   1HD2  ASN  44          1HD2      ASN  44  -5.323  -1.328   1.950
  350   2HD2  ASN  44          2HD2      ASN  44  -6.053   0.209   2.091
  351    H    PHE  45           H        PHE  45  -0.021   2.125   2.162
  352    HA   PHE  45           HA       PHE  45  -0.859   3.074   4.843
  353   1HB   PHE  45          1HB       PHE  45   1.254   4.167   2.965
  354   2HB   PHE  45          2HB       PHE  45   1.172   4.352   4.718
  355    HD1  PHE  45           1HD      PHE  45   1.932   2.041   1.943
  356    HD2  PHE  45           2HD      PHE  45   1.764   2.496   6.212
  357    HE1  PHE  45           1HE      PHE  45   3.212  -0.067   2.217
  358    HE2  PHE  45           2HE      PHE  45   3.047   0.389   6.486
  359    HZ   PHE  45           HZ       PHE  45   3.769  -0.902   4.489
  360    H    LYS  46           H        LYS  46  -1.877   5.072   5.165
  361    HA   LYS  46           HA       LYS  46  -3.559   6.116   3.096
  362   1HB   LYS  46          1HB       LYS  46  -2.611   7.312   5.721
  363   2HB   LYS  46          2HB       LYS  46  -4.019   7.851   4.807
  364   1HG   LYS  46          1HG       LYS  46  -5.039   5.619   5.062
  365   2HG   LYS  46          2HG       LYS  46  -3.623   5.072   5.963
  366   1HD   LYS  46          1HD       LYS  46  -4.202   7.255   7.411
  367   2HD   LYS  46          2HD       LYS  46  -5.821   6.910   6.802
  368   1HE   LYS  46          1HE       LYS  46  -5.881   4.785   7.848
  369   2HE   LYS  46          2HE       LYS  46  -4.117   4.734   8.036
  370   1HZ   LYS  46          1HZ       LYS  46  -4.454   6.859   9.393
  371   2HZ   LYS  46          2HZ       LYS  46  -4.907   5.394  10.126
  372   3HZ   LYS  46          3HZ       LYS  46  -6.091   6.421   9.467
  373    H    SER  47           H        SER  47  -0.303   6.932   4.139
  374    HA   SER  47           HA       SER  47  -0.199   8.983   1.957
  375   1HB   SER  47          1HB       SER  47   1.001  10.465   3.483
  376   2HB   SER  47          2HB       SER  47  -0.534  10.004   4.211
  377    HG   SER  47           HG       SER  47   0.480   8.587   5.532
  378    H    ALA  48           H        ALA  48   1.982   9.326   1.135
  379    HA   ALA  48           HA       ALA  48   3.541   6.921   0.879
  380   1HB   ALA  48          1HB       ALA  48   4.912   9.448   0.315
  381   2HB   ALA  48          2HB       ALA  48   3.280   9.407  -0.353
  382   3HB   ALA  48          3HB       ALA  48   4.446   8.160  -0.796
  383    H    GLU  49           H        GLU  49   3.615   9.609   3.119
  384    HA   GLU  49           HA       GLU  49   6.329   9.292   4.058
  385   1HB   GLU  49          1HB       GLU  49   3.810  10.402   5.342
  386   2HB   GLU  49          2HB       GLU  49   5.445  10.663   5.950
  387   1HG   GLU  49          1HG       GLU  49   5.919  12.205   4.344
  388   2HG   GLU  49          2HG       GLU  49   5.089  11.289   3.086
  389    H    ASP  50           H        ASP  50   3.337   7.607   4.695
  390    HA   ASP  50           HA       ASP  50   4.361   6.333   7.161
  391   1HB   ASP  50          1HB       ASP  50   1.993   7.098   6.833
  392   2HB   ASP  50          2HB       ASP  50   1.823   5.897   5.553
  393    H    CYS  51           H        CYS  51   4.045   5.681   3.746
  394    HA   CYS  51           HA       CYS  51   4.421   2.776   3.995
  395   1HB   CYS  51          1HB       CYS  51   3.116   3.704   2.172
  396   2HB   CYS  51          2HB       CYS  51   4.447   4.761   1.698
  397    H    MET  52           H        MET  52   6.378   5.589   2.974
  398    HA   MET  52           HA       MET  52   8.762   4.108   2.343
  399   1HB   MET  52          1HB       MET  52   8.146   6.971   3.105
  400   2HB   MET  52          2HB       MET  52   9.768   6.447   2.649
  401   1HG   MET  52          1HG       MET  52   8.393   5.376   0.601
  402   2HG   MET  52          2HG       MET  52   7.317   6.722   0.974
  403   1HE   MET  52          1HE       MET  52  10.539   5.740  -1.010
  404   2HE   MET  52          2HE       MET  52  10.862   5.611   0.716
  405   3HE   MET  52          3HE       MET  52  11.712   6.820  -0.244
  406    H    ARG  53           H        ARG  53   7.873   5.989   5.272
  407    HA   ARG  53           HA       ARG  53  10.191   5.518   6.803
  408   1HB   ARG  53          1HB       ARG  53   8.490   7.067   7.500
  409   2HB   ARG  53          2HB       ARG  53   7.260   5.802   7.520
  410   1HG   ARG  53          1HG       ARG  53   8.067   4.870   9.496
  411   2HG   ARG  53          2HG       ARG  53   9.698   5.490   9.242
  412   1HD   ARG  53          1HD       ARG  53   9.160   7.194  10.647
  413   2HD   ARG  53          2HD       ARG  53   8.027   7.770   9.406
  414    HE   ARG  53           HE       ARG  53   6.440   5.981  10.488
  415   1HH1  ARG  53          1HH2      ARG  53   6.638   8.711  11.838
  416   2HH1  ARG  53          2HH2      ARG  53   6.835   8.248  13.496
  417   1HH2  ARG  53          1HH1      ARG  53   7.660   4.962  12.756
  418   2HH2  ARG  53          2HH1      ARG  53   7.413   6.125  14.016
  419    H    THR  54           H        THR  54   7.751   3.264   5.824
  420    HA   THR  54           HA       THR  54   8.695   1.285   7.868
  421    HB   THR  54           HB       THR  54   6.164   1.683   6.270
  422    HG1  THR  54           1HG      THR  54   6.970   1.667   8.947
  423   1HG2  THR  54          1HG2      THR  54   5.390  -0.486   7.272
  424   2HG2  THR  54          2HG2      THR  54   7.056  -0.798   7.759
  425   3HG2  THR  54          3HG2      THR  54   6.646  -0.676   6.049
  426    H    CYS  55           H        CYS  55   7.951   1.666   4.389
  427    HA   CYS  55           HA       CYS  55   9.306  -0.925   3.830
  428   1HB   CYS  55          1HB       CYS  55   7.797   0.989   2.022
  429   2HB   CYS  55          2HB       CYS  55   8.266  -0.664   1.635
  430    H    GLY  56           H        GLY  56   9.495   2.532   3.009
  431   1HA   GLY  56          1HA       GLY  56  11.455   2.636   1.088
  432   2HA   GLY  56          2HA       GLY  56  11.403   3.795   2.416
  433    H    GLY  57           H        GLY  57  13.030   1.040   1.101
  434   1HA   GLY  57          1HA       GLY  57  14.740   0.802   3.527
  435   2HA   GLY  57          2HA       GLY  57  14.679  -0.367   2.207
  436    H    ALA  58           H        ALA  58  16.593  -0.330   1.121
  437    HA   ALA  58           HA       ALA  58  18.528   0.516   0.059
  438   1HB   ALA  58          1HB       ALA  58  17.692   1.813  -1.592
  439   2HB   ALA  58          2HB       ALA  58  17.524   3.164  -0.472
  440   3HB   ALA  58          3HB       ALA  58  16.211   2.002  -0.655
  Start of MODEL   16
    1   1H    ARG   1          1H        ARG   1  14.321  -4.747   7.115
    2   2H    ARG   1          2H        ARG   1  14.196  -6.083   6.074
    3   3H    ARG   1          3H        ARG   1  13.484  -6.135   7.616
    4    HA   ARG   1           HA       ARG   1  12.051  -4.201   6.887
    5   1HB   ARG   1          1HB       ARG   1  13.236  -3.361   5.060
    6   2HB   ARG   1          2HB       ARG   1  13.622  -4.962   4.441
    7   1HG   ARG   1          1HG       ARG   1  11.848  -4.870   3.061
    8   2HG   ARG   1          2HG       ARG   1  10.764  -4.632   4.427
    9   1HD   ARG   1          1HD       ARG   1  10.604  -2.740   2.828
   10   2HD   ARG   1          2HD       ARG   1  11.269  -2.193   4.380
   11    HE   ARG   1           HE       ARG   1  13.310  -1.787   3.254
   12   1HH1  ARG   1          1HH2      ARG   1  13.602  -4.672   2.361
   13   2HH1  ARG   1          2HH2      ARG   1  13.680  -4.489   0.640
   14   1HH2  ARG   1          1HH1      ARG   1  12.434  -1.253   0.658
   15   2HH2  ARG   1          2HH1      ARG   1  13.017  -2.555  -0.324
   16    HA   PRO   2           HA       PRO   2   9.193  -7.532   6.711
   17   1HB   PRO   2          1HB       PRO   2   6.986  -6.117   5.946
   18   2HB   PRO   2          2HB       PRO   2   7.639  -6.079   7.592
   19   1HG   PRO   2          1HG       PRO   2   7.966  -4.130   5.351
   20   2HG   PRO   2          2HG       PRO   2   7.714  -3.824   7.078
   21   1HD   PRO   2          1HD       PRO   2  10.151  -3.644   5.869
   22   2HD   PRO   2          2HD       PRO   2   9.945  -4.114   7.573
   23    H    ASP   3           H        ASP   3   7.808  -8.681   5.173
   24    HA   ASP   3           HA       ASP   3   8.811  -8.460   2.411
   25   1HB   ASP   3          1HB       ASP   3   7.197 -10.385   4.067
   26   2HB   ASP   3          2HB       ASP   3   7.187 -10.537   2.310
   27    H    PHE   4           H        PHE   4   5.927  -7.666   4.262
   28    HA   PHE   4           HA       PHE   4   4.090  -7.560   2.037
   29   1HB   PHE   4          1HB       PHE   4   2.656  -6.379   3.581
   30   2HB   PHE   4          2HB       PHE   4   3.512  -7.623   4.482
   31    HD1  PHE   4           1HD      PHE   4   3.648  -3.949   3.643
   32    HD2  PHE   4           2HD      PHE   4   4.772  -7.087   6.369
   33    HE1  PHE   4           1HE      PHE   4   4.485  -2.271   5.246
   34    HE2  PHE   4           2HE      PHE   4   5.613  -5.386   7.964
   35    HZ   PHE   4           HZ       PHE   4   5.462  -2.977   7.398
   36    H    CYS   5           H        CYS   5   6.738  -5.585   2.887
   37    HA   CYS   5           HA       CYS   5   5.700  -3.132   1.636
   38   1HB   CYS   5          1HB       CYS   5   8.202  -4.084   2.986
   39   2HB   CYS   5          2HB       CYS   5   8.273  -2.615   2.011
   40    H    LEU   6           H        LEU   6   7.511  -5.964   0.653
   41    HA   LEU   6           HA       LEU   6   8.442  -4.620  -1.830
   42   1HB   LEU   6          1HB       LEU   6   8.829  -7.478  -0.905
   43   2HB   LEU   6          2HB       LEU   6   9.810  -6.586  -2.071
   44    HG   LEU   6           HG       LEU   6   9.477  -5.758   0.823
   45   1HD1  LEU   6          1HD1      LEU   6  10.753  -8.037   0.070
   46   2HD1  LEU   6          2HD1      LEU   6  11.267  -7.046   1.436
   47   3HD1  LEU   6          3HD1      LEU   6  12.059  -6.868  -0.128
   48   1HD2  LEU   6          1HD2      LEU   6  11.615  -5.010  -1.192
   49   2HD2  LEU   6          2HD2      LEU   6  11.287  -4.244   0.362
   50   3HD2  LEU   6          3HD2      LEU   6  10.145  -4.062  -0.969
   51    H    GLU   7           H        GLU   7   5.699  -6.171  -0.775
   52    HA   GLU   7           HA       GLU   7   5.147  -7.599  -3.320
   53   1HB   GLU   7          1HB       GLU   7   4.253  -7.615  -0.533
   54   2HB   GLU   7          2HB       GLU   7   2.912  -7.722  -1.675
   55   1HG   GLU   7          1HG       GLU   7   3.741  -9.705  -2.641
   56   2HG   GLU   7          2HG       GLU   7   5.371  -9.432  -2.022
   57    HA   PRO   8           HA       PRO   8   2.511  -4.509  -4.987
   58   1HB   PRO   8          1HB       PRO   8   0.379  -5.960  -5.911
   59   2HB   PRO   8          2HB       PRO   8   1.980  -5.999  -6.678
   60   1HG   PRO   8          1HG       PRO   8   0.693  -7.953  -4.835
   61   2HG   PRO   8          2HG       PRO   8   1.740  -8.242  -6.231
   62   1HD   PRO   8          1HD       PRO   8   2.561  -8.351  -3.603
   63   2HD   PRO   8          2HD       PRO   8   3.641  -8.041  -4.980
   64    HA   PRO   9           HA       PRO   9  -0.613  -3.342  -2.113
   65   1HB   PRO   9          1HB       PRO   9  -2.445  -2.061  -3.709
   66   2HB   PRO   9          2HB       PRO   9  -0.876  -1.355  -3.275
   67   1HG   PRO   9          1HG       PRO   9  -1.722  -2.743  -5.781
   68   2HG   PRO   9          2HG       PRO   9  -0.700  -1.310  -5.576
   69   1HD   PRO   9          1HD       PRO   9   0.278  -3.813  -6.075
   70   2HD   PRO   9          2HD       PRO   9   1.182  -2.570  -5.181
   71    H    TYR  10           H        TYR  10  -3.303  -3.351  -2.111
   72    HA   TYR  10           HA       TYR  10  -4.346  -5.768  -3.475
   73   1HB   TYR  10          1HB       TYR  10  -3.075  -6.497  -1.433
   74   2HB   TYR  10          2HB       TYR  10  -4.179  -5.530  -0.455
   75    HD1  TYR  10           1HD      TYR  10  -6.146  -6.502   0.352
   76    HD2  TYR  10           2HD      TYR  10  -4.209  -8.218  -3.078
   77    HE1  TYR  10           1HE      TYR  10  -7.773  -8.372   0.368
   78    HE2  TYR  10           2HE      TYR  10  -5.838 -10.088  -3.060
   79    HH   TYR  10           HH       TYR  10  -7.340 -11.195  -1.114
   80    H    THR  11           H        THR  11  -5.929  -4.383  -4.376
   81    HA   THR  11           HA       THR  11  -7.542  -2.510  -2.954
   82    HB   THR  11           HB       THR  11  -7.786  -4.199  -5.443
   83    HG1  THR  11           1HG      THR  11  -6.610  -2.120  -5.162
   84   1HG2  THR  11          1HG2      THR  11  -9.939  -3.014  -5.936
   85   2HG2  THR  11          2HG2      THR  11  -9.948  -2.428  -4.273
   86   3HG2  THR  11          3HG2      THR  11 -10.063  -4.157  -4.598
   87    H    GLY  12           H        GLY  12  -7.458  -5.977  -3.073
   88   1HA   GLY  12          1HA       GLY  12  -8.662  -7.591  -1.858
   89   2HA   GLY  12          2HA       GLY  12  -9.244  -6.275  -0.838
   90    HA   PRO  13           HA       PRO  13 -12.459  -7.877  -3.986
   91   1HB   PRO  13          1HB       PRO  13 -13.831  -9.621  -2.369
   92   2HB   PRO  13          2HB       PRO  13 -12.504 -10.119  -3.438
   93   1HG   PRO  13          1HG       PRO  13 -12.485  -9.549  -0.503
   94   2HG   PRO  13          2HG       PRO  13 -11.685 -10.849  -1.401
   95   1HD   PRO  13          1HD       PRO  13 -10.389  -8.620  -0.540
   96   2HD   PRO  13          2HD       PRO  13  -9.921  -9.499  -2.015
   97    H    CYS  14           H        CYS  14 -12.634  -5.491  -3.033
   98    HA   CYS  14           HA       CYS  14 -15.077  -5.364  -1.292
   99   1HB   CYS  14          1HB       CYS  14 -12.546  -3.735  -1.476
  100   2HB   CYS  14          2HB       CYS  14 -14.007  -3.031  -0.785
  101    H    LYS  15           H        LYS  15 -15.955  -2.873  -1.681
  102    HA   LYS  15           HA       LYS  15 -16.204  -2.564  -4.659
  103   1HB   LYS  15          1HB       LYS  15 -18.202  -3.458  -3.432
  104   2HB   LYS  15          2HB       LYS  15 -18.236  -1.971  -2.483
  105   1HG   LYS  15          1HG       LYS  15 -19.079  -0.739  -4.215
  106   2HG   LYS  15          2HG       LYS  15 -18.116  -1.596  -5.420
  107   1HD   LYS  15          1HD       LYS  15 -19.645  -3.529  -5.260
  108   2HD   LYS  15          2HD       LYS  15 -20.607  -2.670  -4.056
  109   1HE   LYS  15          1HE       LYS  15 -20.986  -0.850  -5.773
  110   2HE   LYS  15          2HE       LYS  15 -20.189  -1.894  -6.967
  111   1HZ   LYS  15          1HZ       LYS  15 -22.480  -2.413  -7.073
  112   2HZ   LYS  15          2HZ       LYS  15 -22.642  -2.445  -5.383
  113   3HZ   LYS  15          3HZ       LYS  15 -21.782  -3.674  -6.179
  114    H    ALA  16           H        ALA  16 -14.616  -1.195  -2.234
  115    HA   ALA  16           HA       ALA  16 -15.480   1.616  -2.688
  116   1HB   ALA  16          1HB       ALA  16 -14.001   0.038  -0.668
  117   2HB   ALA  16          2HB       ALA  16 -15.064   1.427  -0.447
  118   3HB   ALA  16          3HB       ALA  16 -13.386   1.668  -0.930
  119    H    ARG  17           H        ARG  17 -13.667   3.224  -3.076
  120    HA   ARG  17           HA       ARG  17 -11.331   2.088  -4.535
  121   1HB   ARG  17          1HB       ARG  17 -13.698   3.398  -5.642
  122   2HB   ARG  17          2HB       ARG  17 -12.209   4.227  -6.102
  123   1HG   ARG  17          1HG       ARG  17 -12.429   2.590  -7.775
  124   2HG   ARG  17          2HG       ARG  17 -11.332   1.821  -6.627
  125   1HD   ARG  17          1HD       ARG  17 -12.826   0.148  -6.280
  126   2HD   ARG  17          2HD       ARG  17 -14.091   1.323  -5.869
  127    HE   ARG  17           HE       ARG  17 -13.495   1.192  -8.733
  128   1HH1  ARG  17          1HH2      ARG  17 -15.955   1.214  -6.546
  129   2HH1  ARG  17          2HH2      ARG  17 -16.941   0.026  -7.330
  130   1HH2  ARG  17          1HH1      ARG  17 -14.470  -0.927  -9.572
  131   2HH2  ARG  17          2HH1      ARG  17 -16.099  -1.188  -9.045
  132    H    ILE  18           H        ILE  18 -10.621   3.024  -2.285
  133    HA   ILE  18           HA       ILE  18 -10.405   5.966  -2.195
  134    HB   ILE  18           HB       ILE  18  -9.258   3.792  -0.414
  135   1HG1  ILE  18          1HG1      ILE  18 -11.817   5.370  -0.048
  136   2HG1  ILE  18          2HG1      ILE  18 -11.773   3.742  -0.725
  137   1HG2  ILE  18          1HG2      ILE  18  -9.917   6.155   0.997
  138   2HG2  ILE  18          2HG2      ILE  18  -9.037   6.665  -0.444
  139   3HG2  ILE  18          3HG2      ILE  18  -8.306   5.515   0.676
  140   1HD1  ILE  18          1HD1      ILE  18 -11.950   3.051   1.431
  141   2HD1  ILE  18          2HD1      ILE  18 -11.472   4.626   2.066
  142   3HD1  ILE  18          3HD1      ILE  18 -10.242   3.472   1.551
  143    H    ILE  19           H        ILE  19  -8.318   7.047  -2.156
  144    HA   ILE  19           HA       ILE  19  -6.309   5.736  -3.895
  145    HB   ILE  19           HB       ILE  19  -6.539   8.557  -2.794
  146   1HG1  ILE  19          1HG1      ILE  19  -8.475   7.782  -4.214
  147   2HG1  ILE  19          2HG1      ILE  19  -7.574   9.127  -4.912
  148   1HG2  ILE  19          1HG2      ILE  19  -5.186   8.750  -5.138
  149   2HG2  ILE  19          2HG2      ILE  19  -4.642   7.160  -4.600
  150   3HG2  ILE  19          3HG2      ILE  19  -4.388   8.573  -3.575
  151   1HD1  ILE  19          1HD1      ILE  19  -6.776   7.860  -6.639
  152   2HD1  ILE  19          2HD1      ILE  19  -8.178   6.851  -6.278
  153   3HD1  ILE  19          3HD1      ILE  19  -6.593   6.423  -5.630
  154    H    ARG  20           H        ARG  20  -5.379   4.268  -2.312
  155    HA   ARG  20           HA       ARG  20  -4.065   5.532   0.045
  156   1HB   ARG  20          1HB       ARG  20  -4.798   2.740  -0.814
  157   2HB   ARG  20          2HB       ARG  20  -3.660   3.000   0.507
  158   1HG   ARG  20          1HG       ARG  20  -6.309   4.437   0.463
  159   2HG   ARG  20          2HG       ARG  20  -6.203   2.784   1.068
  160   1HD   ARG  20          1HD       ARG  20  -5.346   3.532   3.034
  161   2HD   ARG  20          2HD       ARG  20  -4.057   4.401   2.177
  162    HE   ARG  20           HE       ARG  20  -5.759   6.241   1.818
  163   1HH1  ARG  20          1HH2      ARG  20  -7.559   3.919   3.269
  164   2HH1  ARG  20          2HH2      ARG  20  -8.049   4.855   4.641
  165   1HH2  ARG  20          1HH1      ARG  20  -5.822   7.436   4.013
  166   2HH2  ARG  20          2HH1      ARG  20  -7.067   6.844   5.063
  167    H    TYR  21           H        TYR  21  -1.817   4.269   0.497
  168    HA   TYR  21           HA       TYR  21  -0.209   4.526  -2.024
  169   1HB   TYR  21          1HB       TYR  21   0.103   5.379   0.818
  170   2HB   TYR  21          2HB       TYR  21   1.568   4.927  -0.052
  171    HD1  TYR  21           1HD      TYR  21  -1.164   7.347   0.217
  172    HD2  TYR  21           2HD      TYR  21   2.271   6.159  -2.063
  173    HE1  TYR  21           1HE      TYR  21  -1.155   9.555  -0.919
  174    HE2  TYR  21           2HE      TYR  21   2.282   8.364  -3.200
  175    HH   TYR  21           HH       TYR  21   0.802  10.186  -3.686
  176    H    PHE  22           H        PHE  22   1.553   3.057  -2.304
  177    HA   PHE  22           HA       PHE  22   1.854   0.809  -0.391
  178   1HB   PHE  22          1HB       PHE  22   1.205  -0.845  -1.960
  179   2HB   PHE  22          2HB       PHE  22   0.003   0.422  -2.178
  180    HD1  PHE  22           1HD      PHE  22   2.779  -1.392  -3.689
  181    HD2  PHE  22           2HD      PHE  22   0.191   2.013  -4.098
  182    HE1  PHE  22           1HE      PHE  22   3.422  -1.191  -6.076
  183    HE2  PHE  22           2HE      PHE  22   0.836   2.217  -6.484
  184    HZ   PHE  22           HZ       PHE  22   2.450   0.614  -7.475
  185    H    TYR  23           H        TYR  23   3.687  -0.705  -1.395
  186    HA   TYR  23           HA       TYR  23   5.921   1.112  -2.183
  187   1HB   TYR  23          1HB       TYR  23   5.943  -0.582  -0.279
  188   2HB   TYR  23          2HB       TYR  23   5.926  -1.837  -1.513
  189    HD1  TYR  23           1HD      TYR  23   8.119  -1.536   0.497
  190    HD2  TYR  23           2HD      TYR  23   7.702   0.173  -3.416
  191    HE1  TYR  23           1HE      TYR  23  10.581  -1.306   0.332
  192    HE2  TYR  23           2HE      TYR  23  10.154   0.364  -3.597
  193    HH   TYR  23           HH       TYR  23  12.294  -1.062  -1.249
  194    H    ASN  24           H        ASN  24   5.737   1.383  -4.505
  195    HA   ASN  24           HA       ASN  24   5.323  -1.021  -6.186
  196   1HB   ASN  24          1HB       ASN  24   4.451   1.352  -6.647
  197   2HB   ASN  24          2HB       ASN  24   6.114   1.782  -7.022
  198   1HD2  ASN  24          1HD2      ASN  24   3.911   1.762  -8.970
  199   2HD2  ASN  24          2HD2      ASN  24   4.298   0.595 -10.140
  200    H    ALA  25           H        ALA  25   7.407  -1.894  -5.014
  201    HA   ALA  25           HA       ALA  25   9.969  -0.854  -5.349
  202   1HB   ALA  25          1HB       ALA  25   8.705  -3.500  -5.083
  203   2HB   ALA  25          2HB       ALA  25  10.113  -2.841  -4.249
  204   3HB   ALA  25          3HB       ALA  25  10.291  -3.551  -5.857
  205    H    LYS  26           H        LYS  26   7.783  -2.125  -7.755
  206    HA   LYS  26           HA       LYS  26   9.621  -2.552  -9.916
  207   1HB   LYS  26          1HB       LYS  26   6.833  -2.585  -9.397
  208   2HB   LYS  26          2HB       LYS  26   7.061  -1.443 -10.722
  209   1HG   LYS  26          1HG       LYS  26   7.990  -3.071 -12.129
  210   2HG   LYS  26          2HG       LYS  26   8.450  -4.113 -10.781
  211   1HD   LYS  26          1HD       LYS  26   6.369  -5.060 -10.638
  212   2HD   LYS  26          2HD       LYS  26   5.545  -3.559 -11.062
  213   1HE   LYS  26          1HE       LYS  26   7.080  -4.431 -13.335
  214   2HE   LYS  26          2HE       LYS  26   6.079  -5.781 -12.763
  215   1HZ   LYS  26          1HZ       LYS  26   4.947  -4.143 -14.296
  216   2HZ   LYS  26          2HZ       LYS  26   5.058  -3.005 -13.039
  217   3HZ   LYS  26          3HZ       LYS  26   4.157  -4.429 -12.824
  218    H    ALA  27           H        ALA  27   7.933   0.299  -8.636
  219    HA   ALA  27           HA       ALA  27   9.010   2.090 -10.713
  220   1HB   ALA  27          1HB       ALA  27   7.534   3.619  -9.758
  221   2HB   ALA  27          2HB       ALA  27   7.781   2.990  -8.129
  222   3HB   ALA  27          3HB       ALA  27   6.771   2.106  -9.273
  223    H    GLY  28           H        GLY  28   9.732   1.165  -7.370
  224   1HA   GLY  28          1HA       GLY  28  12.186   1.339  -6.797
  225   2HA   GLY  28          2HA       GLY  28  12.125   2.958  -7.484
  226    H    LEU  29           H        LEU  29   9.241   2.894  -6.051
  227    HA   LEU  29           HA       LEU  29  10.153   3.234  -3.261
  228   1HB   LEU  29          1HB       LEU  29   9.405   5.601  -3.253
  229   2HB   LEU  29          2HB       LEU  29  10.706   5.344  -4.415
  230    HG   LEU  29           HG       LEU  29   8.071   4.860  -5.583
  231   1HD1  LEU  29          1HD1      LEU  29   8.077   6.933  -3.744
  232   2HD1  LEU  29          2HD1      LEU  29   6.971   6.781  -5.109
  233   3HD1  LEU  29          3HD1      LEU  29   8.435   7.752  -5.265
  234   1HD2  LEU  29          1HD2      LEU  29   9.266   5.496  -7.390
  235   2HD2  LEU  29          2HD2      LEU  29  10.657   5.727  -6.330
  236   3HD2  LEU  29          3HD2      LEU  29   9.576   7.078  -6.673
  237    H    CYS  30           H        CYS  30   7.703   5.000  -2.926
  238    HA   CYS  30           HA       CYS  30   5.692   2.793  -2.957
  239   1HB   CYS  30          1HB       CYS  30   6.002   5.323  -1.310
  240   2HB   CYS  30          2HB       CYS  30   4.637   4.217  -1.159
  241    H    GLN  31           H        GLN  31   3.540   3.303  -3.718
  242    HA   GLN  31           HA       GLN  31   3.230   5.926  -5.114
  243   1HB   GLN  31          1HB       GLN  31   2.957   3.133  -6.261
  244   2HB   GLN  31          2HB       GLN  31   2.380   4.581  -7.085
  245   1HG   GLN  31          1HG       GLN  31   4.961   5.267  -6.360
  246   2HG   GLN  31          2HG       GLN  31   5.113   3.563  -6.788
  247   1HE2  GLN  31          1HE2      GLN  31   6.413   4.958  -8.603
  248   2HE2  GLN  31          2HE2      GLN  31   5.512   5.272 -10.006
  249    H    THR  32           H        THR  32   0.845   5.903  -6.089
  250    HA   THR  32           HA       THR  32  -0.951   5.254  -3.829
  251    HB   THR  32           HB       THR  32  -2.474   6.514  -5.682
  252    HG1  THR  32           1HG      THR  32  -1.274   7.229  -7.228
  253   1HG2  THR  32          1HG2      THR  32  -2.044   7.341  -3.425
  254   2HG2  THR  32          2HG2      THR  32  -1.772   8.638  -4.588
  255   3HG2  THR  32          3HG2      THR  32  -0.400   7.788  -3.877
  256    H    PHE  33           H        PHE  33  -2.771   3.883  -4.065
  257    HA   PHE  33           HA       PHE  33  -3.129   2.482  -6.658
  258   1HB   PHE  33          1HB       PHE  33  -2.618   0.351  -5.783
  259   2HB   PHE  33          2HB       PHE  33  -1.378   1.386  -5.088
  260    HD1  PHE  33           1HD      PHE  33  -1.511   2.100  -2.706
  261    HD2  PHE  33           2HD      PHE  33  -4.337  -0.653  -4.412
  262    HE1  PHE  33           1HE      PHE  33  -2.227   1.430  -0.433
  263    HE2  PHE  33           2HE      PHE  33  -5.054  -1.323  -2.132
  264    HZ   PHE  33           HZ       PHE  33  -3.997  -0.282  -0.143
  265    H    VAL  34           H        VAL  34  -5.104   1.062  -6.579
  266    HA   VAL  34           HA       VAL  34  -7.316   2.491  -5.355
  267    HB   VAL  34           HB       VAL  34  -7.275  -0.241  -6.671
  268   1HG1  VAL  34          1HG1      VAL  34  -9.505  -0.079  -6.409
  269   2HG1  VAL  34          2HG1      VAL  34  -9.489   1.357  -7.433
  270   3HG1  VAL  34          3HG1      VAL  34  -9.332   1.519  -5.683
  271   1HG2  VAL  34          1HG2      VAL  34  -6.722   2.447  -7.754
  272   2HG2  VAL  34          2HG2      VAL  34  -7.962   1.554  -8.634
  273   3HG2  VAL  34          3HG2      VAL  34  -6.351   0.864  -8.435
  274    H    TYR  35           H        TYR  35  -8.000   2.194  -3.291
  275    HA   TYR  35           HA       TYR  35  -7.245  -0.321  -1.859
  276   1HB   TYR  35          1HB       TYR  35  -6.514   1.791  -0.894
  277   2HB   TYR  35          2HB       TYR  35  -8.151   2.437  -0.979
  278    HD1  TYR  35           1HD      TYR  35  -7.346  -1.055  -0.055
  279    HD2  TYR  35           2HD      TYR  35  -8.444   2.844   1.375
  280    HE1  TYR  35           1HE      TYR  35  -7.840  -2.011   2.180
  281    HE2  TYR  35           2HE      TYR  35  -8.937   1.889   3.607
  282    HH   TYR  35           HH       TYR  35  -8.570   0.042   4.934
  283    H    GLY  36           H        GLY  36  -8.895  -1.639  -0.971
  284   1HA   GLY  36          1HA       GLY  36 -11.609  -1.154  -2.025
  285   2HA   GLY  36          2HA       GLY  36 -11.054  -2.634  -1.245
  286    H    ALA  37           H        ALA  37 -10.009  -0.194   0.717
  287    HA   ALA  37           HA       ALA  37 -10.876   0.812   2.687
  288   1HB   ALA  37          1HB       ALA  37 -13.631  -0.111   1.948
  289   2HB   ALA  37          2HB       ALA  37 -12.848   1.094   0.923
  290   3HB   ALA  37          3HB       ALA  37 -13.118   1.431   2.633
  291    H    CYS  38           H        CYS  38 -10.920  -2.404   1.887
  292    HA   CYS  38           HA       CYS  38 -11.258  -3.202   4.708
  293   1HB   CYS  38          1HB       CYS  38 -12.793  -5.134   3.474
  294   2HB   CYS  38          2HB       CYS  38 -13.437  -3.759   4.360
  295    H    ARG  39           H        ARG  39 -10.832  -5.696   4.843
  296    HA   ARG  39           HA       ARG  39  -9.134  -7.329   4.552
  297   1HB   ARG  39          1HB       ARG  39 -10.792  -6.962   2.239
  298   2HB   ARG  39          2HB       ARG  39  -9.162  -7.364   1.694
  299   1HG   ARG  39          1HG       ARG  39  -9.367  -9.499   2.407
  300   2HG   ARG  39          2HG       ARG  39  -9.973  -8.983   3.981
  301   1HD   ARG  39          1HD       ARG  39 -11.954  -8.527   1.888
  302   2HD   ARG  39          2HD       ARG  39 -11.473 -10.234   1.975
  303    HE   ARG  39           HE       ARG  39 -12.007  -8.870   4.552
  304   1HH1  ARG  39          1HH2      ARG  39 -12.144 -11.811   3.153
  305   2HH1  ARG  39          2HH2      ARG  39 -13.781 -12.187   3.577
  306   1HH2  ARG  39          1HH1      ARG  39 -14.527  -8.962   4.618
  307   2HH2  ARG  39          2HH1      ARG  39 -15.132 -10.572   4.410
  308    H    ALA  40           H        ALA  40  -8.346  -4.398   4.436
  309    HA   ALA  40           HA       ALA  40  -6.335  -3.965   2.454
  310   1HB   ALA  40          1HB       ALA  40  -5.696  -2.141   3.932
  311   2HB   ALA  40          2HB       ALA  40  -6.491  -2.924   5.299
  312   3HB   ALA  40          3HB       ALA  40  -7.453  -2.293   3.964
  313    H    LYS  41           H        LYS  41  -4.146  -4.472   2.433
  314    HA   LYS  41           HA       LYS  41  -3.207  -6.455   4.441
  315   1HB   LYS  41          1HB       LYS  41  -2.064  -5.459   1.806
  316   2HB   LYS  41          2HB       LYS  41  -1.433  -6.814   2.744
  317   1HG   LYS  41          1HG       LYS  41  -3.713  -7.891   2.540
  318   2HG   LYS  41          2HG       LYS  41  -4.151  -6.606   1.414
  319   1HD   LYS  41          1HD       LYS  41  -3.391  -8.295  -0.026
  320   2HD   LYS  41          2HD       LYS  41  -1.946  -7.303   0.177
  321   1HE   LYS  41          1HE       LYS  41  -0.982  -9.327   0.717
  322   2HE   LYS  41          2HE       LYS  41  -1.707  -9.015   2.307
  323   1HZ   LYS  41          1HZ       LYS  41  -3.349 -10.187   0.161
  324   2HZ   LYS  41          2HZ       LYS  41  -3.497 -10.363   1.844
  325   3HZ   LYS  41          3HZ       LYS  41  -2.276 -11.195   1.005
  326    H    ARG  42           H        ARG  42  -0.444  -5.934   4.280
  327    HA   ARG  42           HA       ARG  42  -0.257  -3.553   6.000
  328   1HB   ARG  42          1HB       ARG  42   1.849  -5.492   5.003
  329   2HB   ARG  42          2HB       ARG  42   2.003  -4.394   6.374
  330   1HG   ARG  42          1HG       ARG  42   0.168  -5.563   7.525
  331   2HG   ARG  42          2HG       ARG  42  -0.027  -6.641   6.144
  332   1HD   ARG  42          1HD       ARG  42   2.711  -6.454   7.327
  333   2HD   ARG  42          2HD       ARG  42   1.480  -7.327   8.261
  334    HE   ARG  42           HE       ARG  42   1.810  -7.938   5.356
  335   1HH1  ARG  42          1HH2      ARG  42   2.624  -8.768   8.576
  336   2HH1  ARG  42          2HH2      ARG  42   2.515 -10.477   8.318
  337   1HH2  ARG  42          1HH1      ARG  42   1.396 -10.180   5.048
  338   2HH2  ARG  42          2HH1      ARG  42   1.821 -11.276   6.321
  339    H    ASN  43           H        ASN  43  -0.024  -4.177   2.666
  340    HA   ASN  43           HA       ASN  43   1.922  -1.973   2.160
  341   1HB   ASN  43          1HB       ASN  43   1.644  -4.385   1.022
  342   2HB   ASN  43          2HB       ASN  43   0.492  -3.506   0.017
  343   1HD2  ASN  43          1HD2      ASN  43   3.519  -4.540  -0.243
  344   2HD2  ASN  43          2HD2      ASN  43   4.264  -3.232  -1.025
  345    H    ASN  44           H        ASN  44  -0.283  -0.926   3.329
  346    HA   ASN  44           HA       ASN  44  -1.661   0.505   1.093
  347   1HB   ASN  44          1HB       ASN  44  -3.117  -1.339   1.702
  348   2HB   ASN  44          2HB       ASN  44  -2.896  -1.015   3.419
  349   1HD2  ASN  44          1HD2      ASN  44  -5.466  -1.063   1.968
  350   2HD2  ASN  44          2HD2      ASN  44  -6.156   0.490   2.148
  351    H    PHE  45           H        PHE  45  -0.186   2.254   1.848
  352    HA   PHE  45           HA       PHE  45  -0.731   3.306   4.584
  353   1HB   PHE  45          1HB       PHE  45   1.317   4.147   2.513
  354   2HB   PHE  45          2HB       PHE  45   1.341   4.506   4.241
  355    HD1  PHE  45           1HD      PHE  45   2.116   2.880   5.848
  356    HD2  PHE  45           2HD      PHE  45   1.648   1.797   1.714
  357    HE1  PHE  45           1HE      PHE  45   3.325   0.752   6.269
  358    HE2  PHE  45           2HE      PHE  45   2.858  -0.330   2.136
  359    HZ   PHE  45           HZ       PHE  45   3.697  -0.861   4.413
  360    H    LYS  46           H        LYS  46  -1.011   5.712   4.759
  361    HA   LYS  46           HA       LYS  46  -2.915   6.657   2.696
  362   1HB   LYS  46          1HB       LYS  46  -2.053   7.978   5.282
  363   2HB   LYS  46          2HB       LYS  46  -3.564   8.218   4.400
  364   1HG   LYS  46          1HG       LYS  46  -4.181   5.860   4.848
  365   2HG   LYS  46          2HG       LYS  46  -2.682   5.648   5.754
  366   1HD   LYS  46          1HD       LYS  46  -3.386   7.402   7.336
  367   2HD   LYS  46          2HD       LYS  46  -4.877   7.637   6.421
  368   1HE   LYS  46          1HE       LYS  46  -5.266   5.090   6.823
  369   2HE   LYS  46          2HE       LYS  46  -4.041   5.263   8.097
  370   1HZ   LYS  46          1HZ       LYS  46  -6.574   6.793   7.784
  371   2HZ   LYS  46          2HZ       LYS  46  -5.344   7.236   8.868
  372   3HZ   LYS  46          3HZ       LYS  46  -6.154   5.756   9.058
  373    H    SER  47           H        SER  47   0.387   7.092   3.595
  374    HA   SER  47           HA       SER  47   0.593   9.342   1.640
  375   1HB   SER  47          1HB       SER  47   1.967  10.587   3.231
  376   2HB   SER  47          2HB       SER  47   0.414  10.210   3.968
  377    HG   SER  47           HG       SER  47   1.433   9.160   5.437
  378    H    ALA  48           H        ALA  48   2.709   9.532   0.705
  379    HA   ALA  48           HA       ALA  48   4.098   7.042   0.279
  380   1HB   ALA  48          1HB       ALA  48   4.197   9.869  -0.545
  381   2HB   ALA  48          2HB       ALA  48   4.447   8.414  -1.509
  382   3HB   ALA  48          3HB       ALA  48   5.771   9.078  -0.552
  383    H    GLU  49           H        GLU  49   4.529   9.723   2.504
  384    HA   GLU  49           HA       GLU  49   7.255   9.050   3.292
  385   1HB   GLU  49          1HB       GLU  49   5.636  11.218   3.475
  386   2HB   GLU  49          2HB       GLU  49   5.436  10.553   5.098
  387   1HG   GLU  49          1HG       GLU  49   8.105  10.344   4.902
  388   2HG   GLU  49          2HG       GLU  49   7.868  11.691   3.790
  389    H    ASP  50           H        ASP  50   4.152   7.805   4.034
  390    HA   ASP  50           HA       ASP  50   4.982   6.716   6.666
  391   1HB   ASP  50          1HB       ASP  50   2.711   7.767   6.087
  392   2HB   ASP  50          2HB       ASP  50   2.390   6.304   5.157
  393    H    CYS  51           H        CYS  51   4.540   5.770   3.331
  394    HA   CYS  51           HA       CYS  51   4.446   2.896   3.800
  395   1HB   CYS  51          1HB       CYS  51   3.539   3.790   1.775
  396   2HB   CYS  51          2HB       CYS  51   5.002   4.718   1.445
  397    H    MET  52           H        MET  52   6.992   5.166   2.703
  398    HA   MET  52           HA       MET  52   9.110   3.217   2.594
  399   1HB   MET  52          1HB       MET  52   8.691   6.107   2.377
  400   2HB   MET  52          2HB       MET  52  10.245   5.714   3.115
  401   1HG   MET  52          1HG       MET  52   9.676   3.976   0.852
  402   2HG   MET  52          2HG       MET  52   9.639   5.673   0.378
  403   1HE   MET  52          1HE       MET  52  12.028   3.112  -0.273
  404   2HE   MET  52          2HE       MET  52  13.094   4.423  -0.773
  405   3HE   MET  52          3HE       MET  52  11.373   4.508  -1.139
  406    H    ARG  53           H        ARG  53   8.264   5.630   5.134
  407    HA   ARG  53           HA       ARG  53  10.271   5.139   6.995
  408   1HB   ARG  53          1HB       ARG  53   8.735   6.006   8.590
  409   2HB   ARG  53          2HB       ARG  53   8.188   6.675   7.053
  410   1HG   ARG  53          1HG       ARG  53   6.172   5.866   7.803
  411   2HG   ARG  53          2HG       ARG  53   6.766   4.393   7.042
  412   1HD   ARG  53          1HD       ARG  53   5.924   4.002   9.377
  413   2HD   ARG  53          2HD       ARG  53   7.649   3.611   9.213
  414    HE   ARG  53           HE       ARG  53   6.887   6.367  10.055
  415   1HH1  ARG  53          1HH2      ARG  53   7.744   3.198  11.039
  416   2HH1  ARG  53          2HH2      ARG  53   8.750   3.722  12.349
  417   1HH2  ARG  53          1HH1      ARG  53   8.398   7.095  11.616
  418   2HH2  ARG  53          2HH1      ARG  53   9.119   5.930  12.675
  419    H    THR  54           H        THR  54   7.606   3.044   6.093
  420    HA   THR  54           HA       THR  54   8.410   1.038   8.162
  421    HB   THR  54           HB       THR  54   5.950   1.701   6.564
  422    HG1  THR  54           1HG      THR  54   6.646   1.143   9.233
  423   1HG2  THR  54          1HG2      THR  54   5.054  -0.569   7.449
  424   2HG2  THR  54          2HG2      THR  54   6.755  -1.035   7.523
  425   3HG2  THR  54          3HG2      THR  54   6.036  -0.566   5.982
  426    H    CYS  55           H        CYS  55   8.096   1.636   4.718
  427    HA   CYS  55           HA       CYS  55   9.025  -1.111   4.059
  428   1HB   CYS  55          1HB       CYS  55   7.905   1.213   2.463
  429   2HB   CYS  55          2HB       CYS  55   8.380  -0.321   1.758
  430    H    GLY  56           H        GLY  56  10.713   1.314   5.095
  431   1HA   GLY  56          1HA       GLY  56  12.769   1.102   2.936
  432   2HA   GLY  56          2HA       GLY  56  12.444   2.643   3.733
  433    H    GLY  57           H        GLY  57  15.003   1.739   3.867
  434   1HA   GLY  57          1HA       GLY  57  16.406   1.860   5.900
  435   2HA   GLY  57          2HA       GLY  57  15.226   0.823   6.703
  436    H    ALA  58           H        ALA  58  16.318   0.283   3.403
  437    HA   ALA  58           HA       ALA  58  17.316  -2.390   4.203
  438   1HB   ALA  58          1HB       ALA  58  15.893  -1.310   2.061
  439   2HB   ALA  58          2HB       ALA  58  16.588  -2.929   2.122
  440   3HB   ALA  58          3HB       ALA  58  17.497  -1.608   1.387
  Start of MODEL   17
    1   1H    ARG   1          1H        ARG   1  14.498  -6.453   3.659
    2   2H    ARG   1          2H        ARG   1  14.127  -6.445   5.317
    3   3H    ARG   1          3H        ARG   1  14.775  -5.058   4.582
    4    HA   ARG   1           HA       ARG   1  12.524  -4.534   4.739
    5   1HB   ARG   1          1HB       ARG   1  13.478  -5.659   2.127
    6   2HB   ARG   1          2HB       ARG   1  11.811  -5.092   2.237
    7   1HG   ARG   1          1HG       ARG   1  12.904  -2.966   3.334
    8   2HG   ARG   1          2HG       ARG   1  14.369  -3.537   2.536
    9   1HD   ARG   1          1HD       ARG   1  12.078  -3.629   0.721
   10   2HD   ARG   1          2HD       ARG   1  12.353  -1.992   1.349
   11    HE   ARG   1           HE       ARG   1  14.151  -3.483  -0.401
   12   1HH1  ARG   1          1HH1      ARG   1  13.828  -0.483  -0.336
   13   2HH1  ARG   1          2HH1      ARG   1  15.344   0.020   0.336
   14   1HH2  ARG   1          1HH2      ARG   1  16.154  -3.131   1.540
   15   2HH2  ARG   1          2HH2      ARG   1  16.658  -1.480   1.399
   16    HA   PRO   2           HA       PRO   2   9.815  -7.880   5.721
   17   1HB   PRO   2          1HB       PRO   2   7.445  -6.532   5.482
   18   2HB   PRO   2          2HB       PRO   2   8.531  -6.354   6.866
   19   1HG   PRO   2          1HG       PRO   2   8.166  -4.609   4.482
   20   2HG   PRO   2          2HG       PRO   2   8.429  -4.152   6.167
   21   1HD   PRO   2          1HD       PRO   2  10.378  -4.105   4.255
   22   2HD   PRO   2          2HD       PRO   2  10.708  -4.368   5.983
   23    H    ASP   3           H        ASP   3   8.292  -9.290   4.701
   24    HA   ASP   3           HA       ASP   3   8.465  -9.402   1.810
   25   1HB   ASP   3          1HB       ASP   3   7.594 -10.999   4.073
   26   2HB   ASP   3          2HB       ASP   3   6.430 -11.107   2.752
   27    H    PHE   4           H        PHE   4   6.044  -8.231   4.134
   28    HA   PHE   4           HA       PHE   4   3.870  -8.069   2.217
   29   1HB   PHE   4          1HB       PHE   4   2.745  -6.860   3.938
   30   2HB   PHE   4          2HB       PHE   4   3.783  -8.005   4.778
   31    HD1  PHE   4           1HD      PHE   4   3.734  -4.452   3.523
   32    HD2  PHE   4           2HD      PHE   4   5.298  -7.260   6.383
   33    HE1  PHE   4           1HE      PHE   4   4.840  -2.610   4.737
   34    HE2  PHE   4           2HE      PHE   4   6.405  -5.401   7.592
   35    HZ   PHE   4           HZ       PHE   4   6.169  -3.075   6.766
   36    H    CYS   5           H        CYS   5   6.675  -6.191   2.790
   37    HA   CYS   5           HA       CYS   5   5.738  -3.710   1.588
   38   1HB   CYS   5          1HB       CYS   5   7.481  -3.564   3.169
   39   2HB   CYS   5          2HB       CYS   5   8.350  -4.934   2.478
   40    H    LEU   6           H        LEU   6   7.292  -6.670   0.501
   41    HA   LEU   6           HA       LEU   6   7.910  -5.552  -2.162
   42   1HB   LEU   6          1HB       LEU   6   8.057  -8.420  -1.201
   43   2HB   LEU   6          2HB       LEU   6   9.002  -7.660  -2.483
   44    HG   LEU   6           HG       LEU   6   9.155  -7.110   0.493
   45   1HD1  LEU   6          1HD1      LEU   6  11.660  -7.568  -0.848
   46   2HD1  LEU   6          2HD1      LEU   6  10.545  -8.873  -1.254
   47   3HD1  LEU   6          3HD1      LEU   6  10.911  -8.520   0.435
   48   1HD2  LEU   6          1HD2      LEU   6  10.788  -5.376  -0.051
   49   2HD2  LEU   6          2HD2      LEU   6   9.268  -5.015  -0.868
   50   3HD2  LEU   6          3HD2      LEU   6  10.611  -5.712  -1.774
   51    H    GLU   7           H        GLU   7   5.245  -6.927  -0.586
   52    HA   GLU   7           HA       GLU   7   4.084  -8.367  -2.841
   53   1HB   GLU   7          1HB       GLU   7   3.193  -7.367  -0.138
   54   2HB   GLU   7          2HB       GLU   7   2.025  -8.068  -1.259
   55   1HG   GLU   7          1HG       GLU   7   4.236  -9.813  -1.281
   56   2HG   GLU   7          2HG       GLU   7   3.976  -9.402   0.415
   57    HA   PRO   8           HA       PRO   8   2.358  -4.919  -4.956
   58   1HB   PRO   8          1HB       PRO   8   0.110  -6.088  -6.008
   59   2HB   PRO   8          2HB       PRO   8   1.745  -6.386  -6.636
   60   1HG   PRO   8          1HG       PRO   8   0.070  -8.039  -4.793
   61   2HG   PRO   8          2HG       PRO   8   1.112  -8.553  -6.130
   62   1HD   PRO   8          1HD       PRO   8   1.839  -8.706  -3.505
   63   2HD   PRO   8          2HD       PRO   8   3.008  -8.487  -4.828
   64    HA   PRO   9           HA       PRO   9  -0.832  -3.162  -2.511
   65   1HB   PRO   9          1HB       PRO   9  -2.461  -1.904  -4.325
   66   2HB   PRO   9          2HB       PRO   9  -0.848  -1.308  -3.887
   67   1HG   PRO   9          1HG       PRO   9  -1.737  -2.822  -6.290
   68   2HG   PRO   9          2HG       PRO   9  -0.528  -1.535  -6.146
   69   1HD   PRO   9          1HD       PRO   9   0.054  -4.223  -6.345
   70   2HD   PRO   9          2HD       PRO   9   1.137  -3.010  -5.628
   71    H    TYR  10           H        TYR  10  -3.069  -3.452  -1.827
   72    HA   TYR  10           HA       TYR  10  -4.428  -5.762  -3.189
   73   1HB   TYR  10          1HB       TYR  10  -3.316  -5.983  -0.875
   74   2HB   TYR  10          2HB       TYR  10  -4.626  -4.961  -0.283
   75    HD1  TYR  10           1HD      TYR  10  -6.620  -5.970   0.393
   76    HD2  TYR  10           2HD      TYR  10  -4.059  -8.023  -2.372
   77    HE1  TYR  10           1HE      TYR  10  -8.121  -7.944   0.468
   78    HE2  TYR  10           2HE      TYR  10  -5.555  -9.998  -2.295
   79    HH   TYR  10           HH       TYR  10  -7.446 -10.836  -1.507
   80    H    THR  11           H        THR  11  -5.836  -4.476  -4.480
   81    HA   THR  11           HA       THR  11  -7.394  -2.271  -3.540
   82    HB   THR  11           HB       THR  11  -7.572  -4.333  -5.734
   83    HG1  THR  11           1HG      THR  11  -7.803  -1.711  -6.370
   84   1HG2  THR  11          1HG2      THR  11  -9.574  -2.924  -6.568
   85   2HG2  THR  11          2HG2      THR  11  -9.721  -2.386  -4.894
   86   3HG2  THR  11          3HG2      THR  11  -9.886  -4.097  -5.288
   87    H    GLY  12           H        GLY  12  -7.558  -5.705  -3.078
   88   1HA   GLY  12          1HA       GLY  12  -8.948  -7.028  -1.733
   89   2HA   GLY  12          2HA       GLY  12  -9.451  -5.536  -0.941
   90    HA   PRO  13           HA       PRO  13 -12.828  -7.216  -3.736
   91   1HB   PRO  13          1HB       PRO  13 -14.280  -8.676  -1.931
   92   2HB   PRO  13          2HB       PRO  13 -12.976  -9.373  -2.910
   93   1HG   PRO  13          1HG       PRO  13 -13.015  -8.612  -0.052
   94   2HG   PRO  13          2HG       PRO  13 -12.092  -9.879  -0.874
   95   1HD   PRO  13          1HD       PRO  13 -11.133  -7.367  -0.059
   96   2HD   PRO  13          2HD       PRO  13 -10.320  -8.499  -1.160
   97    H    CYS  14           H        CYS  14 -13.417  -4.932  -3.594
   98    HA   CYS  14           HA       CYS  14 -15.759  -4.435  -1.887
   99   1HB   CYS  14          1HB       CYS  14 -13.017  -3.401  -1.354
  100   2HB   CYS  14          2HB       CYS  14 -14.333  -2.240  -1.180
  101    H    LYS  15           H        LYS  15 -16.570  -2.108  -2.347
  102    HA   LYS  15           HA       LYS  15 -16.150  -1.535  -5.245
  103   1HB   LYS  15          1HB       LYS  15 -18.385  -1.873  -3.655
  104   2HB   LYS  15          2HB       LYS  15 -18.259  -0.116  -3.764
  105   1HG   LYS  15          1HG       LYS  15 -19.616  -0.992  -5.618
  106   2HG   LYS  15          2HG       LYS  15 -18.115  -0.303  -6.235
  107   1HD   LYS  15          1HD       LYS  15 -17.405  -2.307  -7.015
  108   2HD   LYS  15          2HD       LYS  15 -17.855  -3.133  -5.521
  109   1HE   LYS  15          1HE       LYS  15 -20.328  -2.634  -6.532
  110   2HE   LYS  15          2HE       LYS  15 -19.403  -2.799  -8.038
  111   1HZ   LYS  15          1HZ       LYS  15 -18.344  -4.787  -6.743
  112   2HZ   LYS  15          2HZ       LYS  15 -19.838  -4.991  -7.527
  113   3HZ   LYS  15          3HZ       LYS  15 -19.784  -4.734  -5.848
  114    H    ALA  16           H        ALA  16 -15.385  -0.324  -2.126
  115    HA   ALA  16           HA       ALA  16 -15.430   2.467  -2.390
  116   1HB   ALA  16          1HB       ALA  16 -13.322   0.664  -1.154
  117   2HB   ALA  16          2HB       ALA  16 -14.809   1.196  -0.370
  118   3HB   ALA  16          3HB       ALA  16 -13.554   2.369  -0.767
  119    H    ARG  17           H        ARG  17 -13.439   3.882  -2.756
  120    HA   ARG  17           HA       ARG  17 -11.482   2.836  -4.714
  121   1HB   ARG  17          1HB       ARG  17 -13.787   3.707  -5.717
  122   2HB   ARG  17          2HB       ARG  17 -13.051   5.288  -5.454
  123   1HG   ARG  17          1HG       ARG  17 -10.999   4.343  -6.692
  124   2HG   ARG  17          2HG       ARG  17 -12.059   3.027  -7.197
  125   1HD   ARG  17          1HD       ARG  17 -13.446   4.475  -8.452
  126   2HD   ARG  17          2HD       ARG  17 -12.871   5.916  -7.590
  127    HE   ARG  17           HE       ARG  17 -11.180   4.309  -9.481
  128   1HH1  ARG  17          1HH2      ARG  17 -12.686   7.212  -9.399
  129   2HH1  ARG  17          2HH2      ARG  17 -11.271   8.197  -9.551
  130   1HH2  ARG  17          1HH1      ARG  17  -9.066   5.575  -9.006
  131   2HH2  ARG  17          2HH1      ARG  17  -9.220   7.271  -9.327
  132    H    ILE  18           H        ILE  18 -10.407   3.453  -2.513
  133    HA   ILE  18           HA       ILE  18  -9.929   6.384  -2.277
  134    HB   ILE  18           HB       ILE  18  -9.234   4.006  -0.522
  135   1HG1  ILE  18          1HG1      ILE  18 -11.106   5.990   0.511
  136   2HG1  ILE  18          2HG1      ILE  18 -11.689   5.262  -0.986
  137   1HG2  ILE  18          1HG2      ILE  18  -8.786   6.974  -0.254
  138   2HG2  ILE  18          2HG2      ILE  18  -7.657   5.656   0.050
  139   3HG2  ILE  18          3HG2      ILE  18  -8.976   5.963   1.179
  140   1HD1  ILE  18          1HD1      ILE  18 -11.025   3.003   0.095
  141   2HD1  ILE  18          2HD1      ILE  18 -12.475   3.803   0.701
  142   3HD1  ILE  18          3HD1      ILE  18 -10.969   3.905   1.611
  143    H    ILE  19           H        ILE  19  -7.725   7.176  -2.184
  144    HA   ILE  19           HA       ILE  19  -5.866   5.640  -3.911
  145    HB   ILE  19           HB       ILE  19  -5.913   8.471  -2.818
  146   1HG1  ILE  19          1HG1      ILE  19  -7.637   7.729  -4.564
  147   2HG1  ILE  19          2HG1      ILE  19  -6.641   9.119  -4.998
  148   1HG2  ILE  19          1HG2      ILE  19  -3.690   8.408  -3.284
  149   2HG2  ILE  19          2HG2      ILE  19  -4.205   8.468  -4.969
  150   3HG2  ILE  19          3HG2      ILE  19  -3.836   6.918  -4.216
  151   1HD1  ILE  19          1HD1      ILE  19  -5.730   6.352  -5.738
  152   2HD1  ILE  19          2HD1      ILE  19  -5.364   7.890  -6.520
  153   3HD1  ILE  19          3HD1      ILE  19  -6.955   7.156  -6.721
  154    H    ARG  20           H        ARG  20  -5.185   4.052  -2.283
  155    HA   ARG  20           HA       ARG  20  -3.842   5.073   0.150
  156   1HB   ARG  20          1HB       ARG  20  -4.699   2.431  -0.976
  157   2HB   ARG  20          2HB       ARG  20  -3.483   2.461   0.303
  158   1HG   ARG  20          1HG       ARG  20  -6.162   3.872   0.475
  159   2HG   ARG  20          2HG       ARG  20  -5.846   2.275   1.157
  160   1HD   ARG  20          1HD       ARG  20  -4.667   3.148   2.918
  161   2HD   ARG  20          2HD       ARG  20  -3.857   4.350   1.892
  162    HE   ARG  20           HE       ARG  20  -5.916   5.717   2.028
  163   1HH1  ARG  20          1HH1      ARG  20  -6.685   2.735   3.356
  164   2HH1  ARG  20          2HH1      ARG  20  -7.469   3.365   4.767
  165   1HH2  ARG  20          1HH2      ARG  20  -6.496   6.639   4.171
  166   2HH2  ARG  20          2HH2      ARG  20  -7.364   5.574   5.226
  167    H    TYR  21           H        TYR  21  -1.650   3.893   0.623
  168    HA   TYR  21           HA       TYR  21   0.071   4.124  -1.823
  169   1HB   TYR  21          1HB       TYR  21   0.410   4.842   1.089
  170   2HB   TYR  21          2HB       TYR  21   1.802   4.691   0.017
  171    HD1  TYR  21           1HD      TYR  21   2.279   6.341  -1.659
  172    HD2  TYR  21           2HD      TYR  21  -1.359   6.538   0.616
  173    HE1  TYR  21           1HE      TYR  21   1.861   8.629  -2.523
  174    HE2  TYR  21           2HE      TYR  21  -1.776   8.824  -0.247
  175    HH   TYR  21           HH       TYR  21  -1.105  10.166  -2.291
  176    H    PHE  22           H        PHE  22   1.724   2.593  -2.100
  177    HA   PHE  22           HA       PHE  22   2.064   0.423  -0.105
  178   1HB   PHE  22          1HB       PHE  22   1.377  -1.287  -1.599
  179   2HB   PHE  22          2HB       PHE  22   0.169  -0.033  -1.811
  180    HD1  PHE  22           1HD      PHE  22   2.914  -1.868  -3.357
  181    HD2  PHE  22           2HD      PHE  22   0.260   1.483  -3.795
  182    HE1  PHE  22           1HE      PHE  22   3.476  -1.738  -5.769
  183    HE2  PHE  22           2HE      PHE  22   0.823   1.612  -6.206
  184    HZ   PHE  22           HZ       PHE  22   2.432   0.001  -7.193
  185    H    TYR  23           H        TYR  23   4.027  -0.879  -0.658
  186    HA   TYR  23           HA       TYR  23   6.072   0.854  -1.923
  187   1HB   TYR  23          1HB       TYR  23   6.367  -0.301   0.280
  188   2HB   TYR  23          2HB       TYR  23   6.314  -1.850  -0.566
  189    HD1  TYR  23           1HD      TYR  23   8.268  -2.725  -1.570
  190    HD2  TYR  23           2HD      TYR  23   8.109   1.431  -0.491
  191    HE1  TYR  23           1HE      TYR  23  10.675  -2.491  -2.127
  192    HE2  TYR  23           2HE      TYR  23  10.511   1.668  -1.056
  193    HH   TYR  23           HH       TYR  23  12.250  -0.726  -2.760
  194    H    ASN  24           H        ASN  24   6.150   0.656  -4.157
  195    HA   ASN  24           HA       ASN  24   5.564  -1.885  -5.507
  196   1HB   ASN  24          1HB       ASN  24   4.960   0.265  -6.502
  197   2HB   ASN  24          2HB       ASN  24   6.634   0.810  -6.417
  198   1HD2  ASN  24          1HD2      ASN  24   5.011   0.514  -8.888
  199   2HD2  ASN  24          2HD2      ASN  24   5.814  -0.632  -9.850
  200    H    ALA  25           H        ALA  25   7.279  -3.251  -4.549
  201    HA   ALA  25           HA       ALA  25   9.996  -2.738  -4.355
  202   1HB   ALA  25          1HB       ALA  25  10.043  -4.983  -3.997
  203   2HB   ALA  25          2HB       ALA  25   9.400  -5.328  -5.604
  204   3HB   ALA  25          3HB       ALA  25   8.303  -4.934  -4.281
  205    H    LYS  26           H        LYS  26   8.097  -3.122  -7.262
  206    HA   LYS  26           HA       LYS  26  10.299  -3.530  -9.098
  207   1HB   LYS  26          1HB       LYS  26   7.491  -3.487  -9.096
  208   2HB   LYS  26          2HB       LYS  26   7.960  -2.169 -10.172
  209   1HG   LYS  26          1HG       LYS  26   9.318  -3.662 -11.504
  210   2HG   LYS  26          2HG       LYS  26   9.094  -4.975 -10.346
  211   1HD   LYS  26          1HD       LYS  26   6.648  -4.923 -10.815
  212   2HD   LYS  26          2HD       LYS  26   6.930  -3.674 -12.028
  213   1HE   LYS  26          1HE       LYS  26   7.966  -5.161 -13.500
  214   2HE   LYS  26          2HE       LYS  26   8.487  -6.245 -12.194
  215   1HZ   LYS  26          1HZ       LYS  26   5.652  -5.748 -12.958
  216   2HZ   LYS  26          2HZ       LYS  26   6.215  -6.880 -11.824
  217   3HZ   LYS  26          3HZ       LYS  26   6.550  -7.091 -13.476
  218    H    ALA  27           H        ALA  27   8.755  -0.718  -7.636
  219    HA   ALA  27           HA       ALA  27  10.207   1.163  -9.412
  220   1HB   ALA  27          1HB       ALA  27   8.506   2.540  -8.809
  221   2HB   ALA  27          2HB       ALA  27   8.775   2.233  -7.093
  222   3HB   ALA  27          3HB       ALA  27   7.782   1.127  -8.042
  223    H    GLY  28           H        GLY  28  10.228   0.038  -6.045
  224   1HA   GLY  28          1HA       GLY  28  12.274  -0.039  -4.740
  225   2HA   GLY  28          2HA       GLY  28  12.923   1.263  -5.738
  226    H    LEU  29           H        LEU  29   9.790   2.087  -5.107
  227    HA   LEU  29           HA       LEU  29  10.382   3.365  -2.479
  228   1HB   LEU  29          1HB       LEU  29   9.585   5.510  -3.441
  229   2HB   LEU  29          2HB       LEU  29  10.990   4.909  -4.321
  230    HG   LEU  29           HG       LEU  29   8.484   3.860  -5.393
  231   1HD1  LEU  29          1HD1      LEU  29   7.561   6.000  -4.675
  232   2HD1  LEU  29          2HD1      LEU  29   7.791   6.035  -6.423
  233   3HD1  LEU  29          3HD1      LEU  29   8.936   6.861  -5.367
  234   1HD2  LEU  29          1HD2      LEU  29  11.096   4.500  -6.231
  235   2HD2  LEU  29          2HD2      LEU  29  10.038   5.587  -7.130
  236   3HD2  LEU  29          3HD2      LEU  29   9.799   3.842  -7.227
  237    H    CYS  30           H        CYS  30   7.871   4.968  -2.957
  238    HA   CYS  30           HA       CYS  30   5.914   2.735  -2.554
  239   1HB   CYS  30          1HB       CYS  30   6.136   5.522  -1.385
  240   2HB   CYS  30          2HB       CYS  30   4.746   4.466  -1.126
  241    H    GLN  31           H        GLN  31   3.828   3.003  -3.482
  242    HA   GLN  31           HA       GLN  31   3.453   5.318  -5.332
  243   1HB   GLN  31          1HB       GLN  31   3.186   2.365  -5.979
  244   2HB   GLN  31          2HB       GLN  31   2.766   3.680  -7.077
  245   1HG   GLN  31          1HG       GLN  31   5.137   4.506  -6.867
  246   2HG   GLN  31          2HG       GLN  31   5.508   3.053  -5.939
  247   1HE2  GLN  31          1HE2      GLN  31   6.485   3.893  -8.691
  248   2HE2  GLN  31          2HE2      GLN  31   6.071   2.602  -9.714
  249    H    THR  32           H        THR  32   1.104   5.386  -6.087
  250    HA   THR  32           HA       THR  32  -0.653   4.693  -3.797
  251    HB   THR  32           HB       THR  32  -2.144   6.200  -5.496
  252    HG1  THR  32           1HG      THR  32  -0.756   7.637  -6.521
  253   1HG2  THR  32          1HG2      THR  32  -0.516   6.613  -3.156
  254   2HG2  THR  32          2HG2      THR  32  -1.997   7.447  -3.631
  255   3HG2  THR  32          3HG2      THR  32  -0.432   8.039  -4.191
  256    H    PHE  33           H        PHE  33  -2.534   3.451  -4.049
  257    HA   PHE  33           HA       PHE  33  -3.091   2.253  -6.722
  258   1HB   PHE  33          1HB       PHE  33  -2.879   0.035  -5.889
  259   2HB   PHE  33          2HB       PHE  33  -1.477   0.885  -5.256
  260    HD1  PHE  33           1HD      PHE  33  -1.353   1.519  -2.851
  261    HD2  PHE  33           2HD      PHE  33  -4.688  -0.682  -4.441
  262    HE1  PHE  33           1HE      PHE  33  -2.059   0.933  -0.559
  263    HE2  PHE  33           2HE      PHE  33  -5.388  -1.272  -2.139
  264    HZ   PHE  33           HZ       PHE  33  -4.074  -0.467  -0.196
  265    H    VAL  34           H        VAL  34  -5.244   1.195  -6.763
  266    HA   VAL  34           HA       VAL  34  -7.234   2.774  -5.341
  267    HB   VAL  34           HB       VAL  34  -7.351   0.353  -7.169
  268   1HG1  VAL  34          1HG1      VAL  34  -9.559   0.202  -6.754
  269   2HG1  VAL  34          2HG1      VAL  34  -9.766   1.913  -7.125
  270   3HG1  VAL  34          3HG1      VAL  34  -9.380   1.409  -5.480
  271   1HG2  VAL  34          1HG2      VAL  34  -6.625   2.916  -7.755
  272   2HG2  VAL  34          2HG2      VAL  34  -8.372   3.012  -7.983
  273   3HG2  VAL  34          3HG2      VAL  34  -7.425   1.842  -8.902
  274    H    TYR  35           H        TYR  35  -7.476   2.352  -3.163
  275    HA   TYR  35           HA       TYR  35  -7.207  -0.375  -2.092
  276   1HB   TYR  35          1HB       TYR  35  -6.334   1.563  -0.902
  277   2HB   TYR  35          2HB       TYR  35  -7.917   2.335  -0.919
  278    HD1  TYR  35           1HD      TYR  35  -7.355  -1.287  -0.352
  279    HD2  TYR  35           2HD      TYR  35  -8.217   2.511   1.464
  280    HE1  TYR  35           1HE      TYR  35  -7.934  -2.432   1.772
  281    HE2  TYR  35           2HE      TYR  35  -8.792   1.366   3.587
  282    HH   TYR  35           HH       TYR  35  -8.986  -0.573   4.631
  283    H    GLY  36           H        GLY  36  -8.941  -1.614  -1.245
  284   1HA   GLY  36          1HA       GLY  36 -11.611  -0.918  -2.289
  285   2HA   GLY  36          2HA       GLY  36 -11.145  -2.467  -1.589
  286    H    ALA  37           H        ALA  37  -9.987  -0.087   0.435
  287    HA   ALA  37           HA       ALA  37 -10.775   0.820   2.479
  288   1HB   ALA  37          1HB       ALA  37 -13.033   1.512   2.498
  289   2HB   ALA  37          2HB       ALA  37 -13.548   0.146   1.508
  290   3HB   ALA  37          3HB       ALA  37 -12.631   1.466   0.782
  291    H    CYS  38           H        CYS  38 -10.700  -2.286   1.723
  292    HA   CYS  38           HA       CYS  38 -11.499  -3.154   4.431
  293   1HB   CYS  38          1HB       CYS  38 -13.106  -4.793   3.580
  294   2HB   CYS  38          2HB       CYS  38 -13.564  -3.184   3.022
  295    H    ARG  39           H        ARG  39 -10.987  -5.580   4.668
  296    HA   ARG  39           HA       ARG  39  -9.210  -7.160   4.659
  297   1HB   ARG  39          1HB       ARG  39 -10.253  -6.776   1.866
  298   2HB   ARG  39          2HB       ARG  39  -8.940  -7.918   2.148
  299   1HG   ARG  39          1HG       ARG  39 -10.836  -8.399   4.184
  300   2HG   ARG  39          2HG       ARG  39 -11.762  -8.222   2.692
  301   1HD   ARG  39          1HD       ARG  39 -10.993 -10.208   1.888
  302   2HD   ARG  39          2HD       ARG  39  -9.320  -9.822   2.336
  303    HE   ARG  39           HE       ARG  39 -10.062 -10.418   4.726
  304   1HH1  ARG  39          1HH2      ARG  39 -12.953 -10.873   3.862
  305   2HH1  ARG  39          2HH2      ARG  39 -13.012 -12.602   3.782
  306   1HH2  ARG  39          1HH1      ARG  39  -9.564 -12.984   3.809
  307   2HH2  ARG  39          2HH1      ARG  39 -11.093 -13.797   3.752
  308    H    ALA  40           H        ALA  40  -8.246  -4.406   4.679
  309    HA   ALA  40           HA       ALA  40  -6.142  -4.080   2.695
  310   1HB   ALA  40          1HB       ALA  40  -6.429  -2.010   3.549
  311   2HB   ALA  40          2HB       ALA  40  -5.632  -2.552   5.026
  312   3HB   ALA  40          3HB       ALA  40  -7.386  -2.661   4.881
  313    H    LYS  41           H        LYS  41  -3.895  -4.425   2.995
  314    HA   LYS  41           HA       LYS  41  -3.167  -6.146   5.346
  315   1HB   LYS  41          1HB       LYS  41  -2.002  -6.037   2.544
  316   2HB   LYS  41          2HB       LYS  41  -1.577  -7.201   3.801
  317   1HG   LYS  41          1HG       LYS  41  -3.785  -8.157   3.761
  318   2HG   LYS  41          2HG       LYS  41  -4.390  -6.858   2.732
  319   1HD   LYS  41          1HD       LYS  41  -3.419  -7.730   0.833
  320   2HD   LYS  41          2HD       LYS  41  -2.062  -8.427   1.721
  321   1HE   LYS  41          1HE       LYS  41  -4.908  -9.495   1.837
  322   2HE   LYS  41          2HE       LYS  41  -3.615 -10.181   0.832
  323   1HZ   LYS  41          1HZ       LYS  41  -3.381 -11.364   2.790
  324   2HZ   LYS  41          2HZ       LYS  41  -3.837 -10.055   3.773
  325   3HZ   LYS  41          3HZ       LYS  41  -2.298 -10.086   3.054
  326    H    ARG  42           H        ARG  42  -0.399  -6.039   5.069
  327    HA   ARG  42           HA       ARG  42   0.236  -3.480   6.240
  328   1HB   ARG  42          1HB       ARG  42   2.133  -5.513   5.042
  329   2HB   ARG  42          2HB       ARG  42   2.449  -4.407   6.375
  330   1HG   ARG  42          1HG       ARG  42   0.400  -5.636   7.488
  331   2HG   ARG  42          2HG       ARG  42   0.794  -6.914   6.337
  332   1HD   ARG  42          1HD       ARG  42   3.280  -6.227   7.373
  333   2HD   ARG  42          2HD       ARG  42   2.208  -6.119   8.783
  334    HE   ARG  42           HE       ARG  42   2.817  -8.552   7.246
  335   1HH1  ARG  42          1HH2      ARG  42  -0.226  -7.956   7.554
  336   2HH1  ARG  42          2HH2      ARG  42  -0.581  -8.933   8.939
  337   1HH2  ARG  42          1HH1      ARG  42   2.745  -9.377   9.808
  338   2HH2  ARG  42          2HH1      ARG  42   1.100  -9.739  10.215
  339    H    ASN  43           H        ASN  43   0.133  -4.619   2.953
  340    HA   ASN  43           HA       ASN  43   1.895  -2.450   1.971
  341   1HB   ASN  43          1HB       ASN  43   1.506  -4.986   1.177
  342   2HB   ASN  43          2HB       ASN  43   0.276  -4.208   0.178
  343   1HD2  ASN  43          1HD2      ASN  43   3.726  -3.662   1.123
  344   2HD2  ASN  43          2HD2      ASN  43   4.216  -3.143  -0.418
  345    H    ASN  44           H        ASN  44  -0.167  -1.237   3.228
  346    HA   ASN  44           HA       ASN  44  -1.631   0.079   1.022
  347   1HB   ASN  44          1HB       ASN  44  -3.086  -1.790   1.505
  348   2HB   ASN  44          2HB       ASN  44  -2.914  -1.548   3.242
  349   1HD2  ASN  44          1HD2      ASN  44  -5.487  -1.584   1.985
  350   2HD2  ASN  44          2HD2      ASN  44  -6.168  -0.023   2.110
  351    H    PHE  45           H        PHE  45  -0.048   1.692   2.012
  352    HA   PHE  45           HA       PHE  45  -0.734   2.700   4.707
  353   1HB   PHE  45          1HB       PHE  45   1.255   3.770   2.690
  354   2HB   PHE  45          2HB       PHE  45   1.302   3.937   4.446
  355    HD1  PHE  45           1HD      PHE  45   2.037   1.776   1.594
  356    HD2  PHE  45           2HD      PHE  45   1.773   1.938   5.880
  357    HE1  PHE  45           1HE      PHE  45   3.309  -0.349   1.753
  358    HE2  PHE  45           2HE      PHE  45   3.046  -0.187   6.040
  359    HZ   PHE  45           HZ       PHE  45   3.811  -1.338   3.974
  360    H    LYS  46           H        LYS  46  -1.595   4.789   5.081
  361    HA   LYS  46           HA       LYS  46  -3.310   5.861   2.976
  362   1HB   LYS  46          1HB       LYS  46  -4.173   5.904   5.172
  363   2HB   LYS  46          2HB       LYS  46  -2.654   6.487   5.851
  364   1HG   LYS  46          1HG       LYS  46  -3.965   8.239   3.834
  365   2HG   LYS  46          2HG       LYS  46  -4.764   8.109   5.402
  366   1HD   LYS  46          1HD       LYS  46  -2.226   8.439   6.243
  367   2HD   LYS  46          2HD       LYS  46  -2.120   9.294   4.703
  368   1HE   LYS  46          1HE       LYS  46  -3.081  11.077   5.730
  369   2HE   LYS  46          2HE       LYS  46  -4.563  10.113   5.888
  370   1HZ   LYS  46          1HZ       LYS  46  -2.254  10.205   7.764
  371   2HZ   LYS  46          2HZ       LYS  46  -3.520   9.077   7.880
  372   3HZ   LYS  46          3HZ       LYS  46  -3.834  10.737   8.071
  373    H    SER  47           H        SER  47  -0.112   6.546   4.177
  374    HA   SER  47           HA       SER  47   0.017   8.909   2.340
  375   1HB   SER  47          1HB       SER  47   1.255  10.110   4.064
  376   2HB   SER  47          2HB       SER  47  -0.267   9.549   4.746
  377    HG   SER  47           HG       SER  47   1.006   7.629   5.402
  378    H    ALA  48           H        ALA  48   2.177   9.328   1.533
  379    HA   ALA  48           HA       ALA  48   3.710   6.988   0.893
  380   1HB   ALA  48          1HB       ALA  48   3.767   8.883  -0.560
  381   2HB   ALA  48          2HB       ALA  48   5.372   8.818   0.168
  382   3HB   ALA  48          3HB       ALA  48   4.181   9.974   0.763
  383    H    GLU  49           H        GLU  49   3.813   9.257   3.555
  384    HA   GLU  49           HA       GLU  49   6.503   8.619   4.444
  385   1HB   GLU  49          1HB       GLU  49   4.543  10.509   4.976
  386   2HB   GLU  49          2HB       GLU  49   4.567   9.540   6.450
  387   1HG   GLU  49          1HG       GLU  49   6.218  11.201   6.822
  388   2HG   GLU  49          2HG       GLU  49   7.142   9.782   6.328
  389    H    ASP  50           H        ASP  50   3.320   7.222   4.894
  390    HA   ASP  50           HA       ASP  50   4.039   5.598   7.217
  391   1HB   ASP  50          1HB       ASP  50   1.740   6.256   6.849
  392   2HB   ASP  50          2HB       ASP  50   1.761   5.601   5.212
  393    H    CYS  51           H        CYS  51   4.033   5.244   3.716
  394    HA   CYS  51           HA       CYS  51   4.618   2.356   3.768
  395   1HB   CYS  51          1HB       CYS  51   3.355   3.279   1.927
  396   2HB   CYS  51          2HB       CYS  51   4.549   4.547   1.667
  397    H    MET  52           H        MET  52   6.360   5.372   2.936
  398    HA   MET  52           HA       MET  52   8.908   4.132   2.443
  399   1HB   MET  52          1HB       MET  52   8.203   6.386   1.690
  400   2HB   MET  52          2HB       MET  52   8.178   6.931   3.368
  401   1HG   MET  52          1HG       MET  52  10.456   7.057   3.487
  402   2HG   MET  52          2HG       MET  52  10.684   5.618   2.493
  403   1HE   MET  52          1HE       MET  52   9.159   6.647  -0.615
  404   2HE   MET  52          2HE       MET  52   9.936   5.398   0.353
  405   3HE   MET  52          3HE       MET  52  10.881   6.302  -0.827
  406    H    ARG  53           H        ARG  53   7.532   5.694   5.354
  407    HA   ARG  53           HA       ARG  53   9.798   5.471   7.049
  408   1HB   ARG  53          1HB       ARG  53   7.848   6.780   7.625
  409   2HB   ARG  53          2HB       ARG  53   6.808   5.359   7.529
  410   1HG   ARG  53          1HG       ARG  53   7.263   4.809   9.664
  411   2HG   ARG  53          2HG       ARG  53   9.000   4.891   9.366
  412   1HD   ARG  53          1HD       ARG  53   8.867   6.673  10.828
  413   2HD   ARG  53          2HD       ARG  53   8.347   7.553   9.376
  414    HE   ARG  53           HE       ARG  53   5.979   6.618  10.128
  415   1HH1  ARG  53          1HH2      ARG  53   8.207   6.423  12.597
  416   2HH1  ARG  53          2HH2      ARG  53   7.355   7.453  13.700
  417   1HH2  ARG  53          1HH1      ARG  53   5.020   8.483  11.354
  418   2HH2  ARG  53          2HH1      ARG  53   5.554   8.616  12.997
  419    H    THR  54           H        THR  54   7.507   3.081   5.935
  420    HA   THR  54           HA       THR  54   8.350   1.075   7.938
  421    HB   THR  54           HB       THR  54   6.361   1.246   5.670
  422    HG1  THR  54           1HG      THR  54   4.961   0.791   7.454
  423   1HG2  THR  54          1HG2      THR  54   5.722  -1.052   6.053
  424   2HG2  THR  54          2HG2      THR  54   6.896  -1.209   7.360
  425   3HG2  THR  54          3HG2      THR  54   7.448  -1.021   5.695
  426    H    CYS  55           H        CYS  55   8.571   1.637   4.420
  427    HA   CYS  55           HA       CYS  55  10.784  -0.394   4.347
  428   1HB   CYS  55          1HB       CYS  55   8.291  -0.592   3.235
  429   2HB   CYS  55          2HB       CYS  55   9.217   0.091   1.898
  430    H    GLY  56           H        GLY  56  11.275   2.379   4.761
  431   1HA   GLY  56          1HA       GLY  56  12.190   3.317   2.078
  432   2HA   GLY  56          2HA       GLY  56  11.959   4.361   3.481
  433    H    GLY  57           H        GLY  57  13.965   5.097   4.032
  434   1HA   GLY  57          1HA       GLY  57  16.184   5.014   4.803
  435   2HA   GLY  57          2HA       GLY  57  15.945   3.286   5.068
  436    H    ALA  58           H        ALA  58  15.544   4.937   1.963
  437    HA   ALA  58           HA       ALA  58  17.702   3.193   0.855
  438   1HB   ALA  58          1HB       ALA  58  16.246   2.953  -0.859
  439   2HB   ALA  58          2HB       ALA  58  16.133   4.701  -1.063
  440   3HB   ALA  58          3HB       ALA  58  15.077   3.879   0.085
  Start of MODEL   18
    1   1H    ARG   1          1H        ARG   1  14.296  -5.547   6.788
    2   2H    ARG   1          2H        ARG   1  14.919  -4.770   5.411
    3   3H    ARG   1          3H        ARG   1  14.333  -6.360   5.300
    4    HA   ARG   1           HA       ARG   1  12.549  -4.159   6.151
    5   1HB   ARG   1          1HB       ARG   1  13.481  -3.334   4.134
    6   2HB   ARG   1          2HB       ARG   1  13.568  -4.939   3.415
    7   1HG   ARG   1          1HG       ARG   1  10.944  -4.882   3.669
    8   2HG   ARG   1          2HG       ARG   1  11.186  -3.138   3.760
    9   1HD   ARG   1          1HD       ARG   1  11.981  -4.989   1.488
   10   2HD   ARG   1          2HD       ARG   1  10.843  -3.627   1.431
   11    HE   ARG   1           HE       ARG   1  12.780  -2.123   1.817
   12   1HH1  ARG   1          1HH1      ARG   1  13.276  -4.073  -0.587
   13   2HH1  ARG   1          2HH1      ARG   1  14.961  -4.397  -0.354
   14   1HH2  ARG   1          1HH2      ARG   1  15.033  -3.116   2.869
   15   2HH2  ARG   1          2HH2      ARG   1  15.957  -3.854   1.603
   16    HA   PRO   2           HA       PRO   2   9.746  -7.536   6.414
   17   1HB   PRO   2          1HB       PRO   2   7.419  -6.213   5.813
   18   2HB   PRO   2          2HB       PRO   2   8.231  -6.094   7.381
   19   1HG   PRO   2          1HG       PRO   2   8.315  -4.241   5.033
   20   2HG   PRO   2          2HG       PRO   2   8.175  -3.856   6.758
   21   1HD   PRO   2          1HD       PRO   2  10.511  -3.646   5.406
   22   2HD   PRO   2          2HD       PRO   2  10.447  -4.127   7.118
   23    H    ASP   3           H        ASP   3   8.391  -8.878   5.052
   24    HA   ASP   3           HA       ASP   3   9.090  -8.708   2.210
   25   1HB   ASP   3          1HB       ASP   3   8.128 -10.910   2.150
   26   2HB   ASP   3          2HB       ASP   3   8.976 -10.784   3.692
   27    H    PHE   4           H        PHE   4   6.329  -7.950   4.258
   28    HA   PHE   4           HA       PHE   4   4.335  -7.960   2.169
   29   1HB   PHE   4          1HB       PHE   4   2.954  -6.915   3.817
   30   2HB   PHE   4          2HB       PHE   4   4.033  -7.987   4.704
   31    HD1  PHE   4           1HD      PHE   4   5.269  -7.160   6.487
   32    HD2  PHE   4           2HD      PHE   4   3.793  -4.410   3.525
   33    HE1  PHE   4           1HE      PHE   4   6.068  -5.250   7.851
   34    HE2  PHE   4           2HE      PHE   4   4.602  -2.520   4.892
   35    HZ   PHE   4           HZ       PHE   4   5.729  -2.927   7.044
   36    H    CYS   5           H        CYS   5   6.932  -5.837   2.829
   37    HA   CYS   5           HA       CYS   5   5.698  -3.457   1.638
   38   1HB   CYS   5          1HB       CYS   5   8.326  -4.310   2.785
   39   2HB   CYS   5          2HB       CYS   5   8.318  -2.906   1.716
   40    H    LEU   6           H        LEU   6   7.669  -6.176   0.610
   41    HA   LEU   6           HA       LEU   6   8.360  -4.988  -1.989
   42   1HB   LEU   6          1HB       LEU   6   8.534  -7.860  -1.022
   43   2HB   LEU   6          2HB       LEU   6   9.474  -7.116  -2.317
   44    HG   LEU   6           HG       LEU   6   9.559  -6.037   0.500
   45   1HD1  LEU   6          1HD1      LEU   6  10.386  -8.110   1.042
   46   2HD1  LEU   6          2HD1      LEU   6  11.857  -7.433   0.349
   47   3HD1  LEU   6          3HD1      LEU   6  10.829  -8.485  -0.623
   48   1HD2  LEU   6          1HD2      LEU   6  10.665  -5.274  -1.991
   49   2HD2  LEU   6          2HD2      LEU   6  11.997  -5.945  -1.051
   50   3HD2  LEU   6          3HD2      LEU   6  11.051  -4.605  -0.406
   51    H    GLU   7           H        GLU   7   5.750  -6.791  -0.625
   52    HA   GLU   7           HA       GLU   7   4.789  -8.017  -3.083
   53   1HB   GLU   7          1HB       GLU   7   4.019  -7.698  -0.253
   54   2HB   GLU   7          2HB       GLU   7   2.648  -7.806  -1.358
   55   1HG   GLU   7          1HG       GLU   7   3.130  -9.974  -1.949
   56   2HG   GLU   7          2HG       GLU   7   4.871  -9.740  -1.791
   57    HA   PRO   8           HA       PRO   8   2.701  -4.575  -4.835
   58   1HB   PRO   8          1HB       PRO   8   0.524  -5.801  -5.965
   59   2HB   PRO   8          2HB       PRO   8   2.165  -5.929  -6.628
   60   1HG   PRO   8          1HG       PRO   8   0.624  -7.851  -4.946
   61   2HG   PRO   8          2HG       PRO   8   1.703  -8.165  -6.314
   62   1HD   PRO   8          1HD       PRO   8   2.421  -8.486  -3.690
   63   2HD   PRO   8          2HD       PRO   8   3.576  -8.120  -4.991
   64    HA   PRO   9           HA       PRO   9  -0.547  -3.208  -2.225
   65   1HB   PRO   9          1HB       PRO   9  -2.323  -1.993  -3.926
   66   2HB   PRO   9          2HB       PRO   9  -0.753  -1.294  -3.484
   67   1HG   PRO   9          1HG       PRO   9  -1.577  -2.744  -5.951
   68   2HG   PRO   9          2HG       PRO   9  -0.484  -1.362  -5.762
   69   1HD   PRO   9          1HD       PRO   9   0.341  -3.955  -6.135
   70   2HD   PRO   9          2HD       PRO   9   1.318  -2.702  -5.338
   71    H    TYR  10           H        TYR  10  -2.983  -3.393  -1.780
   72    HA   TYR  10           HA       TYR  10  -4.126  -5.882  -3.028
   73   1HB   TYR  10          1HB       TYR  10  -3.043  -6.151  -0.767
   74   2HB   TYR  10          2HB       TYR  10  -4.223  -5.010  -0.125
   75    HD1  TYR  10           1HD      TYR  10  -6.290  -5.783   0.636
   76    HD2  TYR  10           2HD      TYR  10  -4.005  -8.203  -2.077
   77    HE1  TYR  10           1HE      TYR  10  -7.940  -7.618   0.885
   78    HE2  TYR  10           2HE      TYR  10  -5.656 -10.040  -1.830
   79    HH   TYR  10           HH       TYR  10  -7.485 -10.588   0.331
   80    H    THR  11           H        THR  11  -5.600  -4.690  -4.334
   81    HA   THR  11           HA       THR  11  -7.243  -2.533  -3.499
   82    HB   THR  11           HB       THR  11  -7.403  -4.761  -5.524
   83    HG1  THR  11           1HG      THR  11  -6.280  -3.164  -6.345
   84   1HG2  THR  11          1HG2      THR  11  -9.566  -2.693  -5.027
   85   2HG2  THR  11          2HG2      THR  11  -9.728  -4.431  -4.775
   86   3HG2  THR  11          3HG2      THR  11  -9.500  -3.793  -6.404
   87    H    GLY  12           H        GLY  12  -7.287  -5.928  -2.767
   88   1HA   GLY  12          1HA       GLY  12  -8.685  -7.206  -1.375
   89   2HA   GLY  12          2HA       GLY  12  -9.090  -5.682  -0.584
   90    HA   PRO  13           HA       PRO  13 -12.818  -7.331  -2.811
   91   1HB   PRO  13          1HB       PRO  13 -14.442  -7.413  -0.602
   92   2HB   PRO  13          2HB       PRO  13 -13.411  -8.766  -1.098
   93   1HG   PRO  13          1HG       PRO  13 -13.001  -6.730   1.033
   94   2HG   PRO  13          2HG       PRO  13 -12.599  -8.453   1.026
   95   1HD   PRO  13          1HD       PRO  13 -10.788  -6.421   0.612
   96   2HD   PRO  13          2HD       PRO  13 -10.579  -8.087   0.025
   97    H    CYS  14           H        CYS  14 -15.261  -6.230  -1.722
   98    HA   CYS  14           HA       CYS  14 -16.495  -4.220  -1.693
   99   1HB   CYS  14          1HB       CYS  14 -13.808  -2.995  -0.989
  100   2HB   CYS  14          2HB       CYS  14 -15.407  -2.365  -0.591
  101    H    LYS  15           H        LYS  15 -16.473  -1.951  -2.801
  102    HA   LYS  15           HA       LYS  15 -14.850  -2.042  -5.321
  103   1HB   LYS  15          1HB       LYS  15 -17.780  -2.071  -4.835
  104   2HB   LYS  15          2HB       LYS  15 -17.231  -1.014  -6.135
  105   1HG   LYS  15          1HG       LYS  15 -16.292  -2.800  -7.350
  106   2HG   LYS  15          2HG       LYS  15 -16.237  -3.853  -5.936
  107   1HD   LYS  15          1HD       LYS  15 -18.935  -2.896  -6.682
  108   2HD   LYS  15          2HD       LYS  15 -18.177  -3.974  -7.854
  109   1HE   LYS  15          1HE       LYS  15 -18.334  -5.780  -6.451
  110   2HE   LYS  15          2HE       LYS  15 -17.905  -4.818  -5.021
  111   1HZ   LYS  15          1HZ       LYS  15 -20.467  -4.397  -6.439
  112   2HZ   LYS  15          2HZ       LYS  15 -20.066  -4.013  -4.832
  113   3HZ   LYS  15          3HZ       LYS  15 -20.327  -5.630  -5.283
  114    H    ALA  16           H        ALA  16 -14.712  -0.407  -2.753
  115    HA   ALA  16           HA       ALA  16 -15.661   2.256  -3.263
  116   1HB   ALA  16          1HB       ALA  16 -14.217   2.812  -1.397
  117   2HB   ALA  16          2HB       ALA  16 -13.250   1.360  -1.655
  118   3HB   ALA  16          3HB       ALA  16 -14.911   1.222  -1.080
  119    H    ARG  17           H        ARG  17 -13.519   3.949  -3.083
  120    HA   ARG  17           HA       ARG  17 -11.579   3.268  -5.225
  121   1HB   ARG  17          1HB       ARG  17 -13.576   4.136  -6.372
  122   2HB   ARG  17          2HB       ARG  17 -13.570   5.561  -5.332
  123   1HG   ARG  17          1HG       ARG  17 -11.412   6.253  -6.231
  124   2HG   ARG  17          2HG       ARG  17 -11.298   4.772  -7.182
  125   1HD   ARG  17          1HD       ARG  17 -13.656   6.630  -7.521
  126   2HD   ARG  17          2HD       ARG  17 -12.138   6.914  -8.396
  127    HE   ARG  17           HE       ARG  17 -12.846   4.148  -8.624
  128   1HH1  ARG  17          1HH1      ARG  17 -14.086   7.245  -9.485
  129   2HH1  ARG  17          2HH1      ARG  17 -14.697   6.723 -11.017
  130   1HH2  ARG  17          1HH2      ARG  17 -13.540   3.474 -10.679
  131   2HH2  ARG  17          2HH2      ARG  17 -14.388   4.591 -11.693
  132    H    ILE  18           H        ILE  18 -10.336   3.482  -3.066
  133    HA   ILE  18           HA       ILE  18  -9.822   6.353  -2.378
  134    HB   ILE  18           HB       ILE  18  -9.256   3.766  -0.893
  135   1HG1  ILE  18          1HG1      ILE  18 -11.341   5.894  -0.329
  136   2HG1  ILE  18          2HG1      ILE  18 -11.687   4.394  -1.189
  137   1HG2  ILE  18          1HG2      ILE  18  -9.237   6.558   0.248
  138   2HG2  ILE  18          2HG2      ILE  18  -7.787   5.859  -0.472
  139   3HG2  ILE  18          3HG2      ILE  18  -8.535   5.089   0.926
  140   1HD1  ILE  18          1HD1      ILE  18 -11.211   4.854   1.688
  141   2HD1  ILE  18          2HD1      ILE  18 -10.361   3.461   1.021
  142   3HD1  ILE  18          3HD1      ILE  18 -12.116   3.567   0.890
  143    H    ILE  19           H        ILE  19  -7.666   7.112  -2.410
  144    HA   ILE  19           HA       ILE  19  -5.786   5.513  -4.053
  145    HB   ILE  19           HB       ILE  19  -5.714   8.353  -2.975
  146   1HG1  ILE  19          1HG1      ILE  19  -7.594   7.860  -4.547
  147   2HG1  ILE  19          2HG1      ILE  19  -6.427   8.995  -5.226
  148   1HG2  ILE  19          1HG2      ILE  19  -3.908   8.730  -4.521
  149   2HG2  ILE  19          2HG2      ILE  19  -4.103   7.126  -5.228
  150   3HG2  ILE  19          3HG2      ILE  19  -3.491   7.296  -3.582
  151   1HD1  ILE  19          1HD1      ILE  19  -7.294   6.606  -6.398
  152   2HD1  ILE  19          2HD1      ILE  19  -5.685   6.232  -5.781
  153   3HD1  ILE  19          3HD1      ILE  19  -5.909   7.573  -6.905
  154    H    ARG  20           H        ARG  20  -5.318   3.941  -2.291
  155    HA   ARG  20           HA       ARG  20  -4.022   4.906   0.157
  156   1HB   ARG  20          1HB       ARG  20  -4.678   2.262  -1.127
  157   2HB   ARG  20          2HB       ARG  20  -3.642   2.322   0.301
  158   1HG   ARG  20          1HG       ARG  20  -6.379   3.621   0.147
  159   2HG   ARG  20          2HG       ARG  20  -6.098   2.012   0.814
  160   1HD   ARG  20          1HD       ARG  20  -5.154   2.851   2.733
  161   2HD   ARG  20          2HD       ARG  20  -4.332   4.163   1.865
  162    HE   ARG  20           HE       ARG  20  -6.627   5.254   1.711
  163   1HH1  ARG  20          1HH2      ARG  20  -6.888   2.382   3.425
  164   2HH1  ARG  20          2HH2      ARG  20  -7.711   3.063   4.789
  165   1HH2  ARG  20          1HH1      ARG  20  -7.293   6.342   3.741
  166   2HH2  ARG  20          2HH1      ARG  20  -7.941   5.305   4.968
  167    H    TYR  21           H        TYR  21  -1.774   3.976   0.693
  168    HA   TYR  21           HA       TYR  21  -0.020   4.264  -1.716
  169   1HB   TYR  21          1HB       TYR  21   0.205   4.970   1.203
  170   2HB   TYR  21          2HB       TYR  21   1.651   4.836   0.203
  171    HD1  TYR  21           1HD      TYR  21   2.025   6.361  -1.692
  172    HD2  TYR  21           2HD      TYR  21  -1.393   6.755   0.878
  173    HE1  TYR  21           1HE      TYR  21   1.622   8.643  -2.580
  174    HE2  TYR  21           2HE      TYR  21  -1.797   9.038  -0.008
  175    HH   TYR  21           HH       TYR  21   0.416  10.803  -1.614
  176    H    PHE  22           H        PHE  22   1.740   2.848  -1.968
  177    HA   PHE  22           HA       PHE  22   2.135   0.645  -0.029
  178   1HB   PHE  22          1HB       PHE  22   1.523  -1.058  -1.545
  179   2HB   PHE  22          2HB       PHE  22   0.290   0.162  -1.792
  180    HD1  PHE  22           1HD      PHE  22   3.247  -1.477  -3.213
  181    HD2  PHE  22           2HD      PHE  22   0.273   1.566  -3.816
  182    HE1  PHE  22           1HE      PHE  22   3.880  -1.334  -5.607
  183    HE2  PHE  22           2HE      PHE  22   0.909   1.710  -6.210
  184    HZ   PHE  22           HZ       PHE  22   2.713   0.259  -7.105
  185    H    TYR  23           H        TYR  23   4.177  -0.468  -0.458
  186    HA   TYR  23           HA       TYR  23   6.191   1.320  -1.657
  187   1HB   TYR  23          1HB       TYR  23   6.511   0.107   0.483
  188   2HB   TYR  23          2HB       TYR  23   6.405  -1.430  -0.378
  189    HD1  TYR  23           1HD      TYR  23   8.459  -2.435  -0.837
  190    HD2  TYR  23           2HD      TYR  23   8.198   1.852  -0.821
  191    HE1  TYR  23           1HE      TYR  23  10.863  -2.292  -1.398
  192    HE2  TYR  23           2HE      TYR  23  10.610   1.997  -1.383
  193    HH   TYR  23           HH       TYR  23  12.737  -0.305  -0.959
  194    H    ASN  24           H        ASN  24   6.564   1.205  -3.853
  195    HA   ASN  24           HA       ASN  24   5.967  -1.287  -5.341
  196   1HB   ASN  24          1HB       ASN  24   5.246   0.898  -6.196
  197   2HB   ASN  24          2HB       ASN  24   6.906   1.483  -6.159
  198   1HD2  ASN  24          1HD2      ASN  24   4.956   0.971  -8.498
  199   2HD2  ASN  24          2HD2      ASN  24   5.845  -0.007  -9.562
  200    H    ALA  25           H        ALA  25   7.751  -2.620  -4.516
  201    HA   ALA  25           HA       ALA  25  10.455  -1.996  -4.329
  202   1HB   ALA  25          1HB       ALA  25  10.440  -4.514  -5.471
  203   2HB   ALA  25          2HB       ALA  25   8.791  -4.362  -4.869
  204   3HB   ALA  25          3HB       ALA  25  10.152  -4.181  -3.763
  205    H    LYS  26           H        LYS  26   8.595  -2.698  -7.279
  206    HA   LYS  26           HA       LYS  26  10.824  -2.737  -9.088
  207   1HB   LYS  26          1HB       LYS  26   8.729  -3.636  -9.785
  208   2HB   LYS  26          2HB       LYS  26   7.859  -2.179  -9.314
  209   1HG   LYS  26          1HG       LYS  26   8.007  -2.000 -11.663
  210   2HG   LYS  26          2HG       LYS  26   9.332  -0.986 -11.097
  211   1HD   LYS  26          1HD       LYS  26  10.919  -2.394 -11.923
  212   2HD   LYS  26          2HD       LYS  26  10.018  -3.837 -11.456
  213   1HE   LYS  26          1HE       LYS  26   9.928  -3.888 -13.826
  214   2HE   LYS  26          2HE       LYS  26   8.389  -3.117 -13.396
  215   1HZ   LYS  26          1HZ       LYS  26  10.041  -1.981 -15.073
  216   2HZ   LYS  26          2HZ       LYS  26  10.802  -1.456 -13.648
  217   3HZ   LYS  26          3HZ       LYS  26   9.179  -1.049 -13.948
  218    H    ALA  27           H        ALA  27   8.974  -0.132  -7.591
  219    HA   ALA  27           HA       ALA  27  10.210   1.899  -9.371
  220   1HB   ALA  27          1HB       ALA  27   8.643   3.383  -8.312
  221   2HB   ALA  27          2HB       ALA  27   8.401   2.266  -6.969
  222   3HB   ALA  27          3HB       ALA  27   7.786   1.865  -8.572
  223    H    GLY  28           H        GLY  28  10.608   0.514  -6.188
  224   1HA   GLY  28          1HA       GLY  28  12.588   0.746  -4.857
  225   2HA   GLY  28          2HA       GLY  28  13.025   2.174  -5.796
  226    H    LEU  29           H        LEU  29   9.947   2.831  -5.272
  227    HA   LEU  29           HA       LEU  29  10.326   3.874  -2.491
  228   1HB   LEU  29          1HB       LEU  29   9.073   5.396  -4.791
  229   2HB   LEU  29          2HB       LEU  29   9.593   6.033  -3.230
  230    HG   LEU  29           HG       LEU  29  11.910   4.896  -4.157
  231   1HD1  LEU  29          1HD1      LEU  29  10.452   4.642  -6.358
  232   2HD1  LEU  29          2HD1      LEU  29  12.144   5.132  -6.456
  233   3HD1  LEU  29          3HD1      LEU  29  10.866   6.344  -6.565
  234   1HD2  LEU  29          1HD2      LEU  29  10.876   7.712  -4.628
  235   2HD2  LEU  29          2HD2      LEU  29  12.572   7.237  -4.701
  236   3HD2  LEU  29          3HD2      LEU  29  11.694   7.135  -3.176
  237    H    CYS  30           H        CYS  30   7.699   5.310  -2.990
  238    HA   CYS  30           HA       CYS  30   5.909   2.912  -2.758
  239   1HB   CYS  30          1HB       CYS  30   5.974   5.588  -1.344
  240   2HB   CYS  30          2HB       CYS  30   4.576   4.515  -1.270
  241    H    GLN  31           H        GLN  31   3.759   3.172  -3.617
  242    HA   GLN  31           HA       GLN  31   3.319   5.548  -5.373
  243   1HB   GLN  31          1HB       GLN  31   3.017   2.623  -6.139
  244   2HB   GLN  31          2HB       GLN  31   2.681   4.003  -7.187
  245   1HG   GLN  31          1HG       GLN  31   5.263   4.473  -6.218
  246   2HG   GLN  31          2HG       GLN  31   5.232   2.741  -6.555
  247   1HE2  GLN  31          1HE2      GLN  31   6.864   4.059  -8.247
  248   2HE2  GLN  31          2HE2      GLN  31   6.147   4.325  -9.762
  249    H    THR  32           H        THR  32   0.925   5.457  -6.179
  250    HA   THR  32           HA       THR  32  -0.762   4.755  -3.828
  251    HB   THR  32           HB       THR  32  -2.394   6.220  -5.211
  252    HG1  THR  32           1HG      THR  32  -1.384   6.121  -7.181
  253   1HG2  THR  32          1HG2      THR  32   0.141   7.050  -3.870
  254   2HG2  THR  32          2HG2      THR  32  -1.530   7.363  -3.403
  255   3HG2  THR  32          3HG2      THR  32  -0.791   8.291  -4.709
  256    H    PHE  33           H        PHE  33  -2.538   3.360  -4.018
  257    HA   PHE  33           HA       PHE  33  -3.050   2.124  -6.689
  258   1HB   PHE  33          1HB       PHE  33  -2.796  -0.067  -5.809
  259   2HB   PHE  33          2HB       PHE  33  -1.429   0.832  -5.172
  260    HD1  PHE  33           1HD      PHE  33  -4.564  -0.863  -4.376
  261    HD2  PHE  33           2HD      PHE  33  -1.394   1.565  -2.781
  262    HE1  PHE  33           1HE      PHE  33  -5.272  -1.442  -2.072
  263    HE2  PHE  33           2HE      PHE  33  -2.112   1.000  -0.488
  264    HZ   PHE  33           HZ       PHE  33  -4.048  -0.511  -0.128
  265    H    VAL  34           H        VAL  34  -5.174   1.131  -6.827
  266    HA   VAL  34           HA       VAL  34  -7.223   2.630  -5.407
  267    HB   VAL  34           HB       VAL  34  -7.416   0.180  -7.192
  268   1HG1  VAL  34          1HG1      VAL  34  -9.599   1.766  -7.680
  269   2HG1  VAL  34          2HG1      VAL  34  -9.364   2.021  -5.950
  270   3HG1  VAL  34          3HG1      VAL  34  -9.599   0.390  -6.577
  271   1HG2  VAL  34          1HG2      VAL  34  -6.133   2.285  -8.036
  272   2HG2  VAL  34          2HG2      VAL  34  -7.723   3.048  -8.072
  273   3HG2  VAL  34          3HG2      VAL  34  -7.407   1.621  -9.058
  274    H    TYR  35           H        TYR  35  -7.301   2.126  -3.217
  275    HA   TYR  35           HA       TYR  35  -7.116  -0.624  -2.234
  276   1HB   TYR  35          1HB       TYR  35  -6.240   1.270  -0.984
  277   2HB   TYR  35          2HB       TYR  35  -7.816   2.056  -0.996
  278    HD1  TYR  35           1HD      TYR  35  -7.096  -1.558  -0.472
  279    HD2  TYR  35           2HD      TYR  35  -8.345   2.141   1.316
  280    HE1  TYR  35           1HE      TYR  35  -7.720  -2.770   1.599
  281    HE2  TYR  35           2HE      TYR  35  -8.969   0.929   3.389
  282    HH   TYR  35           HH       TYR  35  -8.673  -1.058   4.514
  283    H    GLY  36           H        GLY  36  -8.873  -1.834  -1.324
  284   1HA   GLY  36          1HA       GLY  36 -11.510  -1.216  -2.466
  285   2HA   GLY  36          2HA       GLY  36 -11.080  -2.679  -1.581
  286    H    ALA  37           H        ALA  37  -9.930  -0.230   0.277
  287    HA   ALA  37           HA       ALA  37 -10.768   0.976   2.141
  288   1HB   ALA  37          1HB       ALA  37 -13.569   0.236   1.409
  289   2HB   ALA  37          2HB       ALA  37 -12.666   1.250   0.284
  290   3HB   ALA  37          3HB       ALA  37 -12.924   1.787   1.944
  291    H    CYS  38           H        CYS  38 -10.880  -2.266   1.682
  292    HA   CYS  38           HA       CYS  38 -11.654  -2.749   4.511
  293   1HB   CYS  38          1HB       CYS  38 -13.168  -4.599   3.729
  294   2HB   CYS  38          2HB       CYS  38 -13.719  -2.995   3.246
  295    H    ARG  39           H        ARG  39 -11.190  -5.147   5.046
  296    HA   ARG  39           HA       ARG  39  -9.418  -6.712   5.300
  297   1HB   ARG  39          1HB       ARG  39 -11.015  -7.100   3.117
  298   2HB   ARG  39          2HB       ARG  39  -9.421  -7.086   2.362
  299   1HG   ARG  39          1HG       ARG  39  -8.982  -9.147   3.159
  300   2HG   ARG  39          2HG       ARG  39  -9.339  -8.624   4.805
  301   1HD   ARG  39          1HD       ARG  39 -11.821  -8.850   3.369
  302   2HD   ARG  39          2HD       ARG  39 -10.898 -10.352   3.163
  303    HE   ARG  39           HE       ARG  39 -10.957  -9.233   5.901
  304   1HH1  ARG  39          1HH2      ARG  39 -13.622 -10.279   4.509
  305   2HH1  ARG  39          2HH2      ARG  39 -13.727 -11.832   5.271
  306   1HH2  ARG  39          1HH1      ARG  39 -10.490 -11.734   6.511
  307   2HH2  ARG  39          2HH1      ARG  39 -11.953 -12.656   6.404
  308    H    ALA  40           H        ALA  40  -8.290  -4.148   5.207
  309    HA   ALA  40           HA       ALA  40  -6.300  -3.818   3.139
  310   1HB   ALA  40          1HB       ALA  40  -7.337  -2.457   5.395
  311   2HB   ALA  40          2HB       ALA  40  -6.182  -1.834   4.215
  312   3HB   ALA  40          3HB       ALA  40  -5.605  -2.627   5.681
  313    H    LYS  41           H        LYS  41  -3.974  -4.134   3.385
  314    HA   LYS  41           HA       LYS  41  -3.248  -6.259   5.382
  315   1HB   LYS  41          1HB       LYS  41  -2.017  -5.784   2.656
  316   2HB   LYS  41          2HB       LYS  41  -1.880  -7.223   3.665
  317   1HG   LYS  41          1HG       LYS  41  -4.541  -7.177   3.435
  318   2HG   LYS  41          2HG       LYS  41  -4.149  -6.312   1.947
  319   1HD   LYS  41          1HD       LYS  41  -3.230  -8.164   0.967
  320   2HD   LYS  41          2HD       LYS  41  -2.532  -8.740   2.480
  321   1HE   LYS  41          1HE       LYS  41  -5.516  -8.794   2.239
  322   2HE   LYS  41          2HE       LYS  41  -4.590 -10.015   1.344
  323   1HZ   LYS  41          1HZ       LYS  41  -4.662 -11.009   3.387
  324   2HZ   LYS  41          2HZ       LYS  41  -4.767  -9.539   4.233
  325   3HZ   LYS  41          3HZ       LYS  41  -3.274 -10.062   3.616
  326    H    ARG  42           H        ARG  42  -0.474  -6.195   4.924
  327    HA   ARG  42           HA       ARG  42   0.272  -3.759   6.370
  328   1HB   ARG  42          1HB       ARG  42   2.094  -5.876   5.202
  329   2HB   ARG  42          2HB       ARG  42   2.359  -4.881   6.634
  330   1HG   ARG  42          1HG       ARG  42   0.197  -6.017   7.538
  331   2HG   ARG  42          2HG       ARG  42   0.495  -7.222   6.285
  332   1HD   ARG  42          1HD       ARG  42   2.947  -6.623   7.736
  333   2HD   ARG  42          2HD       ARG  42   1.664  -7.158   8.840
  334    HE   ARG  42           HE       ARG  42   2.595  -8.685   6.433
  335   1HH1  ARG  42          1HH2      ARG  42   2.776  -9.192   9.576
  336   2HH1  ARG  42          2HH2      ARG  42   1.699 -10.545   9.684
  337   1HH2  ARG  42          1HH1      ARG  42   0.404 -10.105   6.498
  338   2HH2  ARG  42          2HH1      ARG  42   0.355 -11.060   7.943
  339    H    ASN  43           H        ASN  43  -0.147  -4.505   3.109
  340    HA   ASN  43           HA       ASN  43   1.908  -2.500   2.237
  341   1HB   ASN  43          1HB       ASN  43   1.746  -4.976   1.393
  342   2HB   ASN  43          2HB       ASN  43   0.381  -4.383   0.446
  343   1HD2  ASN  43          1HD2      ASN  43   3.861  -3.722   1.083
  344   2HD2  ASN  43          2HD2      ASN  43   4.172  -3.054  -0.446
  345    H    ASN  44           H        ASN  44  -0.219  -1.311   3.359
  346    HA   ASN  44           HA       ASN  44  -1.591   0.002   1.081
  347   1HB   ASN  44          1HB       ASN  44  -3.011  -1.920   1.567
  348   2HB   ASN  44          2HB       ASN  44  -2.944  -1.592   3.295
  349   1HD2  ASN  44          1HD2      ASN  44  -5.458  -1.769   2.174
  350   2HD2  ASN  44          2HD2      ASN  44  -6.177  -0.223   2.070
  351    H    PHE  45           H        PHE  45  -0.180   1.725   2.003
  352    HA   PHE  45           HA       PHE  45  -0.819   2.658   4.743
  353   1HB   PHE  45          1HB       PHE  45   1.114   3.809   2.713
  354   2HB   PHE  45          2HB       PHE  45   1.185   3.945   4.471
  355    HD1  PHE  45           1HD      PHE  45   2.080   1.948   1.584
  356    HD2  PHE  45           2HD      PHE  45   1.563   1.831   5.848
  357    HE1  PHE  45           1HE      PHE  45   3.391  -0.159   1.685
  358    HE2  PHE  45           2HE      PHE  45   2.873  -0.273   5.951
  359    HZ   PHE  45           HZ       PHE  45   3.784  -1.279   3.868
  360    H    LYS  46           H        LYS  46  -1.853   4.611   5.178
  361    HA   LYS  46           HA       LYS  46  -3.611   5.719   3.164
  362   1HB   LYS  46          1HB       LYS  46  -4.325   5.685   5.432
  363   2HB   LYS  46          2HB       LYS  46  -2.814   6.400   5.998
  364   1HG   LYS  46          1HG       LYS  46  -4.332   8.010   4.026
  365   2HG   LYS  46          2HG       LYS  46  -5.094   7.828   5.607
  366   1HD   LYS  46          1HD       LYS  46  -3.148   8.720   6.721
  367   2HD   LYS  46          2HD       LYS  46  -2.212   8.682   5.227
  368   1HE   LYS  46          1HE       LYS  46  -3.716  10.379   4.236
  369   2HE   LYS  46          2HE       LYS  46  -4.670  10.404   5.731
  370   1HZ   LYS  46          1HZ       LYS  46  -2.806  11.154   6.951
  371   2HZ   LYS  46          2HZ       LYS  46  -2.842  12.123   5.556
  372   3HZ   LYS  46          3HZ       LYS  46  -1.733  10.841   5.675
  373    H    SER  47           H        SER  47  -0.392   6.497   4.284
  374    HA   SER  47           HA       SER  47  -0.378   8.860   2.439
  375   1HB   SER  47          1HB       SER  47   0.904  10.073   4.134
  376   2HB   SER  47          2HB       SER  47  -0.599   9.498   4.845
  377    HG   SER  47           HG       SER  47   1.998   8.723   5.350
  378    H    ALA  48           H        ALA  48   1.787   9.369   1.620
  379    HA   ALA  48           HA       ALA  48   3.335   7.041   0.903
  380   1HB   ALA  48          1HB       ALA  48   4.766   9.518   0.593
  381   2HB   ALA  48          2HB       ALA  48   3.064   9.792   0.218
  382   3HB   ALA  48          3HB       ALA  48   3.970   8.553  -0.651
  383    H    GLU  49           H        GLU  49   3.446   9.288   3.562
  384    HA   GLU  49           HA       GLU  49   6.222   8.861   4.301
  385   1HB   GLU  49          1HB       GLU  49   3.768  10.172   5.352
  386   2HB   GLU  49          2HB       GLU  49   4.994   9.749   6.548
  387   1HG   GLU  49          1HG       GLU  49   5.982  11.704   5.948
  388   2HG   GLU  49          2HG       GLU  49   6.506  10.830   4.507
  389    H    ASP  50           H        ASP  50   3.172   7.248   5.002
  390    HA   ASP  50           HA       ASP  50   4.223   5.674   7.234
  391   1HB   ASP  50          1HB       ASP  50   1.848   6.301   7.004
  392   2HB   ASP  50          2HB       ASP  50   1.756   5.422   5.477
  393    H    CYS  51           H        CYS  51   3.813   5.300   3.754
  394    HA   CYS  51           HA       CYS  51   4.442   2.456   3.674
  395   1HB   CYS  51          1HB       CYS  51   3.131   3.547   1.937
  396   2HB   CYS  51          2HB       CYS  51   4.424   4.703   1.630
  397    H    MET  52           H        MET  52   6.246   5.477   3.056
  398    HA   MET  52           HA       MET  52   8.742   4.222   2.352
  399   1HB   MET  52          1HB       MET  52   7.749   6.664   2.104
  400   2HB   MET  52          2HB       MET  52   8.530   6.915   3.666
  401   1HG   MET  52          1HG       MET  52  10.472   7.232   2.568
  402   2HG   MET  52          2HG       MET  52  10.414   5.540   2.074
  403   1HE   MET  52          1HE       MET  52  10.152   5.265  -1.225
  404   2HE   MET  52          2HE       MET  52   8.479   5.153  -0.686
  405   3HE   MET  52          3HE       MET  52   9.775   4.603   0.372
  406    H    ARG  53           H        ARG  53   7.601   5.696   5.421
  407    HA   ARG  53           HA       ARG  53   9.953   5.063   6.937
  408   1HB   ARG  53          1HB       ARG  53   8.592   5.738   8.795
  409   2HB   ARG  53          2HB       ARG  53   8.034   6.693   7.420
  410   1HG   ARG  53          1HG       ARG  53   5.965   5.904   7.873
  411   2HG   ARG  53          2HG       ARG  53   6.530   4.344   7.275
  412   1HD   ARG  53          1HD       ARG  53   6.117   3.552   9.374
  413   2HD   ARG  53          2HD       ARG  53   7.520   4.502   9.903
  414    HE   ARG  53           HE       ARG  53   5.929   6.391  10.314
  415   1HH1  ARG  53          1HH1      ARG  53   5.184   3.822  11.908
  416   2HH1  ARG  53          2HH1      ARG  53   3.459   3.868  11.762
  417   1HH2  ARG  53          1HH2      ARG  53   3.475   6.207   9.203
  418   2HH2  ARG  53          2HH2      ARG  53   2.491   5.218  10.229
  419    H    THR  54           H        THR  54   7.485   3.074   5.677
  420    HA   THR  54           HA       THR  54   7.966   0.935   7.713
  421    HB   THR  54           HB       THR  54   5.801   1.628   5.733
  422    HG1  THR  54           1HG      THR  54   6.019   2.156   8.132
  423   1HG2  THR  54          1HG2      THR  54   4.753  -0.540   6.086
  424   2HG2  THR  54          2HG2      THR  54   6.074  -1.042   7.142
  425   3HG2  THR  54          3HG2      THR  54   6.368  -0.785   5.422
  426    H    CYS  55           H        CYS  55   8.008   1.596   4.211
  427    HA   CYS  55           HA       CYS  55   9.346  -1.043   3.770
  428   1HB   CYS  55          1HB       CYS  55   8.023   0.893   1.844
  429   2HB   CYS  55          2HB       CYS  55   8.561  -0.745   1.469
  430    H    GLY  56           H        GLY  56  10.132   2.162   4.223
  431   1HA   GLY  56          1HA       GLY  56  11.911   2.887   2.193
  432   2HA   GLY  56          2HA       GLY  56  12.162   3.304   3.890
  433    H    GLY  57           H        GLY  57  13.416   1.569   1.288
  434   1HA   GLY  57          1HA       GLY  57  15.475   0.377   3.024
  435   2HA   GLY  57          2HA       GLY  57  14.524  -0.771   2.081
  436    H    ALA  58           H        ALA  58  15.044   2.356   0.708
  437    HA   ALA  58           HA       ALA  58  16.709   1.142  -1.421
  438   1HB   ALA  58          1HB       ALA  58  15.367   2.529  -2.597
  439   2HB   ALA  58          2HB       ALA  58  16.209   3.895  -1.866
  440   3HB   ALA  58          3HB       ALA  58  14.754   3.247  -1.108
  Start of MODEL   19
    1   1H    ARG   1          1H        ARG   1  15.041  -3.837   4.867
    2   2H    ARG   1          2H        ARG   1  14.557  -5.411   5.289
    3   3H    ARG   1          3H        ARG   1  14.308  -4.123   6.369
    4    HA   ARG   1           HA       ARG   1  12.495  -3.330   5.261
    5   1HB   ARG   1          1HB       ARG   1  13.462  -2.704   3.247
    6   2HB   ARG   1          2HB       ARG   1  14.155  -4.297   2.961
    7   1HG   ARG   1          1HG       ARG   1  11.710  -5.092   2.638
    8   2HG   ARG   1          2HG       ARG   1  11.309  -3.381   2.520
    9   1HD   ARG   1          1HD       ARG   1  13.117  -5.009   0.712
   10   2HD   ARG   1          2HD       ARG   1  11.694  -4.046   0.267
   11    HE   ARG   1           HE       ARG   1  13.233  -2.111   1.312
   12   1HH1  ARG   1          1HH1      ARG   1  15.670  -3.817   1.239
   13   2HH1  ARG   1          2HH1      ARG   1  16.332  -3.464  -0.322
   14   1HH2  ARG   1          1HH2      ARG   1  13.403  -2.060  -1.540
   15   2HH2  ARG   1          2HH2      ARG   1  15.049  -2.469  -1.896
   16    HA   PRO   2           HA       PRO   2  10.186  -7.038   5.838
   17   1HB   PRO   2          1HB       PRO   2   7.746  -6.081   5.074
   18   2HB   PRO   2          2HB       PRO   2   8.490  -5.681   6.631
   19   1HG   PRO   2          1HG       PRO   2   8.381  -4.100   4.100
   20   2HG   PRO   2          2HG       PRO   2   8.189  -3.551   5.772
   21   1HD   PRO   2          1HD       PRO   2  10.494  -3.241   4.340
   22   2HD   PRO   2          2HD       PRO   2  10.464  -3.428   6.110
   23    H    ASP   3           H        ASP   3   8.905  -8.583   4.533
   24    HA   ASP   3           HA       ASP   3   9.738  -8.542   1.707
   25   1HB   ASP   3          1HB       ASP   3   8.655 -10.456   3.712
   26   2HB   ASP   3          2HB       ASP   3   8.277 -10.795   2.023
   27    H    PHE   4           H        PHE   4   6.869  -7.890   3.619
   28    HA   PHE   4           HA       PHE   4   4.940  -8.315   1.512
   29   1HB   PHE   4          1HB       PHE   4   3.432  -7.095   2.985
   30   2HB   PHE   4          2HB       PHE   4   4.421  -8.200   3.928
   31    HD1  PHE   4           1HD      PHE   4   4.384  -4.591   2.786
   32    HD2  PHE   4           2HD      PHE   4   5.515  -7.433   5.807
   33    HE1  PHE   4           1HE      PHE   4   5.159  -2.752   4.236
   34    HE2  PHE   4           2HE      PHE   4   6.301  -5.578   7.249
   35    HZ   PHE   4           HZ       PHE   4   6.115  -3.236   6.462
   36    H    CYS   5           H        CYS   5   7.233  -5.790   2.080
   37    HA   CYS   5           HA       CYS   5   5.821  -3.686   0.659
   38   1HB   CYS   5          1HB       CYS   5   8.368  -4.181   1.989
   39   2HB   CYS   5          2HB       CYS   5   8.581  -3.231   0.518
   40    H    LEU   6           H        LEU   6   7.947  -6.345  -0.254
   41    HA   LEU   6           HA       LEU   6   8.423  -5.384  -2.976
   42   1HB   LEU   6          1HB       LEU   6   8.701  -8.171  -1.810
   43   2HB   LEU   6          2HB       LEU   6   9.554  -7.513  -3.207
   44    HG   LEU   6           HG       LEU   6   9.800  -6.450  -0.378
   45   1HD1  LEU   6          1HD1      LEU   6  11.276  -8.111  -0.019
   46   2HD1  LEU   6          2HD1      LEU   6  12.241  -7.521  -1.372
   47   3HD1  LEU   6          3HD1      LEU   6  10.994  -8.738  -1.644
   48   1HD2  LEU   6          1HD2      LEU   6  10.262  -4.707  -1.966
   49   2HD2  LEU   6          2HD2      LEU   6  11.176  -5.805  -3.000
   50   3HD2  LEU   6          3HD2      LEU   6  11.829  -5.319  -1.435
   51    H    GLU   7           H        GLU   7   5.941  -7.159  -1.331
   52    HA   GLU   7           HA       GLU   7   4.875  -8.483  -3.721
   53   1HB   GLU   7          1HB       GLU   7   4.031  -8.090  -0.848
   54   2HB   GLU   7          2HB       GLU   7   2.979  -8.900  -2.010
   55   1HG   GLU   7          1HG       GLU   7   4.471 -10.685  -2.303
   56   2HG   GLU   7          2HG       GLU   7   5.851  -9.752  -1.724
   57    HA   PRO   8           HA       PRO   8   2.178  -5.306  -5.100
   58   1HB   PRO   8          1HB       PRO   8  -0.083  -6.704  -5.759
   59   2HB   PRO   8          2HB       PRO   8   1.411  -6.771  -6.715
   60   1HG   PRO   8          1HG       PRO   8   0.338  -8.697  -4.704
   61   2HG   PRO   8          2HG       PRO   8   1.155  -9.014  -6.241
   62   1HD   PRO   8          1HD       PRO   8   2.377  -9.174  -3.795
   63   2HD   PRO   8          2HD       PRO   8   3.238  -8.804  -5.306
   64    HA   PRO   9           HA       PRO   9  -0.495  -4.045  -1.843
   65   1HB   PRO   9          1HB       PRO   9  -2.353  -2.555  -3.207
   66   2HB   PRO   9          2HB       PRO   9  -0.694  -2.000  -2.905
   67   1HG   PRO   9          1HG       PRO   9  -1.896  -3.197  -5.360
   68   2HG   PRO   9          2HG       PRO   9  -0.730  -1.872  -5.207
   69   1HD   PRO   9          1HD       PRO   9  -0.047  -4.432  -5.889
   70   2HD   PRO   9          2HD       PRO   9   1.055  -3.309  -5.060
   71    H    TYR  10           H        TYR  10  -3.293  -3.603  -1.977
   72    HA   TYR  10           HA       TYR  10  -4.512  -6.155  -2.934
   73   1HB   TYR  10          1HB       TYR  10  -3.664  -6.576  -0.660
   74   2HB   TYR  10          2HB       TYR  10  -4.501  -5.138  -0.070
   75    HD1  TYR  10           1HD      TYR  10  -6.474  -5.576   1.070
   76    HD2  TYR  10           2HD      TYR  10  -5.352  -8.103  -2.216
   77    HE1  TYR  10           1HE      TYR  10  -8.540  -6.907   1.387
   78    HE2  TYR  10           2HE      TYR  10  -7.419  -9.435  -1.898
   79    HH   TYR  10           HH       TYR  10  -9.012  -9.911   0.075
   80    H    THR  11           H        THR  11  -5.745  -4.904  -4.369
   81    HA   THR  11           HA       THR  11  -7.202  -2.543  -3.767
   82    HB   THR  11           HB       THR  11  -7.384  -4.813  -5.736
   83    HG1  THR  11           1HG      THR  11  -6.006  -3.366  -6.448
   84   1HG2  THR  11          1HG2      THR  11  -9.189  -3.310  -6.866
   85   2HG2  THR  11          2HG2      THR  11  -9.452  -2.685  -5.238
   86   3HG2  THR  11          3HG2      THR  11  -9.689  -4.400  -5.572
   87    H    GLY  12           H        GLY  12  -7.722  -5.878  -2.926
   88   1HA   GLY  12          1HA       GLY  12  -9.414  -6.894  -1.631
   89   2HA   GLY  12          2HA       GLY  12  -9.774  -5.277  -1.025
   90    HA   PRO  13           HA       PRO  13 -13.127  -6.707  -3.929
   91   1HB   PRO  13          1HB       PRO  13 -15.047  -7.388  -2.107
   92   2HB   PRO  13          2HB       PRO  13 -13.839  -8.533  -2.714
   93   1HG   PRO  13          1HG       PRO  13 -14.004  -7.148  -0.104
   94   2HG   PRO  13          2HG       PRO  13 -13.298  -8.718  -0.511
   95   1HD   PRO  13          1HD       PRO  13 -11.913  -6.302  -0.094
   96   2HD   PRO  13          2HD       PRO  13 -11.247  -7.801  -0.776
   97    H    CYS  14           H        CYS  14 -15.077  -5.812  -1.188
   98    HA   CYS  14           HA       CYS  14 -16.569  -3.974  -0.992
   99   1HB   CYS  14          1HB       CYS  14 -13.715  -3.089  -1.049
  100   2HB   CYS  14          2HB       CYS  14 -14.955  -1.836  -1.019
  101    H    LYS  15           H        LYS  15 -16.405  -1.387  -2.067
  102    HA   LYS  15           HA       LYS  15 -16.369  -1.745  -5.029
  103   1HB   LYS  15          1HB       LYS  15 -18.671  -1.273  -3.205
  104   2HB   LYS  15          2HB       LYS  15 -18.649  -0.315  -4.687
  105   1HG   LYS  15          1HG       LYS  15 -17.997  -2.754  -5.685
  106   2HG   LYS  15          2HG       LYS  15 -19.002  -3.241  -4.321
  107   1HD   LYS  15          1HD       LYS  15 -20.772  -1.664  -5.134
  108   2HD   LYS  15          2HD       LYS  15 -19.775  -1.333  -6.550
  109   1HE   LYS  15          1HE       LYS  15 -21.226  -3.050  -7.307
  110   2HE   LYS  15          2HE       LYS  15 -19.776  -3.954  -6.825
  111   1HZ   LYS  15          1HZ       LYS  15 -22.200  -3.432  -5.175
  112   2HZ   LYS  15          2HZ       LYS  15 -20.780  -4.155  -4.585
  113   3HZ   LYS  15          3HZ       LYS  15 -21.700  -4.935  -5.782
  114    H    ALA  16           H        ALA  16 -14.976  -0.169  -2.693
  115    HA   ALA  16           HA       ALA  16 -15.455   2.615  -3.631
  116   1HB   ALA  16          1HB       ALA  16 -15.440   2.449  -1.284
  117   2HB   ALA  16          2HB       ALA  16 -13.789   2.957  -1.636
  118   3HB   ALA  16          3HB       ALA  16 -14.134   1.264  -1.283
  119    H    ARG  17           H        ARG  17 -13.186   3.893  -3.592
  120    HA   ARG  17           HA       ARG  17 -10.971   2.310  -4.743
  121   1HB   ARG  17          1HB       ARG  17 -11.066   3.881  -6.790
  122   2HB   ARG  17          2HB       ARG  17 -12.289   2.612  -6.700
  123   1HG   ARG  17          1HG       ARG  17 -13.966   4.136  -5.985
  124   2HG   ARG  17          2HG       ARG  17 -12.779   5.372  -5.572
  125   1HD   ARG  17          1HD       ARG  17 -12.496   6.020  -7.790
  126   2HD   ARG  17          2HD       ARG  17 -12.905   4.410  -8.416
  127    HE   ARG  17           HE       ARG  17 -14.964   6.179  -7.135
  128   1HH1  ARG  17          1HH1      ARG  17 -14.814   6.687 -10.004
  129   2HH1  ARG  17          2HH1      ARG  17 -15.884   5.507 -10.683
  130   1HH2  ARG  17          1HH2      ARG  17 -15.935   3.525  -7.839
  131   2HH2  ARG  17          2HH2      ARG  17 -16.520   3.717  -9.457
  132    H    ILE  18           H        ILE  18 -10.292   3.375  -2.568
  133    HA   ILE  18           HA       ILE  18  -9.708   6.262  -2.707
  134    HB   ILE  18           HB       ILE  18  -9.011   4.084  -0.706
  135   1HG1  ILE  18          1HG1      ILE  18 -10.911   5.734   0.423
  136   2HG1  ILE  18          2HG1      ILE  18 -11.435   5.665  -1.261
  137   1HG2  ILE  18          1HG2      ILE  18  -8.492   7.008  -0.847
  138   2HG2  ILE  18          2HG2      ILE  18  -7.578   5.741  -0.029
  139   3HG2  ILE  18          3HG2      ILE  18  -9.045   6.387   0.708
  140   1HD1  ILE  18          1HD1      ILE  18 -11.987   3.455  -1.125
  141   2HD1  ILE  18          2HD1      ILE  18 -12.064   3.776   0.607
  142   3HD1  ILE  18          3HD1      ILE  18 -10.607   3.073  -0.096
  143    H    ILE  19           H        ILE  19  -7.481   7.071  -2.597
  144    HA   ILE  19           HA       ILE  19  -5.601   5.376  -4.144
  145    HB   ILE  19           HB       ILE  19  -5.446   8.270  -3.241
  146   1HG1  ILE  19          1HG1      ILE  19  -7.426   8.046  -4.579
  147   2HG1  ILE  19          2HG1      ILE  19  -6.178   8.681  -5.653
  148   1HG2  ILE  19          1HG2      ILE  19  -3.793   8.505  -5.000
  149   2HG2  ILE  19          2HG2      ILE  19  -4.055   6.842  -5.525
  150   3HG2  ILE  19          3HG2      ILE  19  -3.305   7.166  -3.962
  151   1HD1  ILE  19          1HD1      ILE  19  -7.338   5.908  -5.526
  152   2HD1  ILE  19          2HD1      ILE  19  -5.712   6.149  -6.162
  153   3HD1  ILE  19          3HD1      ILE  19  -7.086   6.941  -6.932
  154    H    ARG  20           H        ARG  20  -5.161   3.931  -2.231
  155    HA   ARG  20           HA       ARG  20  -3.794   5.082   0.097
  156   1HB   ARG  20          1HB       ARG  20  -4.452   2.319  -0.937
  157   2HB   ARG  20          2HB       ARG  20  -3.472   2.547   0.513
  158   1HG   ARG  20          1HG       ARG  20  -6.021   4.089   0.329
  159   2HG   ARG  20          2HG       ARG  20  -6.148   2.354   0.626
  160   1HD   ARG  20          1HD       ARG  20  -5.108   2.506   2.703
  161   2HD   ARG  20          2HD       ARG  20  -4.168   3.938   2.237
  162    HE   ARG  20           HE       ARG  20  -6.803   4.797   2.107
  163   1HH1  ARG  20          1HH1      ARG  20  -4.637   3.501   4.453
  164   2HH1  ARG  20          2HH1      ARG  20  -5.548   4.077   5.808
  165   1HH2  ARG  20          1HH2      ARG  20  -8.080   5.438   3.871
  166   2HH2  ARG  20          2HH2      ARG  20  -7.497   5.169   5.480
  167    H    TYR  21           H        TYR  21  -1.557   3.962   0.651
  168    HA   TYR  21           HA       TYR  21   0.132   4.111  -1.825
  169   1HB   TYR  21          1HB       TYR  21   0.646   4.851   1.067
  170   2HB   TYR  21          2HB       TYR  21   1.893   4.866  -0.180
  171    HD1  TYR  21           1HD      TYR  21  -1.305   6.375   0.907
  172    HD2  TYR  21           2HD      TYR  21   1.985   6.596  -1.843
  173    HE1  TYR  21           1HE      TYR  21  -2.043   8.642   0.208
  174    HE2  TYR  21           2HE      TYR  21   1.248   8.859  -2.546
  175    HH   TYR  21           HH       TYR  21  -0.527  10.312  -2.493
  176    H    PHE  22           H        PHE  22   1.880   2.657  -2.004
  177    HA   PHE  22           HA       PHE  22   2.218   0.528   0.029
  178   1HB   PHE  22          1HB       PHE  22   1.557  -1.223  -1.417
  179   2HB   PHE  22          2HB       PHE  22   0.348   0.017  -1.697
  180    HD1  PHE  22           1HD      PHE  22   3.164  -1.824  -3.111
  181    HD2  PHE  22           2HD      PHE  22   0.430   1.428  -3.744
  182    HE1  PHE  22           1HE      PHE  22   3.773  -1.780  -5.515
  183    HE2  PHE  22           2HE      PHE  22   1.039   1.473  -6.146
  184    HZ   PHE  22           HZ       PHE  22   2.710  -0.130  -7.032
  185    H    TYR  23           H        TYR  23   4.194  -0.770  -0.491
  186    HA   TYR  23           HA       TYR  23   6.261   0.968  -1.693
  187   1HB   TYR  23          1HB       TYR  23   6.555  -0.267   0.451
  188   2HB   TYR  23          2HB       TYR  23   6.428  -1.792  -0.435
  189    HD1  TYR  23           1HD      TYR  23   8.380  -2.743  -1.361
  190    HD2  TYR  23           2HD      TYR  23   8.308   1.452  -0.433
  191    HE1  TYR  23           1HE      TYR  23  10.771  -2.564  -1.988
  192    HE2  TYR  23           2HE      TYR  23  10.699   1.630  -1.057
  193    HH   TYR  23           HH       TYR  23  12.323   0.410  -2.479
  194    H    ASN  24           H        ASN  24   6.325   0.880  -3.939
  195    HA   ASN  24           HA       ASN  24   5.786  -1.630  -5.384
  196   1HB   ASN  24          1HB       ASN  24   5.020   0.514  -6.261
  197   2HB   ASN  24          2HB       ASN  24   6.656   1.161  -6.206
  198   1HD2  ASN  24          1HD2      ASN  24   5.272   1.117  -8.675
  199   2HD2  ASN  24          2HD2      ASN  24   5.981  -0.038  -9.695
  200    H    ALA  25           H        ALA  25   7.585  -2.984  -4.677
  201    HA   ALA  25           HA       ALA  25  10.290  -2.374  -4.506
  202   1HB   ALA  25          1HB       ALA  25   8.643  -4.650  -4.731
  203   2HB   ALA  25          2HB       ALA  25  10.354  -4.628  -4.304
  204   3HB   ALA  25          3HB       ALA  25   9.867  -4.838  -5.985
  205    H    LYS  26           H        LYS  26   8.304  -2.596  -7.389
  206    HA   LYS  26           HA       LYS  26  10.464  -2.695  -9.313
  207   1HB   LYS  26          1HB       LYS  26   7.657  -2.838  -9.233
  208   2HB   LYS  26          2HB       LYS  26   8.012  -1.416 -10.214
  209   1HG   LYS  26          1HG       LYS  26   9.851  -3.255 -11.140
  210   2HG   LYS  26          2HG       LYS  26   8.442  -4.264 -10.809
  211   1HD   LYS  26          1HD       LYS  26   8.061  -1.663 -12.255
  212   2HD   LYS  26          2HD       LYS  26   8.693  -3.048 -13.146
  213   1HE   LYS  26          1HE       LYS  26   6.630  -3.998 -13.222
  214   2HE   LYS  26          2HE       LYS  26   6.428  -3.812 -11.470
  215   1HZ   LYS  26          1HZ       LYS  26   4.933  -2.446 -13.069
  216   2HZ   LYS  26          2HZ       LYS  26   6.305  -1.460 -13.251
  217   3HZ   LYS  26          3HZ       LYS  26   5.608  -1.675 -11.717
  218    H    ALA  27           H        ALA  27   8.844  -0.133  -7.528
  219    HA   ALA  27           HA       ALA  27  10.141   1.965  -9.196
  220   1HB   ALA  27          1HB       ALA  27   7.758   1.661  -7.624
  221   2HB   ALA  27          2HB       ALA  27   8.214   3.014  -8.660
  222   3HB   ALA  27          3HB       ALA  27   8.696   3.001  -6.962
  223    H    GLY  28           H        GLY  28  10.564   0.264  -6.208
  224   1HA   GLY  28          1HA       GLY  28  12.480   0.355  -4.800
  225   2HA   GLY  28          2HA       GLY  28  13.011   1.801  -5.663
  226    H    LEU  29           H        LEU  29   9.860   2.387  -5.009
  227    HA   LEU  29           HA       LEU  29  10.270   3.312  -2.216
  228   1HB   LEU  29          1HB       LEU  29   9.459   5.586  -2.990
  229   2HB   LEU  29          2HB       LEU  29  11.037   5.133  -3.622
  230    HG   LEU  29           HG       LEU  29   9.244   4.079  -5.480
  231   1HD1  LEU  29          1HD1      LEU  29   8.027   6.312  -4.075
  232   2HD1  LEU  29          2HD1      LEU  29   7.332   5.261  -5.308
  233   3HD1  LEU  29          3HD1      LEU  29   8.257   6.685  -5.784
  234   1HD2  LEU  29          1HD2      LEU  29  10.656   5.204  -6.841
  235   2HD2  LEU  29          2HD2      LEU  29  11.442   5.804  -5.380
  236   3HD2  LEU  29          3HD2      LEU  29  10.178   6.758  -6.157
  237    H    CYS  30           H        CYS  30   7.793   4.999  -2.611
  238    HA   CYS  30           HA       CYS  30   5.816   2.749  -2.636
  239   1HB   CYS  30          1HB       CYS  30   5.806   5.417  -1.189
  240   2HB   CYS  30          2HB       CYS  30   4.557   4.180  -1.053
  241    H    GLN  31           H        GLN  31   3.792   3.118  -3.646
  242    HA   GLN  31           HA       GLN  31   3.511   5.621  -5.258
  243   1HB   GLN  31          1HB       GLN  31   3.542   2.734  -6.131
  244   2HB   GLN  31          2HB       GLN  31   2.657   3.936  -7.070
  245   1HG   GLN  31          1HG       GLN  31   5.078   5.189  -6.602
  246   2HG   GLN  31          2HG       GLN  31   5.553   3.506  -6.831
  247   1HE2  GLN  31          1HE2      GLN  31   6.524   4.659  -8.893
  248   2HE2  GLN  31          2HE2      GLN  31   5.519   4.703 -10.259
  249    H    THR  32           H        THR  32   1.147   5.521  -6.274
  250    HA   THR  32           HA       THR  32  -0.680   4.934  -4.015
  251    HB   THR  32           HB       THR  32  -2.243   6.267  -5.521
  252    HG1  THR  32           1HG      THR  32   0.039   6.951  -6.981
  253   1HG2  THR  32          1HG2      THR  32  -0.589   7.183  -3.730
  254   2HG2  THR  32          2HG2      THR  32  -1.302   8.321  -4.875
  255   3HG2  THR  32          3HG2      THR  32   0.348   7.744  -5.114
  256    H    PHE  33           H        PHE  33  -2.400   3.484  -4.178
  257    HA   PHE  33           HA       PHE  33  -2.811   2.056  -6.754
  258   1HB   PHE  33          1HB       PHE  33  -2.280  -0.050  -5.862
  259   2HB   PHE  33          2HB       PHE  33  -1.061   0.988  -5.139
  260    HD1  PHE  33           1HD      PHE  33  -1.132   1.562  -2.747
  261    HD2  PHE  33           2HD      PHE  33  -4.140  -0.935  -4.534
  262    HE1  PHE  33           1HE      PHE  33  -1.901   0.885  -0.501
  263    HE2  PHE  33           2HE      PHE  33  -4.908  -1.617  -2.276
  264    HZ   PHE  33           HZ       PHE  33  -3.786  -0.708  -0.258
  265    H    VAL  34           H        VAL  34  -4.831   0.779  -6.714
  266    HA   VAL  34           HA       VAL  34  -6.969   2.237  -5.389
  267    HB   VAL  34           HB       VAL  34  -6.798  -0.283  -7.066
  268   1HG1  VAL  34          1HG1      VAL  34  -8.807  -0.701  -6.000
  269   2HG1  VAL  34          2HG1      VAL  34  -9.375   0.366  -7.284
  270   3HG1  VAL  34          3HG1      VAL  34  -9.104   1.006  -5.663
  271   1HG2  VAL  34          1HG2      VAL  34  -7.855   1.220  -8.762
  272   2HG2  VAL  34          2HG2      VAL  34  -6.270   1.796  -8.245
  273   3HG2  VAL  34          3HG2      VAL  34  -7.733   2.554  -7.615
  274    H    TYR  35           H        TYR  35  -8.013   1.711  -3.508
  275    HA   TYR  35           HA       TYR  35  -7.289  -0.888  -2.183
  276   1HB   TYR  35          1HB       TYR  35  -6.223   0.993  -1.096
  277   2HB   TYR  35          2HB       TYR  35  -7.726   1.915  -1.103
  278    HD1  TYR  35           1HD      TYR  35  -7.363  -1.707  -0.332
  279    HD2  TYR  35           2HD      TYR  35  -8.057   2.232   1.237
  280    HE1  TYR  35           1HE      TYR  35  -7.981  -2.688   1.861
  281    HE2  TYR  35           2HE      TYR  35  -8.674   1.252   3.427
  282    HH   TYR  35           HH       TYR  35  -9.428  -0.805   4.373
  283    H    GLY  36           H        GLY  36  -9.036  -2.053  -1.314
  284   1HA   GLY  36          1HA       GLY  36 -11.700  -1.353  -2.245
  285   2HA   GLY  36          2HA       GLY  36 -11.287  -2.754  -1.257
  286    H    ALA  37           H        ALA  37  -9.931  -0.210   0.310
  287    HA   ALA  37           HA       ALA  37 -10.600   1.170   2.119
  288   1HB   ALA  37          1HB       ALA  37 -12.660   1.234   0.283
  289   2HB   ALA  37          2HB       ALA  37 -12.589   2.211   1.751
  290   3HB   ALA  37          3HB       ALA  37 -13.477   0.688   1.748
  291    H    CYS  38           H        CYS  38 -11.111  -2.091   1.824
  292    HA   CYS  38           HA       CYS  38 -11.787  -2.329   4.719
  293   1HB   CYS  38          1HB       CYS  38 -13.331  -4.239   3.987
  294   2HB   CYS  38          2HB       CYS  38 -13.888  -2.612   3.596
  295    H    ARG  39           H        ARG  39 -11.062  -4.392   5.624
  296    HA   ARG  39           HA       ARG  39  -9.495  -6.148   5.851
  297   1HB   ARG  39          1HB       ARG  39 -10.362  -6.201   2.964
  298   2HB   ARG  39          2HB       ARG  39  -9.180  -7.362   3.563
  299   1HG   ARG  39          1HG       ARG  39 -10.726  -8.467   4.847
  300   2HG   ARG  39          2HG       ARG  39 -11.623  -6.993   5.217
  301   1HD   ARG  39          1HD       ARG  39 -13.145  -7.895   3.734
  302   2HD   ARG  39          2HD       ARG  39 -12.055  -7.199   2.518
  303    HE   ARG  39           HE       ARG  39 -11.213  -9.396   2.099
  304   1HH1  ARG  39          1HH1      ARG  39 -14.086 -10.140   2.923
  305   2HH1  ARG  39          2HH1      ARG  39 -13.776 -11.460   4.001
  306   1HH2  ARG  39          1HH2      ARG  39 -10.407 -10.717   4.357
  307   2HH2  ARG  39          2HH2      ARG  39 -11.690 -11.785   4.815
  308    H    ALA  40           H        ALA  40  -8.470  -3.423   5.382
  309    HA   ALA  40           HA       ALA  40  -6.405  -3.236   3.465
  310   1HB   ALA  40          1HB       ALA  40  -7.136  -2.047   6.074
  311   2HB   ALA  40          2HB       ALA  40  -6.684  -1.252   4.566
  312   3HB   ALA  40          3HB       ALA  40  -5.434  -1.884   5.638
  313    H    LYS  41           H        LYS  41  -4.158  -3.769   3.561
  314    HA   LYS  41           HA       LYS  41  -3.403  -5.735   5.701
  315   1HB   LYS  41          1HB       LYS  41  -2.489  -5.725   2.812
  316   2HB   LYS  41          2HB       LYS  41  -2.331  -7.033   3.986
  317   1HG   LYS  41          1HG       LYS  41  -4.899  -7.021   4.095
  318   2HG   LYS  41          2HG       LYS  41  -4.846  -6.012   2.649
  319   1HD   LYS  41          1HD       LYS  41  -3.806  -8.835   2.987
  320   2HD   LYS  41          2HD       LYS  41  -5.052  -8.269   1.875
  321   1HE   LYS  41          1HE       LYS  41  -3.359  -8.136   0.344
  322   2HE   LYS  41          2HE       LYS  41  -2.851  -6.684   1.232
  323   1HZ   LYS  41          1HZ       LYS  41  -1.224  -8.692   0.980
  324   2HZ   LYS  41          2HZ       LYS  41  -2.136  -9.355   2.251
  325   3HZ   LYS  41          3HZ       LYS  41  -1.329  -7.876   2.463
  326    H    ARG  42           H        ARG  42  -0.756  -6.024   5.209
  327    HA   ARG  42           HA       ARG  42   0.432  -3.618   6.219
  328   1HB   ARG  42          1HB       ARG  42   2.476  -4.886   6.039
  329   2HB   ARG  42          2HB       ARG  42   1.213  -6.011   6.503
  330   1HG   ARG  42          1HG       ARG  42   0.976  -6.227   3.852
  331   2HG   ARG  42          2HG       ARG  42   2.670  -5.752   3.929
  332   1HD   ARG  42          1HD       ARG  42   2.403  -8.236   4.038
  333   2HD   ARG  42          2HD       ARG  42   3.085  -7.607   5.549
  334    HE   ARG  42           HE       ARG  42   0.156  -8.132   5.196
  335   1HH1  ARG  42          1HH1      ARG  42   2.430  -7.099   7.399
  336   2HH1  ARG  42          2HH1      ARG  42   2.022  -8.233   8.642
  337   1HH2  ARG  42          1HH2      ARG  42  -0.089 -10.097   6.620
  338   2HH2  ARG  42          2HH2      ARG  42   0.598  -9.929   8.202
  339    H    ASN  43           H        ASN  43   0.136  -4.897   2.906
  340    HA   ASN  43           HA       ASN  43   1.901  -2.769   1.861
  341   1HB   ASN  43          1HB       ASN  43   1.555  -5.272   1.081
  342   2HB   ASN  43          2HB       ASN  43   0.195  -4.589   0.186
  343   1HD2  ASN  43          1HD2      ASN  43   3.749  -4.381   0.580
  344   2HD2  ASN  43          2HD2      ASN  43   4.035  -3.627  -0.913
  345    H    ASN  44           H        ASN  44  -0.070  -1.508   3.141
  346    HA   ASN  44           HA       ASN  44  -1.582  -0.156   0.998
  347   1HB   ASN  44          1HB       ASN  44  -2.964  -2.120   1.589
  348   2HB   ASN  44          2HB       ASN  44  -2.878  -1.681   3.293
  349   1HD2  ASN  44          1HD2      ASN  44  -5.415  -1.877   2.314
  350   2HD2  ASN  44          2HD2      ASN  44  -6.108  -0.338   2.063
  351    H    PHE  45           H        PHE  45   0.048   1.427   1.978
  352    HA   PHE  45           HA       PHE  45  -0.466   2.338   4.726
  353   1HB   PHE  45          1HB       PHE  45   1.276   3.575   2.577
  354   2HB   PHE  45          2HB       PHE  45   1.479   3.687   4.327
  355    HD1  PHE  45           1HD      PHE  45   2.289   1.827   1.357
  356    HD2  PHE  45           2HD      PHE  45   1.937   1.499   5.627
  357    HE1  PHE  45           1HE      PHE  45   3.672  -0.233   1.309
  358    HE2  PHE  45           2HE      PHE  45   3.321  -0.562   5.582
  359    HZ   PHE  45           HZ       PHE  45   4.187  -1.441   3.421
  360    H    LYS  46           H        LYS  46  -1.663   4.131   5.279
  361    HA   LYS  46           HA       LYS  46  -3.576   5.260   3.495
  362   1HB   LYS  46          1HB       LYS  46  -3.684   5.160   5.984
  363   2HB   LYS  46          2HB       LYS  46  -2.397   6.363   6.068
  364   1HG   LYS  46          1HG       LYS  46  -4.191   7.554   4.352
  365   2HG   LYS  46          2HG       LYS  46  -5.260   6.711   5.474
  366   1HD   LYS  46          1HD       LYS  46  -3.006   8.575   6.283
  367   2HD   LYS  46          2HD       LYS  46  -4.716   9.009   6.255
  368   1HE   LYS  46          1HE       LYS  46  -4.945   8.137   8.337
  369   2HE   LYS  46          2HE       LYS  46  -4.434   6.552   7.721
  370   1HZ   LYS  46          1HZ       LYS  46  -2.106   7.480   7.800
  371   2HZ   LYS  46          2HZ       LYS  46  -2.826   7.207   9.316
  372   3HZ   LYS  46          3HZ       LYS  46  -2.726   8.784   8.690
  373    H    SER  47           H        SER  47  -0.263   6.149   4.237
  374    HA   SER  47           HA       SER  47  -0.408   8.259   2.138
  375   1HB   SER  47          1HB       SER  47   0.632   9.868   3.654
  376   2HB   SER  47          2HB       SER  47  -0.841   9.249   4.395
  377    HG   SER  47           HG       SER  47   1.591   9.166   5.377
  378    H    ALA  48           H        ALA  48   1.799   8.894   1.410
  379    HA   ALA  48           HA       ALA  48   3.549   6.640   1.060
  380   1HB   ALA  48          1HB       ALA  48   5.066   8.756   0.373
  381   2HB   ALA  48          2HB       ALA  48   3.504   9.568   0.470
  382   3HB   ALA  48          3HB       ALA  48   3.723   8.208  -0.631
  383    H    GLU  49           H        GLU  49   3.270   9.050   3.540
  384    HA   GLU  49           HA       GLU  49   5.981   8.982   4.539
  385   1HB   GLU  49          1HB       GLU  49   3.826  10.544   4.891
  386   2HB   GLU  49          2HB       GLU  49   3.634   9.511   6.309
  387   1HG   GLU  49          1HG       GLU  49   4.975  11.369   7.009
  388   2HG   GLU  49          2HG       GLU  49   6.079  10.006   6.838
  389    H    ASP  50           H        ASP  50   3.062   7.079   5.208
  390    HA   ASP  50           HA       ASP  50   4.253   5.657   7.474
  391   1HB   ASP  50          1HB       ASP  50   1.759   6.204   6.827
  392   2HB   ASP  50          2HB       ASP  50   1.886   4.736   5.857
  393    H    CYS  51           H        CYS  51   3.834   5.146   4.009
  394    HA   CYS  51           HA       CYS  51   4.633   2.360   3.949
  395   1HB   CYS  51          1HB       CYS  51   3.360   3.471   2.166
  396   2HB   CYS  51          2HB       CYS  51   4.686   4.602   1.896
  397    H    MET  52           H        MET  52   6.340   5.454   3.417
  398    HA   MET  52           HA       MET  52   8.918   4.318   2.838
  399   1HB   MET  52          1HB       MET  52   7.846   6.965   3.814
  400   2HB   MET  52          2HB       MET  52   9.583   6.711   3.650
  401   1HG   MET  52          1HG       MET  52   8.434   5.700   1.281
  402   2HG   MET  52          2HG       MET  52   7.618   7.232   1.591
  403   1HE   MET  52          1HE       MET  52   9.579   5.747  -0.312
  404   2HE   MET  52          2HE       MET  52  11.264   5.809   0.201
  405   3HE   MET  52          3HE       MET  52  10.669   6.964  -0.988
  406    H    ARG  53           H        ARG  53   7.670   5.821   5.850
  407    HA   ARG  53           HA       ARG  53   9.795   5.334   7.576
  408   1HB   ARG  53          1HB       ARG  53   7.065   6.017   7.710
  409   2HB   ARG  53          2HB       ARG  53   7.252   4.644   8.803
  410   1HG   ARG  53          1HG       ARG  53   8.708   5.786  10.198
  411   2HG   ARG  53          2HG       ARG  53   9.309   6.818   8.899
  412   1HD   ARG  53          1HD       ARG  53   7.970   8.346  10.050
  413   2HD   ARG  53          2HD       ARG  53   6.765   7.678   8.930
  414    HE   ARG  53           HE       ARG  53   6.323   5.979  10.843
  415   1HH1  ARG  53          1HH2      ARG  53   5.178   8.813  11.182
  416   2HH1  ARG  53          2HH2      ARG  53   5.579   9.123  12.839
  417   1HH2  ARG  53          1HH1      ARG  53   7.859   6.522  13.053
  418   2HH2  ARG  53          2HH1      ARG  53   7.095   7.827  13.897
  419    H    THR  54           H        THR  54   7.453   3.028   6.287
  420    HA   THR  54           HA       THR  54   8.319   0.827   8.014
  421    HB   THR  54           HB       THR  54   6.667   0.966   5.464
  422    HG1  THR  54           1HG      THR  54   5.896   0.711   8.180
  423   1HG2  THR  54          1HG2      THR  54   6.053  -1.271   5.816
  424   2HG2  THR  54          2HG2      THR  54   6.612  -1.261   7.488
  425   3HG2  THR  54          3HG2      THR  54   7.780  -1.278   6.168
  426    H    CYS  55           H        CYS  55   8.513   1.369   4.466
  427    HA   CYS  55           HA       CYS  55  11.019  -0.286   4.463
  428   1HB   CYS  55          1HB       CYS  55   9.024   0.283   2.245
  429   2HB   CYS  55          2HB       CYS  55  10.373  -0.852   2.168
  430    H    GLY  56           H        GLY  56   9.455   2.519   2.870
  431   1HA   GLY  56          1HA       GLY  56  10.443   4.293   1.660
  432   2HA   GLY  56          2HA       GLY  56  11.503   4.363   3.068
  433    H    GLY  57           H        GLY  57  13.576   4.474   2.330
  434   1HA   GLY  57          1HA       GLY  57  14.315   2.995  -0.134
  435   2HA   GLY  57          2HA       GLY  57  15.297   4.226   0.658
  436    H    ALA  58           H        ALA  58  14.059   2.167   2.994
  437    HA   ALA  58           HA       ALA  58  15.146   0.578   4.375
  438   1HB   ALA  58          1HB       ALA  58  16.383  -0.611   1.939
  439   2HB   ALA  58          2HB       ALA  58  14.629  -0.421   1.916
  440   3HB   ALA  58          3HB       ALA  58  15.396  -1.378   3.183
  Start of MODEL   20
    1   1H    ARG   1          1H        ARG   1  14.443  -4.241   4.696
    2   2H    ARG   1          2H        ARG   1  14.300  -5.829   4.111
    3   3H    ARG   1          3H        ARG   1  13.795  -5.454   5.690
    4    HA   ARG   1           HA       ARG   1  12.130  -3.875   4.637
    5   1HB   ARG   1          1HB       ARG   1  13.389  -5.335   2.327
    6   2HB   ARG   1          2HB       ARG   1  11.718  -4.785   2.201
    7   1HG   ARG   1          1HG       ARG   1  12.562  -2.492   2.938
    8   2HG   ARG   1          2HG       ARG   1  14.194  -3.112   2.687
    9   1HD   ARG   1          1HD       ARG   1  11.990  -2.895   0.597
   10   2HD   ARG   1          2HD       ARG   1  13.520  -1.994   0.636
   11    HE   ARG   1           HE       ARG   1  13.189  -4.717  -0.295
   12   1HH1  ARG   1          1HH1      ARG   1  15.288  -2.456   1.242
   13   2HH1  ARG   1          2HH1      ARG   1  16.717  -3.393   0.964
   14   1HH2  ARG   1          1HH2      ARG   1  15.034  -6.003  -0.574
   15   2HH2  ARG   1          2HH2      ARG   1  16.574  -5.400  -0.060
   16    HA   PRO   2           HA       PRO   2   9.705  -7.347   5.959
   17   1HB   PRO   2          1HB       PRO   2   7.251  -6.175   5.623
   18   2HB   PRO   2          2HB       PRO   2   8.310  -5.836   6.999
   19   1HG   PRO   2          1HG       PRO   2   7.885  -4.285   4.481
   20   2HG   PRO   2          2HG       PRO   2   8.049  -3.694   6.140
   21   1HD   PRO   2          1HD       PRO   2  10.067  -3.615   4.324
   22   2HD   PRO   2          2HD       PRO   2  10.353  -3.812   6.068
   23    H    ASP   3           H        ASP   3   8.300  -8.918   5.000
   24    HA   ASP   3           HA       ASP   3   8.528  -9.186   2.133
   25   1HB   ASP   3          1HB       ASP   3   7.439 -10.633   4.473
   26   2HB   ASP   3          2HB       ASP   3   6.629 -10.988   2.947
   27    H    PHE   4           H        PHE   4   6.015  -7.990   4.335
   28    HA   PHE   4           HA       PHE   4   3.876  -8.002   2.381
   29   1HB   PHE   4          1HB       PHE   4   2.682  -6.762   4.043
   30   2HB   PHE   4          2HB       PHE   4   3.740  -7.856   4.921
   31    HD1  PHE   4           1HD      PHE   4   5.063  -7.025   6.613
   32    HD2  PHE   4           2HD      PHE   4   3.732  -4.346   3.523
   33    HE1  PHE   4           1HE      PHE   4   6.056  -5.116   7.831
   34    HE2  PHE   4           2HE      PHE   4   4.737  -2.456   4.743
   35    HZ   PHE   4           HZ       PHE   4   5.898  -2.826   6.892
   36    H    CYS   5           H        CYS   5   6.624  -6.012   2.806
   37    HA   CYS   5           HA       CYS   5   5.529  -3.650   1.444
   38   1HB   CYS   5          1HB       CYS   5   7.169  -3.271   3.116
   39   2HB   CYS   5          2HB       CYS   5   8.195  -4.578   2.522
   40    H    LEU   6           H        LEU   6   7.255  -6.586   0.643
   41    HA   LEU   6           HA       LEU   6   8.088  -5.616  -2.016
   42   1HB   LEU   6          1HB       LEU   6   8.138  -8.444  -0.942
   43   2HB   LEU   6          2HB       LEU   6   9.228  -7.706  -2.115
   44    HG   LEU   6           HG       LEU   6   9.062  -7.182   0.861
   45   1HD1  LEU   6          1HD1      LEU   6  11.186  -8.105   0.960
   46   2HD1  LEU   6          2HD1      LEU   6  11.566  -7.667  -0.706
   47   3HD1  LEU   6          3HD1      LEU   6  10.505  -9.037  -0.373
   48   1HD2  LEU   6          1HD2      LEU   6  10.967  -5.506   0.256
   49   2HD2  LEU   6          2HD2      LEU   6   9.297  -4.994   0.021
   50   3HD2  LEU   6          3HD2      LEU   6  10.257  -5.527  -1.358
   51    H    GLU   7           H        GLU   7   5.338  -7.096  -0.589
   52    HA   GLU   7           HA       GLU   7   4.412  -8.519  -2.970
   53   1HB   GLU   7          1HB       GLU   7   3.572  -7.956  -0.186
   54   2HB   GLU   7          2HB       GLU   7   2.251  -8.209  -1.328
   55   1HG   GLU   7          1HG       GLU   7   3.752 -10.265  -2.083
   56   2HG   GLU   7          2HG       GLU   7   4.401 -10.103  -0.451
   57    HA   PRO   8           HA       PRO   8   2.322  -5.213  -4.949
   58   1HB   PRO   8          1HB       PRO   8   0.038  -6.446  -5.835
   59   2HB   PRO   8          2HB       PRO   8   1.635  -6.720  -6.560
   60   1HG   PRO   8          1HG       PRO   8   0.099  -8.389  -4.626
   61   2HG   PRO   8          2HG       PRO   8   1.113  -8.888  -5.988
   62   1HD   PRO   8          1HD       PRO   8   1.908  -8.952  -3.361
   63   2HD   PRO   8          2HD       PRO   8   3.028  -8.810  -4.735
   64    HA   PRO   9           HA       PRO   9  -0.655  -3.440  -2.265
   65   1HB   PRO   9          1HB       PRO   9  -2.323  -2.107  -3.989
   66   2HB   PRO   9          2HB       PRO   9  -0.687  -1.555  -3.583
   67   1HG   PRO   9          1HG       PRO   9  -1.678  -2.997  -5.994
   68   2HG   PRO   9          2HG       PRO   9  -0.455  -1.721  -5.861
   69   1HD   PRO   9          1HD       PRO   9   0.121  -4.389  -6.156
   70   2HD   PRO   9          2HD       PRO   9   1.213  -3.215  -5.391
   71    H    TYR  10           H        TYR  10  -3.096  -3.355  -1.787
   72    HA   TYR  10           HA       TYR  10  -4.476  -5.784  -2.911
   73   1HB   TYR  10          1HB       TYR  10  -3.433  -5.910  -0.571
   74   2HB   TYR  10          2HB       TYR  10  -4.657  -4.737  -0.078
   75    HD1  TYR  10           1HD      TYR  10  -6.881  -5.410   0.370
   76    HD2  TYR  10           2HD      TYR  10  -4.194  -8.096  -1.635
   77    HE1  TYR  10           1HE      TYR  10  -8.551  -7.233   0.571
   78    HE2  TYR  10           2HE      TYR  10  -5.864  -9.918  -1.431
   79    HH   TYR  10           HH       TYR  10  -8.012 -10.393  -0.934
   80    H    THR  11           H        THR  11  -5.801  -4.572  -4.322
   81    HA   THR  11           HA       THR  11  -7.322  -2.254  -3.522
   82    HB   THR  11           HB       THR  11  -7.339  -4.286  -5.746
   83    HG1  THR  11           1HG      THR  11  -6.943  -1.511  -5.446
   84   1HG2  THR  11          1HG2      THR  11  -9.643  -4.045  -5.710
   85   2HG2  THR  11          2HG2      THR  11  -9.204  -2.650  -6.693
   86   3HG2  THR  11          3HG2      THR  11  -9.568  -2.441  -4.980
   87    H    GLY  12           H        GLY  12  -7.648  -5.685  -3.083
   88   1HA   GLY  12          1HA       GLY  12  -9.289  -6.964  -1.981
   89   2HA   GLY  12          2HA       GLY  12  -9.747  -5.469  -1.164
   90    HA   PRO  13           HA       PRO  13 -12.968  -6.704  -4.324
   91   1HB   PRO  13          1HB       PRO  13 -14.844  -7.804  -2.668
   92   2HB   PRO  13          2HB       PRO  13 -13.550  -8.748  -3.427
   93   1HG   PRO  13          1HG       PRO  13 -13.826  -7.788  -0.638
   94   2HG   PRO  13          2HG       PRO  13 -13.034  -9.242  -1.260
   95   1HD   PRO  13          1HD       PRO  13 -11.772  -6.871  -0.456
   96   2HD   PRO  13          2HD       PRO  13 -11.033  -8.187  -1.395
   97    H    CYS  14           H        CYS  14 -14.948  -6.405  -1.470
   98    HA   CYS  14           HA       CYS  14 -16.541  -4.726  -0.942
   99   1HB   CYS  14          1HB       CYS  14 -13.763  -3.681  -0.971
  100   2HB   CYS  14          2HB       CYS  14 -15.038  -2.467  -0.870
  101    H    LYS  15           H        LYS  15 -16.724  -2.060  -1.680
  102    HA   LYS  15           HA       LYS  15 -16.866  -2.098  -4.672
  103   1HB   LYS  15          1HB       LYS  15 -19.044  -2.691  -3.626
  104   2HB   LYS  15          2HB       LYS  15 -19.003  -1.179  -2.719
  105   1HG   LYS  15          1HG       LYS  15 -18.536  -0.415  -5.371
  106   2HG   LYS  15          2HG       LYS  15 -19.786  -1.654  -5.487
  107   1HD   LYS  15          1HD       LYS  15 -21.094  -0.436  -3.741
  108   2HD   LYS  15          2HD       LYS  15 -19.867   0.833  -3.749
  109   1HE   LYS  15          1HE       LYS  15 -20.669   0.302  -6.465
  110   2HE   LYS  15          2HE       LYS  15 -22.113   0.601  -5.477
  111   1HZ   LYS  15          1HZ       LYS  15 -19.702   2.297  -5.803
  112   2HZ   LYS  15          2HZ       LYS  15 -20.742   2.483  -4.472
  113   3HZ   LYS  15          3HZ       LYS  15 -21.325   2.724  -6.049
  114    H    ALA  16           H        ALA  16 -15.067  -0.759  -2.600
  115    HA   ALA  16           HA       ALA  16 -15.717   2.105  -3.201
  116   1HB   ALA  16          1HB       ALA  16 -14.493   2.600  -1.200
  117   2HB   ALA  16          2HB       ALA  16 -13.776   0.990  -1.161
  118   3HB   ALA  16          3HB       ALA  16 -15.493   1.199  -0.815
  119    H    ARG  17           H        ARG  17 -13.576   3.451  -3.361
  120    HA   ARG  17           HA       ARG  17 -11.322   1.991  -4.602
  121   1HB   ARG  17          1HB       ARG  17 -11.565   3.365  -6.686
  122   2HB   ARG  17          2HB       ARG  17 -12.922   2.270  -6.427
  123   1HG   ARG  17          1HG       ARG  17 -14.388   3.979  -5.996
  124   2HG   ARG  17          2HG       ARG  17 -13.159   4.973  -5.210
  125   1HD   ARG  17          1HD       ARG  17 -13.551   6.140  -7.230
  126   2HD   ARG  17          2HD       ARG  17 -12.151   5.132  -7.650
  127    HE   ARG  17           HE       ARG  17 -14.526   3.616  -8.101
  128   1HH1  ARG  17          1HH2      ARG  17 -12.128   4.514  -9.949
  129   2HH1  ARG  17          2HH2      ARG  17 -13.031   5.178 -11.270
  130   1HH2  ARG  17          1HH1      ARG  17 -16.023   5.282  -9.518
  131   2HH2  ARG  17          2HH1      ARG  17 -15.239   5.611 -11.026
  132    H    ILE  18           H        ILE  18 -10.543   3.071  -2.496
  133    HA   ILE  18           HA       ILE  18 -10.169   6.002  -2.650
  134    HB   ILE  18           HB       ILE  18  -9.352   3.883  -0.632
  135   1HG1  ILE  18          1HG1      ILE  18 -11.407   5.797   0.141
  136   2HG1  ILE  18          2HG1      ILE  18 -11.880   4.893  -1.297
  137   1HG2  ILE  18          1HG2      ILE  18  -7.932   5.730  -0.228
  138   2HG2  ILE  18          2HG2      ILE  18  -9.292   6.003   0.861
  139   3HG2  ILE  18          3HG2      ILE  18  -9.184   6.896  -0.656
  140   1HD1  ILE  18          1HD1      ILE  18 -12.086   3.998   1.326
  141   2HD1  ILE  18          2HD1      ILE  18 -10.631   3.196   0.735
  142   3HD1  ILE  18          3HD1      ILE  18 -12.162   2.984  -0.115
  143    H    ILE  19           H        ILE  19  -7.912   6.862  -2.292
  144    HA   ILE  19           HA       ILE  19  -5.963   5.331  -3.952
  145    HB   ILE  19           HB       ILE  19  -6.140   8.236  -3.090
  146   1HG1  ILE  19          1HG1      ILE  19  -7.926   7.690  -4.620
  147   2HG1  ILE  19          2HG1      ILE  19  -6.686   8.539  -5.545
  148   1HG2  ILE  19          1HG2      ILE  19  -3.816   7.467  -3.528
  149   2HG2  ILE  19          2HG2      ILE  19  -4.367   8.621  -4.742
  150   3HG2  ILE  19          3HG2      ILE  19  -4.321   6.899  -5.119
  151   1HD1  ILE  19          1HD1      ILE  19  -7.623   5.756  -5.766
  152   2HD1  ILE  19          2HD1      ILE  19  -5.867   5.914  -5.737
  153   3HD1  ILE  19          3HD1      ILE  19  -6.809   6.766  -6.961
  154    H    ARG  20           H        ARG  20  -5.097   3.948  -2.311
  155    HA   ARG  20           HA       ARG  20  -3.925   5.205   0.112
  156   1HB   ARG  20          1HB       ARG  20  -4.336   2.376  -0.887
  157   2HB   ARG  20          2HB       ARG  20  -3.476   2.739   0.609
  158   1HG   ARG  20          1HG       ARG  20  -6.195   3.929   0.126
  159   2HG   ARG  20          2HG       ARG  20  -6.059   2.261   0.688
  160   1HD   ARG  20          1HD       ARG  20  -5.049   2.909   2.721
  161   2HD   ARG  20          2HD       ARG  20  -4.544   4.482   2.072
  162    HE   ARG  20           HE       ARG  20  -7.053   5.002   1.960
  163   1HH1  ARG  20          1HH1      ARG  20  -5.463   3.869   4.648
  164   2HH1  ARG  20          2HH1      ARG  20  -6.880   3.406   5.530
  165   1HH2  ARG  20          1HH2      ARG  20  -9.026   3.863   2.843
  166   2HH2  ARG  20          2HH2      ARG  20  -8.897   3.402   4.508
  167    H    TYR  21           H        TYR  21  -1.639   4.039   0.637
  168    HA   TYR  21           HA       TYR  21   0.050   4.405  -1.814
  169   1HB   TYR  21          1HB       TYR  21   0.448   5.040   1.114
  170   2HB   TYR  21          2HB       TYR  21   1.790   5.027  -0.029
  171    HD1  TYR  21           1HD      TYR  21   1.991   6.707  -1.767
  172    HD2  TYR  21           2HD      TYR  21  -1.346   6.703   0.936
  173    HE1  TYR  21           1HE      TYR  21   1.406   9.008  -2.488
  174    HE2  TYR  21           2HE      TYR  21  -1.934   9.004   0.214
  175    HH   TYR  21           HH       TYR  21  -0.960  10.390  -2.484
  176    H    PHE  22           H        PHE  22   1.709   2.912  -2.187
  177    HA   PHE  22           HA       PHE  22   2.132   0.718  -0.229
  178   1HB   PHE  22          1HB       PHE  22   1.422  -0.962  -1.707
  179   2HB   PHE  22          2HB       PHE  22   0.253   0.311  -2.006
  180    HD1  PHE  22           1HD      PHE  22   3.132  -1.519  -3.343
  181    HD2  PHE  22           2HD      PHE  22   0.345   1.672  -4.057
  182    HE1  PHE  22           1HE      PHE  22   3.798  -1.474  -5.731
  183    HE2  PHE  22           2HE      PHE  22   1.013   1.719  -6.446
  184    HZ   PHE  22           HZ       PHE  22   2.740   0.145  -7.283
  185    H    TYR  23           H        TYR  23   4.082  -0.579  -0.858
  186    HA   TYR  23           HA       TYR  23   6.145   1.209  -2.029
  187   1HB   TYR  23          1HB       TYR  23   6.459   0.063   0.143
  188   2HB   TYR  23          2HB       TYR  23   6.296  -1.500  -0.661
  189    HD1  TYR  23           1HD      TYR  23   8.168  -2.531  -1.666
  190    HD2  TYR  23           2HD      TYR  23   8.321   1.647  -0.673
  191    HE1  TYR  23           1HE      TYR  23  10.579  -2.484  -2.247
  192    HE2  TYR  23           2HE      TYR  23  10.730   1.699  -1.257
  193    HH   TYR  23           HH       TYR  23  12.453   0.550  -2.051
  194    H    ASN  24           H        ASN  24   6.763   0.964  -4.147
  195    HA   ASN  24           HA       ASN  24   5.993  -1.510  -5.613
  196   1HB   ASN  24          1HB       ASN  24   5.425   0.728  -6.506
  197   2HB   ASN  24          2HB       ASN  24   7.133   1.158  -6.513
  198   1HD2  ASN  24          1HD2      ASN  24   5.771   1.214  -8.965
  199   2HD2  ASN  24          2HD2      ASN  24   6.269  -0.089  -9.932
  200    H    ALA  25           H        ALA  25   7.637  -3.010  -4.972
  201    HA   ALA  25           HA       ALA  25  10.356  -2.568  -4.563
  202   1HB   ALA  25          1HB       ALA  25   9.529  -4.733  -4.172
  203   2HB   ALA  25          2HB       ALA  25  10.494  -4.961  -5.631
  204   3HB   ALA  25          3HB       ALA  25   8.741  -4.815  -5.748
  205    H    LYS  26           H        LYS  26   8.636  -2.839  -7.657
  206    HA   LYS  26           HA       LYS  26  10.987  -2.852  -9.333
  207   1HB   LYS  26          1HB       LYS  26   8.744  -3.599 -10.039
  208   2HB   LYS  26          2HB       LYS  26   8.123  -1.961  -9.827
  209   1HG   LYS  26          1HG       LYS  26  10.267  -1.499 -11.458
  210   2HG   LYS  26          2HG       LYS  26   9.765  -3.096 -12.013
  211   1HD   LYS  26          1HD       LYS  26   7.498  -1.300 -11.580
  212   2HD   LYS  26          2HD       LYS  26   8.630  -0.676 -12.780
  213   1HE   LYS  26          1HE       LYS  26   7.788  -2.146 -14.290
  214   2HE   LYS  26          2HE       LYS  26   8.302  -3.488 -13.248
  215   1HZ   LYS  26          1HZ       LYS  26   6.278  -3.558 -12.203
  216   2HZ   LYS  26          2HZ       LYS  26   5.768  -3.045 -13.741
  217   3HZ   LYS  26          3HZ       LYS  26   5.941  -1.920 -12.480
  218    H    ALA  27           H        ALA  27   9.170  -0.328  -7.702
  219    HA   ALA  27           HA       ALA  27  10.556   1.796  -9.260
  220   1HB   ALA  27          1HB       ALA  27   8.746   3.052  -8.675
  221   2HB   ALA  27          2HB       ALA  27   8.800   2.508  -6.998
  222   3HB   ALA  27          3HB       ALA  27   8.024   1.508  -8.226
  223    H    GLY  28           H        GLY  28  10.620   0.208  -6.142
  224   1HA   GLY  28          1HA       GLY  28  12.417   0.295  -4.579
  225   2HA   GLY  28          2HA       GLY  28  13.085   1.669  -5.462
  226    H    LEU  29           H        LEU  29  10.005   2.565  -5.218
  227    HA   LEU  29           HA       LEU  29  10.282   3.680  -2.455
  228   1HB   LEU  29          1HB       LEU  29   9.134   5.151  -4.835
  229   2HB   LEU  29          2HB       LEU  29   9.684   5.826  -3.303
  230    HG   LEU  29           HG       LEU  29  11.922   4.484  -4.281
  231   1HD1  LEU  29          1HD1      LEU  29  12.080   4.731  -6.552
  232   2HD1  LEU  29          2HD1      LEU  29  11.117   6.209  -6.562
  233   3HD1  LEU  29          3HD1      LEU  29  10.321   4.637  -6.463
  234   1HD2  LEU  29          1HD2      LEU  29  11.034   7.182  -3.705
  235   2HD2  LEU  29          2HD2      LEU  29  12.133   7.177  -5.083
  236   3HD2  LEU  29          3HD2      LEU  29  12.647   6.488  -3.543
  237    H    CYS  30           H        CYS  30   7.757   5.174  -3.001
  238    HA   CYS  30           HA       CYS  30   5.841   2.868  -2.908
  239   1HB   CYS  30          1HB       CYS  30   5.808   5.485  -1.372
  240   2HB   CYS  30          2HB       CYS  30   4.648   4.169  -1.195
  241    H    GLN  31           H        GLN  31   3.796   3.229  -3.852
  242    HA   GLN  31           HA       GLN  31   3.406   5.797  -5.329
  243   1HB   GLN  31          1HB       GLN  31   3.436   2.950  -6.345
  244   2HB   GLN  31          2HB       GLN  31   2.572   4.219  -7.216
  245   1HG   GLN  31          1HG       GLN  31   4.516   5.319  -7.806
  246   2HG   GLN  31          2HG       GLN  31   5.379   4.785  -6.363
  247   1HE2  GLN  31          1HE2      GLN  31   6.841   4.446  -8.614
  248   2HE2  GLN  31          2HE2      GLN  31   6.837   2.832  -9.141
  249    H    THR  32           H        THR  32   1.080   6.096  -5.916
  250    HA   THR  32           HA       THR  32  -0.667   5.101  -3.778
  251    HB   THR  32           HB       THR  32  -2.279   6.654  -4.946
  252    HG1  THR  32           1HG      THR  32  -1.069   6.216  -7.013
  253   1HG2  THR  32          1HG2      THR  32  -0.912   7.588  -3.211
  254   2HG2  THR  32          2HG2      THR  32  -0.849   8.718  -4.564
  255   3HG2  THR  32          3HG2      THR  32   0.504   7.627  -4.263
  256    H    PHE  33           H        PHE  33  -2.409   3.697  -4.050
  257    HA   PHE  33           HA       PHE  33  -2.904   2.575  -6.771
  258   1HB   PHE  33          1HB       PHE  33  -2.503   0.360  -6.041
  259   2HB   PHE  33          2HB       PHE  33  -1.200   1.280  -5.300
  260    HD1  PHE  33           1HD      PHE  33  -4.230  -0.669  -4.712
  261    HD2  PHE  33           2HD      PHE  33  -1.296   1.876  -2.870
  262    HE1  PHE  33           1HE      PHE  33  -4.960  -1.442  -2.472
  263    HE2  PHE  33           2HE      PHE  33  -2.031   1.115  -0.640
  264    HZ   PHE  33           HZ       PHE  33  -3.862  -0.551  -0.434
  265    H    VAL  34           H        VAL  34  -4.966   1.249  -6.758
  266    HA   VAL  34           HA       VAL  34  -7.072   2.714  -5.386
  267    HB   VAL  34           HB       VAL  34  -7.292   0.077  -6.854
  268   1HG1  VAL  34          1HG1      VAL  34  -9.500   0.535  -6.845
  269   2HG1  VAL  34          2HG1      VAL  34  -9.218   2.165  -7.459
  270   3HG1  VAL  34          3HG1      VAL  34  -9.154   1.852  -5.724
  271   1HG2  VAL  34          1HG2      VAL  34  -6.361   2.702  -7.822
  272   2HG2  VAL  34          2HG2      VAL  34  -7.703   2.033  -8.751
  273   3HG2  VAL  34          3HG2      VAL  34  -6.210   1.112  -8.570
  274    H    TYR  35           H        TYR  35  -8.074   2.169  -3.476
  275    HA   TYR  35           HA       TYR  35  -7.244  -0.402  -2.161
  276   1HB   TYR  35          1HB       TYR  35  -6.497   1.659  -1.074
  277   2HB   TYR  35          2HB       TYR  35  -8.142   2.292  -1.083
  278    HD1  TYR  35           1HD      TYR  35  -7.271  -1.247  -0.409
  279    HD2  TYR  35           2HD      TYR  35  -8.413   2.526   1.302
  280    HE1  TYR  35           1HE      TYR  35  -7.706  -2.363   1.764
  281    HE2  TYR  35           2HE      TYR  35  -8.848   1.409   3.472
  282    HH   TYR  35           HH       TYR  35  -7.892  -0.865   4.593
  283    H    GLY  36           H        GLY  36  -8.897  -1.698  -1.211
  284   1HA   GLY  36          1HA       GLY  36 -11.607  -1.263  -2.280
  285   2HA   GLY  36          2HA       GLY  36 -11.048  -2.703  -1.434
  286    H    ALA  37           H        ALA  37  -9.978  -0.278   0.458
  287    HA   ALA  37           HA       ALA  37 -10.820   0.854   2.368
  288   1HB   ALA  37          1HB       ALA  37 -13.080   1.481   2.337
  289   2HB   ALA  37          2HB       ALA  37 -13.585  -0.024   1.572
  290   3HB   ALA  37          3HB       ALA  37 -12.745   1.205   0.628
  291    H    CYS  38           H        CYS  38 -11.154  -2.440   1.703
  292    HA   CYS  38           HA       CYS  38 -11.538  -3.004   4.602
  293   1HB   CYS  38          1HB       CYS  38 -13.277  -4.666   4.058
  294   2HB   CYS  38          2HB       CYS  38 -13.757  -3.065   3.497
  295    H    ARG  39           H        ARG  39 -11.098  -5.424   5.010
  296    HA   ARG  39           HA       ARG  39  -9.420  -7.106   4.926
  297   1HB   ARG  39          1HB       ARG  39 -11.263  -7.238   2.898
  298   2HB   ARG  39          2HB       ARG  39  -9.751  -7.260   1.993
  299   1HG   ARG  39          1HG       ARG  39  -9.064  -9.265   2.932
  300   2HG   ARG  39          2HG       ARG  39  -9.994  -9.012   4.409
  301   1HD   ARG  39          1HD       ARG  39 -11.980  -9.780   3.435
  302   2HD   ARG  39          2HD       ARG  39 -11.449  -9.366   1.792
  303    HE   ARG  39           HE       ARG  39  -9.602 -11.249   2.587
  304   1HH1  ARG  39          1HH1      ARG  39 -12.998 -11.051   2.132
  305   2HH1  ARG  39          2HH1      ARG  39 -13.243 -12.765   2.151
  306   1HH2  ARG  39          1HH2      ARG  39  -9.919 -13.496   2.821
  307   2HH2  ARG  39          2HH2      ARG  39 -11.497 -14.151   2.542
  308    H    ALA  40           H        ALA  40  -8.141  -4.682   4.984
  309    HA   ALA  40           HA       ALA  40  -6.269  -4.532   2.684
  310   1HB   ALA  40          1HB       ALA  40  -7.425  -2.786   4.656
  311   2HB   ALA  40          2HB       ALA  40  -6.490  -2.354   3.225
  312   3HB   ALA  40          3HB       ALA  40  -5.668  -2.676   4.751
  313    H    LYS  41           H        LYS  41  -3.947  -4.538   3.064
  314    HA   LYS  41           HA       LYS  41  -3.129  -6.104   5.493
  315   1HB   LYS  41          1HB       LYS  41  -1.958  -6.057   2.690
  316   2HB   LYS  41          2HB       LYS  41  -1.442  -7.108   4.008
  317   1HG   LYS  41          1HG       LYS  41  -3.240  -8.497   3.770
  318   2HG   LYS  41          2HG       LYS  41  -4.341  -7.172   3.391
  319   1HD   LYS  41          1HD       LYS  41  -3.988  -7.367   1.147
  320   2HD   LYS  41          2HD       LYS  41  -2.262  -7.671   1.351
  321   1HE   LYS  41          1HE       LYS  41  -3.175  -9.726   0.509
  322   2HE   LYS  41          2HE       LYS  41  -2.971  -9.996   2.251
  323   1HZ   LYS  41          1HZ       LYS  41  -5.271 -10.416   1.070
  324   2HZ   LYS  41          2HZ       LYS  41  -5.446  -8.741   1.293
  325   3HZ   LYS  41          3HZ       LYS  41  -5.202  -9.757   2.631
  326    H    ARG  42           H        ARG  42  -0.335  -5.781   5.097
  327    HA   ARG  42           HA       ARG  42   0.048  -3.096   6.151
  328   1HB   ARG  42          1HB       ARG  42   2.039  -5.186   5.208
  329   2HB   ARG  42          2HB       ARG  42   2.388  -3.824   6.274
  330   1HG   ARG  42          1HG       ARG  42   1.566  -4.910   8.083
  331   2HG   ARG  42          2HG       ARG  42   0.126  -5.433   7.206
  332   1HD   ARG  42          1HD       ARG  42   1.023  -7.523   7.168
  333   2HD   ARG  42          2HD       ARG  42   2.289  -6.890   6.100
  334    HE   ARG  42           HE       ARG  42   3.737  -6.923   7.959
  335   1HH1  ARG  42          1HH2      ARG  42   0.798  -8.112   8.995
  336   2HH1  ARG  42          2HH2      ARG  42   0.990  -7.665  10.658
  337   1HH2  ARG  42          1HH1      ARG  42   3.851  -5.785  10.098
  338   2HH2  ARG  42          2HH1      ARG  42   2.718  -6.346  11.282
  339    H    ASN  43           H        ASN  43   0.257  -4.556   2.969
  340    HA   ASN  43           HA       ASN  43   1.907  -2.420   1.823
  341   1HB   ASN  43          1HB       ASN  43   1.471  -4.960   1.152
  342   2HB   ASN  43          2HB       ASN  43   0.159  -4.247   0.212
  343   1HD2  ASN  43          1HD2      ASN  43   3.708  -4.103   0.703
  344   2HD2  ASN  43          2HD2      ASN  43   4.054  -3.460  -0.830
  345    H    ASN  44           H        ASN  44  -0.063  -1.094   3.087
  346    HA   ASN  44           HA       ASN  44  -1.518   0.249   0.917
  347   1HB   ASN  44          1HB       ASN  44  -2.984  -1.647   1.318
  348   2HB   ASN  44          2HB       ASN  44  -2.877  -1.421   3.063
  349   1HD2  ASN  44          1HD2      ASN  44  -5.428  -1.445   1.946
  350   2HD2  ASN  44          2HD2      ASN  44  -6.091   0.130   1.957
  351    H    PHE  45           H        PHE  45   0.097   1.767   2.032
  352    HA   PHE  45           HA       PHE  45  -0.571   2.656   4.750
  353   1HB   PHE  45          1HB       PHE  45   1.322   3.882   2.728
  354   2HB   PHE  45          2HB       PHE  45   1.420   3.966   4.487
  355    HD1  PHE  45           1HD      PHE  45   2.110   1.955   1.515
  356    HD2  PHE  45           2HD      PHE  45   1.995   1.922   5.809
  357    HE1  PHE  45           1HE      PHE  45   3.449  -0.135   1.536
  358    HE2  PHE  45           2HE      PHE  45   3.334  -0.164   5.830
  359    HZ   PHE  45           HZ       PHE  45   4.059  -1.198   3.695
  360    H    LYS  46           H        LYS  46  -1.571   4.609   5.278
  361    HA   LYS  46           HA       LYS  46  -3.421   5.762   3.390
  362   1HB   LYS  46          1HB       LYS  46  -2.418   6.906   6.013
  363   2HB   LYS  46          2HB       LYS  46  -3.996   7.164   5.268
  364   1HG   LYS  46          1HG       LYS  46  -4.808   5.297   6.236
  365   2HG   LYS  46          2HG       LYS  46  -3.485   4.331   5.579
  366   1HD   LYS  46          1HD       LYS  46  -3.308   4.159   7.961
  367   2HD   LYS  46          2HD       LYS  46  -2.043   5.283   7.463
  368   1HE   LYS  46          1HE       LYS  46  -3.176   7.137   8.334
  369   2HE   LYS  46          2HE       LYS  46  -4.762   6.353   8.197
  370   1HZ   LYS  46          1HZ       LYS  46  -3.920   6.385  10.502
  371   2HZ   LYS  46          2HZ       LYS  46  -2.562   5.490  10.012
  372   3HZ   LYS  46          3HZ       LYS  46  -4.113   4.804   9.920
  373    H    SER  47           H        SER  47  -0.136   6.508   4.327
  374    HA   SER  47           HA       SER  47  -0.168   8.821   2.424
  375   1HB   SER  47          1HB       SER  47   1.132  10.093   4.061
  376   2HB   SER  47          2HB       SER  47  -0.359   9.532   4.806
  377    HG   SER  47           HG       SER  47   0.762   8.417   6.158
  378    H    ALA  48           H        ALA  48   1.950   9.274   1.498
  379    HA   ALA  48           HA       ALA  48   3.492   6.944   0.826
  380   1HB   ALA  48          1HB       ALA  48   4.500   8.419  -0.627
  381   2HB   ALA  48          2HB       ALA  48   4.687   9.664   0.609
  382   3HB   ALA  48          3HB       ALA  48   3.127   9.432  -0.180
  383    H    GLU  49           H        GLU  49   3.686   9.237   3.445
  384    HA   GLU  49           HA       GLU  49   6.468   8.735   4.147
  385   1HB   GLU  49          1HB       GLU  49   4.096   9.874   5.667
  386   2HB   GLU  49          2HB       GLU  49   5.773   9.966   6.209
  387   1HG   GLU  49          1HG       GLU  49   6.300  11.595   4.698
  388   2HG   GLU  49          2HG       GLU  49   5.281  10.896   3.439
  389    H    ASP  50           H        ASP  50   3.366   7.269   4.887
  390    HA   ASP  50           HA       ASP  50   4.259   5.732   7.187
  391   1HB   ASP  50          1HB       ASP  50   1.920   6.193   6.894
  392   2HB   ASP  50          2HB       ASP  50   1.942   5.584   5.239
  393    H    CYS  51           H        CYS  51   4.060   5.221   3.696
  394    HA   CYS  51           HA       CYS  51   4.788   2.411   3.741
  395   1HB   CYS  51          1HB       CYS  51   3.604   3.431   1.874
  396   2HB   CYS  51          2HB       CYS  51   4.897   4.610   1.647
  397    H    MET  52           H        MET  52   6.564   5.461   3.195
  398    HA   MET  52           HA       MET  52   9.154   4.250   2.798
  399   1HB   MET  52          1HB       MET  52   7.953   6.925   3.288
  400   2HB   MET  52          2HB       MET  52   9.657   6.762   3.714
  401   1HG   MET  52          1HG       MET  52   8.672   5.730   1.067
  402   2HG   MET  52          2HG       MET  52   9.000   7.453   1.268
  403   1HE   MET  52          1HE       MET  52  10.842   5.143  -0.729
  404   2HE   MET  52          2HE       MET  52   9.952   4.220   0.478
  405   3HE   MET  52          3HE       MET  52  11.708   4.102   0.409
  406    H    ARG  53           H        ARG  53   7.727   5.934   5.626
  407    HA   ARG  53           HA       ARG  53   9.789   5.475   7.492
  408   1HB   ARG  53          1HB       ARG  53   7.992   6.918   8.063
  409   2HB   ARG  53          2HB       ARG  53   6.780   5.711   7.638
  410   1HG   ARG  53          1HG       ARG  53   8.636   4.816   9.732
  411   2HG   ARG  53          2HG       ARG  53   7.681   6.225  10.197
  412   1HD   ARG  53          1HD       ARG  53   6.134   4.128   8.800
  413   2HD   ARG  53          2HD       ARG  53   6.778   3.639  10.380
  414    HE   ARG  53           HE       ARG  53   5.689   6.303  10.533
  415   1HH1  ARG  53          1HH2      ARG  53   3.900   4.029   9.085
  416   2HH1  ARG  53          2HH2      ARG  53   2.772   3.761  10.371
  417   1HH2  ARG  53          1HH1      ARG  53   4.631   5.513  12.720
  418   2HH2  ARG  53          2HH1      ARG  53   3.186   4.602  12.432
  419    H    THR  54           H        THR  54   7.498   3.260   6.092
  420    HA   THR  54           HA       THR  54   8.064   1.158   8.122
  421    HB   THR  54           HB       THR  54   6.137   1.535   5.819
  422    HG1  THR  54           1HG      THR  54   4.809   0.806   7.780
  423   1HG2  THR  54          1HG2      THR  54   6.639  -1.008   7.385
  424   2HG2  THR  54          2HG2      THR  54   6.959  -0.766   5.667
  425   3HG2  THR  54          3HG2      THR  54   5.301  -0.747   6.267
  426    H    CYS  55           H        CYS  55   8.483   1.852   4.657
  427    HA   CYS  55           HA       CYS  55  10.518  -0.346   4.546
  428   1HB   CYS  55          1HB       CYS  55   8.077  -0.570   3.510
  429   2HB   CYS  55          2HB       CYS  55   8.807   0.351   2.194
  430    H    GLY  56           H        GLY  56  11.249   2.354   4.984
  431   1HA   GLY  56          1HA       GLY  56  12.155   3.267   2.288
  432   2HA   GLY  56          2HA       GLY  56  12.029   4.311   3.707
  433    H    GLY  57           H        GLY  57  14.411   4.012   2.124
  434   1HA   GLY  57          1HA       GLY  57  16.690   4.091   2.944
  435   2HA   GLY  57          2HA       GLY  57  16.229   2.989   4.244
  436    H    ALA  58           H        ALA  58  17.697   3.199   1.198
  437    HA   ALA  58           HA       ALA  58  17.893   0.235   1.059
  438   1HB   ALA  58          1HB       ALA  58  16.384   2.035  -0.736
  439   2HB   ALA  58          2HB       ALA  58  16.192   0.303  -0.464
  440   3HB   ALA  58          3HB       ALA  58  17.436   0.890  -1.567
  Start of MODEL   21
    1   1H    ARG   1          1H        ARG   1  15.245  -5.047   4.493
    2   2H    ARG   1          2H        ARG   1  14.994  -4.173   5.928
    3   3H    ARG   1          3H        ARG   1  15.615  -3.393   4.552
    4    HA   ARG   1           HA       ARG   1  13.216  -2.920   4.950
    5   1HB   ARG   1          1HB       ARG   1  14.690  -3.774   2.613
    6   2HB   ARG   1          2HB       ARG   1  12.982  -4.171   2.420
    7   1HG   ARG   1          1HG       ARG   1  12.653  -1.708   3.355
    8   2HG   ARG   1          2HG       ARG   1  14.288  -1.494   2.728
    9   1HD   ARG   1          1HD       ARG   1  12.318  -2.862   0.937
   10   2HD   ARG   1          2HD       ARG   1  12.137  -1.111   1.166
   11    HE   ARG   1           HE       ARG   1  14.020  -0.961  -0.260
   12   1HH1  ARG   1          1HH1      ARG   1  13.921  -4.189   0.247
   13   2HH1  ARG   1          2HH1      ARG   1  15.628  -4.441   0.393
   14   1HH2  ARG   1          1HH2      ARG   1  16.375  -1.061   0.604
   15   2HH2  ARG   1          2HH2      ARG   1  17.018  -2.669   0.599
   16    HA   PRO   2           HA       PRO   2  10.808  -6.456   6.053
   17   1HB   PRO   2          1HB       PRO   2   8.325  -5.370   5.639
   18   2HB   PRO   2          2HB       PRO   2   9.324  -4.999   7.054
   19   1HG   PRO   2          1HG       PRO   2   8.912  -3.448   4.539
   20   2HG   PRO   2          2HG       PRO   2   9.027  -2.863   6.204
   21   1HD   PRO   2          1HD       PRO   2  11.076  -2.725   4.406
   22   2HD   PRO   2          2HD       PRO   2  11.329  -2.867   6.161
   23    H    ASP   3           H        ASP   3   9.898  -8.173   4.908
   24    HA   ASP   3           HA       ASP   3   9.975  -8.058   2.004
   25   1HB   ASP   3          1HB       ASP   3  10.281  -9.961   3.931
   26   2HB   ASP   3          2HB       ASP   3   8.635 -10.302   3.399
   27    H    PHE   4           H        PHE   4   7.490  -7.600   4.441
   28    HA   PHE   4           HA       PHE   4   5.242  -8.283   2.770
   29   1HB   PHE   4          1HB       PHE   4   3.935  -7.264   4.510
   30   2HB   PHE   4          2HB       PHE   4   5.297  -8.072   5.275
   31    HD1  PHE   4           1HD      PHE   4   6.588  -6.911   6.820
   32    HD2  PHE   4           2HD      PHE   4   4.273  -4.712   3.950
   33    HE1  PHE   4           1HE      PHE   4   7.113  -4.792   7.997
   34    HE2  PHE   4           2HE      PHE   4   4.779  -2.645   5.105
   35    HZ   PHE   4           HZ       PHE   4   6.211  -2.649   7.140
   36    H    CYS   5           H        CYS   5   7.385  -5.600   2.734
   37    HA   CYS   5           HA       CYS   5   5.489  -3.751   1.435
   38   1HB   CYS   5          1HB       CYS   5   8.443  -3.780   2.086
   39   2HB   CYS   5          2HB       CYS   5   7.721  -2.479   1.138
   40    H    LEU   6           H        LEU   6   7.730  -6.249   0.534
   41    HA   LEU   6           HA       LEU   6   8.240  -5.373  -2.186
   42   1HB   LEU   6          1HB       LEU   6   8.344  -8.169  -1.016
   43   2HB   LEU   6          2HB       LEU   6   9.290  -7.539  -2.363
   44    HG   LEU   6           HG       LEU   6   9.500  -6.769   0.558
   45   1HD1  LEU   6          1HD1      LEU   6  11.469  -7.921  -1.441
   46   2HD1  LEU   6          2HD1      LEU   6  10.712  -8.797  -0.110
   47   3HD1  LEU   6          3HD1      LEU   6  11.848  -7.491   0.226
   48   1HD2  LEU   6          1HD2      LEU   6  10.375  -5.363  -1.937
   49   2HD2  LEU   6          2HD2      LEU   6  11.463  -5.344  -0.551
   50   3HD2  LEU   6          3HD2      LEU   6   9.835  -4.684  -0.401
   51    H    GLU   7           H        GLU   7   5.658  -7.094  -0.600
   52    HA   GLU   7           HA       GLU   7   4.591  -8.453  -2.921
   53   1HB   GLU   7          1HB       GLU   7   3.839  -7.810  -0.125
   54   2HB   GLU   7          2HB       GLU   7   2.491  -8.124  -1.218
   55   1HG   GLU   7          1HG       GLU   7   2.930 -10.305  -0.666
   56   2HG   GLU   7          2HG       GLU   7   4.156 -10.145  -1.926
   57    HA   PRO   8           HA       PRO   8   2.477  -5.165  -4.924
   58   1HB   PRO   8          1HB       PRO   8   0.228  -6.448  -5.825
   59   2HB   PRO   8          2HB       PRO   8   1.835  -6.693  -6.538
   60   1HG   PRO   8          1HG       PRO   8   0.325  -8.381  -4.595
   61   2HG   PRO   8          2HG       PRO   8   1.339  -8.870  -5.962
   62   1HD   PRO   8          1HD       PRO   8   2.157  -8.922  -3.348
   63   2HD   PRO   8          2HD       PRO   8   3.264  -8.738  -4.726
   64    HA   PRO   9           HA       PRO   9  -0.605  -3.492  -2.279
   65   1HB   PRO   9          1HB       PRO   9  -2.304  -2.220  -4.015
   66   2HB   PRO   9          2HB       PRO   9  -0.684  -1.612  -3.620
   67   1HG   PRO   9          1HG       PRO   9  -1.633  -3.123  -6.009
   68   2HG   PRO   9          2HG       PRO   9  -0.462  -1.799  -5.904
   69   1HD   PRO   9          1HD       PRO   9   0.216  -4.447  -6.161
   70   2HD   PRO   9          2HD       PRO   9   1.267  -3.222  -5.419
   71    H    TYR  10           H        TYR  10  -3.168  -3.355  -2.070
   72    HA   TYR  10           HA       TYR  10  -4.449  -5.817  -3.207
   73   1HB   TYR  10          1HB       TYR  10  -3.311  -6.008  -0.872
   74   2HB   TYR  10          2HB       TYR  10  -4.656  -5.021  -0.305
   75    HD1  TYR  10           1HD      TYR  10  -6.404  -6.238   0.625
   76    HD2  TYR  10           2HD      TYR  10  -4.209  -7.919  -2.661
   77    HE1  TYR  10           1HE      TYR  10  -7.849  -8.252   0.693
   78    HE2  TYR  10           2HE      TYR  10  -5.652  -9.933  -2.596
   79    HH   TYR  10           HH       TYR  10  -7.082 -11.111  -0.775
   80    H    THR  11           H        THR  11  -5.812  -4.491  -4.490
   81    HA   THR  11           HA       THR  11  -7.275  -2.219  -3.581
   82    HB   THR  11           HB       THR  11  -7.551  -4.307  -5.738
   83    HG1  THR  11           1HG      THR  11  -6.148  -2.654  -6.147
   84   1HG2  THR  11          1HG2      THR  11  -9.472  -2.772  -6.587
   85   2HG2  THR  11          2HG2      THR  11  -9.614  -2.280  -4.900
   86   3HG2  THR  11          3HG2      THR  11  -9.846  -3.970  -5.349
   87    H    GLY  12           H        GLY  12  -7.606  -5.629  -3.034
   88   1HA   GLY  12          1HA       GLY  12  -9.099  -6.834  -1.674
   89   2HA   GLY  12          2HA       GLY  12  -9.550  -5.289  -0.950
   90    HA   PRO  13           HA       PRO  13 -12.700  -6.913  -4.172
   91   1HB   PRO  13          1HB       PRO  13 -14.171  -8.709  -2.717
   92   2HB   PRO  13          2HB       PRO  13 -12.785  -9.179  -3.723
   93   1HG   PRO  13          1HG       PRO  13 -12.962  -8.781  -0.774
   94   2HG   PRO  13          2HG       PRO  13 -12.068 -10.000  -1.694
   95   1HD   PRO  13          1HD       PRO  13 -10.937  -7.757  -0.587
   96   2HD   PRO  13          2HD       PRO  13 -10.270  -8.614  -1.993
   97    H    CYS  14           H        CYS  14 -12.896  -4.565  -3.071
   98    HA   CYS  14           HA       CYS  14 -15.396  -4.530  -1.412
   99   1HB   CYS  14          1HB       CYS  14 -12.889  -2.863  -1.506
  100   2HB   CYS  14          2HB       CYS  14 -14.376  -2.178  -0.851
  101    H    LYS  15           H        LYS  15 -16.662  -2.404  -1.805
  102    HA   LYS  15           HA       LYS  15 -16.915  -2.026  -4.741
  103   1HB   LYS  15          1HB       LYS  15 -18.687  -2.411  -2.668
  104   2HB   LYS  15          2HB       LYS  15 -18.774  -0.664  -2.901
  105   1HG   LYS  15          1HG       LYS  15 -19.013  -1.188  -5.411
  106   2HG   LYS  15          2HG       LYS  15 -19.318  -2.854  -4.914
  107   1HD   LYS  15          1HD       LYS  15 -20.926  -1.226  -3.250
  108   2HD   LYS  15          2HD       LYS  15 -21.119  -0.597  -4.887
  109   1HE   LYS  15          1HE       LYS  15 -22.767  -2.393  -4.453
  110   2HE   LYS  15          2HE       LYS  15 -21.600  -2.926  -5.680
  111   1HZ   LYS  15          1HZ       LYS  15 -22.064  -4.431  -3.636
  112   2HZ   LYS  15          2HZ       LYS  15 -21.054  -3.342  -2.809
  113   3HZ   LYS  15          3HZ       LYS  15 -20.462  -4.209  -4.146
  114    H    ALA  16           H        ALA  16 -15.117  -0.608  -2.390
  115    HA   ALA  16           HA       ALA  16 -15.584   2.188  -3.353
  116   1HB   ALA  16          1HB       ALA  16 -15.659   2.235  -1.035
  117   2HB   ALA  16          2HB       ALA  16 -13.925   2.463  -1.269
  118   3HB   ALA  16          3HB       ALA  16 -14.558   0.865  -0.873
  119    H    ARG  17           H        ARG  17 -13.364   3.465  -3.372
  120    HA   ARG  17           HA       ARG  17 -11.056   1.820  -4.211
  121   1HB   ARG  17          1HB       ARG  17 -11.023   3.084  -6.426
  122   2HB   ARG  17          2HB       ARG  17 -12.318   1.900  -6.252
  123   1HG   ARG  17          1HG       ARG  17 -13.855   3.723  -5.550
  124   2HG   ARG  17          2HG       ARG  17 -12.554   4.891  -5.792
  125   1HD   ARG  17          1HD       ARG  17 -14.127   4.705  -7.766
  126   2HD   ARG  17          2HD       ARG  17 -12.444   4.318  -8.177
  127    HE   ARG  17           HE       ARG  17 -13.890   1.971  -7.269
  128   1HH1  ARG  17          1HH1      ARG  17 -11.903   2.271  -9.603
  129   2HH1  ARG  17          2HH1      ARG  17 -12.932   1.892 -10.945
  130   1HH2  ARG  17          1HH2      ARG  17 -15.869   2.264  -9.144
  131   2HH2  ARG  17          2HH2      ARG  17 -15.175   1.889 -10.686
  132    H    ILE  18           H        ILE  18 -10.500   3.125  -2.134
  133    HA   ILE  18           HA       ILE  18 -10.030   6.000  -2.480
  134    HB   ILE  18           HB       ILE  18  -9.238   3.973  -0.362
  135   1HG1  ILE  18          1HG1      ILE  18 -11.318   6.109  -0.035
  136   2HG1  ILE  18          2HG1      ILE  18 -11.740   4.646  -0.926
  137   1HG2  ILE  18          1HG2      ILE  18  -9.025   6.988  -0.476
  138   2HG2  ILE  18          2HG2      ILE  18  -7.739   5.824  -0.150
  139   3HG2  ILE  18          3HG2      ILE  18  -9.008   6.095   1.045
  140   1HD1  ILE  18          1HD1      ILE  18 -11.856   3.434   0.977
  141   2HD1  ILE  18          2HD1      ILE  18 -11.755   4.959   1.855
  142   3HD1  ILE  18          3HD1      ILE  18 -10.291   4.032   1.528
  143    H    ILE  19           H        ILE  19  -7.839   6.943  -2.411
  144    HA   ILE  19           HA       ILE  19  -5.880   5.281  -3.894
  145    HB   ILE  19           HB       ILE  19  -6.367   8.199  -3.353
  146   1HG1  ILE  19          1HG1      ILE  19  -7.341   6.891  -5.312
  147   2HG1  ILE  19          2HG1      ILE  19  -6.416   8.328  -5.751
  148   1HG2  ILE  19          1HG2      ILE  19  -4.156   8.486  -4.740
  149   2HG2  ILE  19          2HG2      ILE  19  -3.753   6.899  -4.085
  150   3HG2  ILE  19          3HG2      ILE  19  -4.052   8.252  -2.994
  151   1HD1  ILE  19          1HD1      ILE  19  -4.474   6.985  -6.293
  152   2HD1  ILE  19          2HD1      ILE  19  -5.860   6.282  -7.126
  153   3HD1  ILE  19          3HD1      ILE  19  -5.243   5.532  -5.655
  154    H    ARG  20           H        ARG  20  -5.143   3.949  -2.110
  155    HA   ARG  20           HA       ARG  20  -3.876   5.311   0.206
  156   1HB   ARG  20          1HB       ARG  20  -4.525   2.477  -0.600
  157   2HB   ARG  20          2HB       ARG  20  -3.476   2.806   0.778
  158   1HG   ARG  20          1HG       ARG  20  -6.236   4.011   0.450
  159   2HG   ARG  20          2HG       ARG  20  -5.919   2.537   1.365
  160   1HD   ARG  20          1HD       ARG  20  -4.879   3.681   3.086
  161   2HD   ARG  20          2HD       ARG  20  -4.237   4.930   2.001
  162    HE   ARG  20           HE       ARG  20  -6.727   5.650   1.804
  163   1HH1  ARG  20          1HH1      ARG  20  -4.938   4.979   4.599
  164   2HH1  ARG  20          2HH1      ARG  20  -6.255   5.226   5.697
  165   1HH2  ARG  20          1HH2      ARG  20  -8.625   5.592   3.191
  166   2HH2  ARG  20          2HH2      ARG  20  -8.343   5.568   4.900
  167    H    TYR  21           H        TYR  21  -1.663   3.955   0.791
  168    HA   TYR  21           HA       TYR  21   0.040   4.149  -1.673
  169   1HB   TYR  21          1HB       TYR  21   0.466   4.908   1.219
  170   2HB   TYR  21          2HB       TYR  21   1.814   4.747   0.095
  171    HD1  TYR  21           1HD      TYR  21   2.142   6.319  -1.718
  172    HD2  TYR  21           2HD      TYR  21  -1.242   6.641   0.904
  173    HE1  TYR  21           1HE      TYR  21   1.684   8.594  -2.593
  174    HE2  TYR  21           2HE      TYR  21  -1.703   8.920   0.030
  175    HH   TYR  21           HH       TYR  21   0.000  10.198  -2.741
  176    H    PHE  22           H        PHE  22   1.571   2.554  -2.011
  177    HA   PHE  22           HA       PHE  22   1.910   0.404   0.026
  178   1HB   PHE  22          1HB       PHE  22   1.223  -1.286  -1.485
  179   2HB   PHE  22          2HB       PHE  22   0.052  -0.005  -1.756
  180    HD1  PHE  22           1HD      PHE  22   0.283   1.509  -3.739
  181    HD2  PHE  22           2HD      PHE  22   2.787  -1.935  -3.178
  182    HE1  PHE  22           1HE      PHE  22   0.951   1.606  -6.125
  183    HE2  PHE  22           2HE      PHE  22   3.456  -1.839  -5.564
  184    HZ   PHE  22           HZ       PHE  22   2.538  -0.069  -7.038
  185    H    TYR  23           H        TYR  23   3.841  -1.003  -0.640
  186    HA   TYR  23           HA       TYR  23   5.938   0.773  -1.801
  187   1HB   TYR  23          1HB       TYR  23   6.201  -0.361   0.408
  188   2HB   TYR  23          2HB       TYR  23   6.143  -1.921  -0.416
  189    HD1  TYR  23           1HD      TYR  23   8.084  -2.801  -1.481
  190    HD2  TYR  23           2HD      TYR  23   7.993   1.319  -0.272
  191    HE1  TYR  23           1HE      TYR  23  10.486  -2.585  -2.046
  192    HE2  TYR  23           2HE      TYR  23  10.400   1.532  -0.841
  193    HH   TYR  23           HH       TYR  23  12.362   0.092  -1.091
  194    H    ASN  24           H        ASN  24   6.151   0.569  -3.996
  195    HA   ASN  24           HA       ASN  24   5.556  -1.963  -5.378
  196   1HB   ASN  24          1HB       ASN  24   4.969   0.244  -6.315
  197   2HB   ASN  24          2HB       ASN  24   6.666   0.717  -6.284
  198   1HD2  ASN  24          1HD2      ASN  24   4.611   0.136  -8.579
  199   2HD2  ASN  24          2HD2      ASN  24   5.478  -0.893  -9.616
  200    H    ALA  25           H        ALA  25   7.231  -3.389  -4.550
  201    HA   ALA  25           HA       ALA  25   9.951  -2.893  -4.229
  202   1HB   ALA  25          1HB       ALA  25   8.195  -5.168  -4.829
  203   2HB   ALA  25          2HB       ALA  25   9.546  -5.066  -3.700
  204   3HB   ALA  25          3HB       ALA  25   9.844  -5.405  -5.405
  205    H    LYS  26           H        LYS  26   8.123  -3.035  -7.197
  206    HA   LYS  26           HA       LYS  26  10.441  -3.329  -8.958
  207   1HB   LYS  26          1HB       LYS  26   7.797  -3.798  -9.184
  208   2HB   LYS  26          2HB       LYS  26   7.844  -2.173  -9.866
  209   1HG   LYS  26          1HG       LYS  26   8.237  -3.497 -11.754
  210   2HG   LYS  26          2HG       LYS  26   9.879  -3.109 -11.237
  211   1HD   LYS  26          1HD       LYS  26   8.998  -5.425  -9.797
  212   2HD   LYS  26          2HD       LYS  26   8.688  -5.686 -11.514
  213   1HE   LYS  26          1HE       LYS  26  11.344  -4.823 -10.306
  214   2HE   LYS  26          2HE       LYS  26  10.971  -6.429 -10.963
  215   1HZ   LYS  26          1HZ       LYS  26  11.844  -5.355 -12.799
  216   2HZ   LYS  26          2HZ       LYS  26  11.216  -3.840 -12.357
  217   3HZ   LYS  26          3HZ       LYS  26  10.191  -5.034 -12.999
  218    H    ALA  27           H        ALA  27   8.749  -0.709  -7.386
  219    HA   ALA  27           HA       ALA  27   9.956   1.340  -9.164
  220   1HB   ALA  27          1HB       ALA  27   8.470   2.827  -7.989
  221   2HB   ALA  27          2HB       ALA  27   8.254   1.667  -6.679
  222   3HB   ALA  27          3HB       ALA  27   7.568   1.337  -8.270
  223    H    GLY  28           H        GLY  28  10.347  -0.034  -5.944
  224   1HA   GLY  28          1HA       GLY  28  12.384   0.108  -4.675
  225   2HA   GLY  28          2HA       GLY  28  12.868   1.492  -5.656
  226    H    LEU  29           H        LEU  29   9.706   2.027  -4.898
  227    HA   LEU  29           HA       LEU  29  10.154   3.110  -2.198
  228   1HB   LEU  29          1HB       LEU  29   9.892   5.367  -2.830
  229   2HB   LEU  29          2HB       LEU  29  10.969   4.707  -4.057
  230    HG   LEU  29           HG       LEU  29   8.008   5.284  -4.304
  231   1HD1  LEU  29          1HD1      LEU  29  10.440   6.132  -5.895
  232   2HD1  LEU  29          2HD1      LEU  29   9.609   7.123  -4.698
  233   3HD1  LEU  29          3HD1      LEU  29   8.782   6.659  -6.185
  234   1HD2  LEU  29          1HD2      LEU  29   8.319   4.341  -6.652
  235   2HD2  LEU  29          2HD2      LEU  29   8.286   3.141  -5.360
  236   3HD2  LEU  29          3HD2      LEU  29   9.824   3.627  -6.075
  237    H    CYS  30           H        CYS  30   7.834   4.867  -2.484
  238    HA   CYS  30           HA       CYS  30   5.707   2.766  -2.526
  239   1HB   CYS  30          1HB       CYS  30   6.029   5.407  -1.081
  240   2HB   CYS  30          2HB       CYS  30   4.545   4.455  -1.032
  241    H    GLN  31           H        GLN  31   3.678   3.280  -3.447
  242    HA   GLN  31           HA       GLN  31   3.460   5.750  -5.096
  243   1HB   GLN  31          1HB       GLN  31   3.598   2.884  -5.977
  244   2HB   GLN  31          2HB       GLN  31   2.542   3.979  -6.869
  245   1HG   GLN  31          1HG       GLN  31   4.351   5.400  -7.468
  246   2HG   GLN  31          2HG       GLN  31   5.417   4.686  -6.257
  247   1HE2  GLN  31          1HE2      GLN  31   6.889   4.344  -8.222
  248   2HE2  GLN  31          2HE2      GLN  31   6.642   2.957  -9.168
  249    H    THR  32           H        THR  32   1.069   5.743  -6.038
  250    HA   THR  32           HA       THR  32  -0.704   4.987  -3.774
  251    HB   THR  32           HB       THR  32  -2.271   6.426  -5.376
  252    HG1  THR  32           1HG      THR  32  -1.227   7.128  -7.032
  253   1HG2  THR  32          1HG2      THR  32  -0.115   8.074  -4.176
  254   2HG2  THR  32          2HG2      THR  32  -0.908   6.927  -3.095
  255   3HG2  THR  32          3HG2      THR  32  -1.861   8.151  -3.936
  256    H    PHE  33           H        PHE  33  -2.461   3.611  -4.029
  257    HA   PHE  33           HA       PHE  33  -2.926   2.414  -6.722
  258   1HB   PHE  33          1HB       PHE  33  -2.614   0.221  -5.911
  259   2HB   PHE  33          2HB       PHE  33  -1.311   1.125  -5.155
  260    HD1  PHE  33           1HD      PHE  33  -4.510  -0.590  -4.618
  261    HD2  PHE  33           2HD      PHE  33  -1.363   1.662  -2.743
  262    HE1  PHE  33           1HE      PHE  33  -5.329  -1.294  -2.386
  263    HE2  PHE  33           2HE      PHE  33  -2.190   0.971  -0.520
  264    HZ   PHE  33           HZ       PHE  33  -4.172  -0.514  -0.335
  265    H    VAL  34           H        VAL  34  -5.043   1.270  -6.795
  266    HA   VAL  34           HA       VAL  34  -7.102   2.847  -5.478
  267    HB   VAL  34           HB       VAL  34  -7.082   0.416  -7.284
  268   1HG1  VAL  34          1HG1      VAL  34  -9.568   1.234  -7.593
  269   2HG1  VAL  34          2HG1      VAL  34  -9.346   1.895  -5.972
  270   3HG1  VAL  34          3HG1      VAL  34  -9.162   0.163  -6.251
  271   1HG2  VAL  34          1HG2      VAL  34  -6.939   3.304  -7.630
  272   2HG2  VAL  34          2HG2      VAL  34  -8.311   2.617  -8.500
  273   3HG2  VAL  34          3HG2      VAL  34  -6.679   2.026  -8.817
  274    H    TYR  35           H        TYR  35  -7.158   2.460  -3.253
  275    HA   TYR  35           HA       TYR  35  -7.114  -0.265  -2.163
  276   1HB   TYR  35          1HB       TYR  35  -6.117   1.575  -0.944
  277   2HB   TYR  35          2HB       TYR  35  -7.609   2.510  -1.037
  278    HD1  TYR  35           1HD      TYR  35  -7.390  -1.137  -0.388
  279    HD2  TYR  35           2HD      TYR  35  -8.056   2.753   1.308
  280    HE1  TYR  35           1HE      TYR  35  -8.178  -2.187   1.714
  281    HE2  TYR  35           2HE      TYR  35  -8.843   1.702   3.411
  282    HH   TYR  35           HH       TYR  35  -8.582  -0.443   4.603
  283    H    GLY  36           H        GLY  36  -8.959  -1.379  -1.367
  284   1HA   GLY  36          1HA       GLY  36 -11.537  -0.487  -2.476
  285   2HA   GLY  36          2HA       GLY  36 -11.221  -2.044  -1.714
  286    H    ALA  37           H        ALA  37  -9.950   0.315   0.265
  287    HA   ALA  37           HA       ALA  37 -10.768   1.491   2.165
  288   1HB   ALA  37          1HB       ALA  37 -12.799   1.696   0.475
  289   2HB   ALA  37          2HB       ALA  37 -13.001   2.118   2.174
  290   3HB   ALA  37          3HB       ALA  37 -13.552   0.550   1.584
  291    H    CYS  38           H        CYS  38 -11.699  -1.827   1.470
  292    HA   CYS  38           HA       CYS  38 -11.493  -2.418   4.388
  293   1HB   CYS  38          1HB       CYS  38 -13.353  -4.236   3.544
  294   2HB   CYS  38          2HB       CYS  38 -13.762  -2.699   4.293
  295    H    ARG  39           H        ARG  39 -11.140  -4.858   4.714
  296    HA   ARG  39           HA       ARG  39  -9.804  -6.763   4.264
  297   1HB   ARG  39          1HB       ARG  39 -11.241  -5.996   1.774
  298   2HB   ARG  39          2HB       ARG  39  -9.910  -7.134   1.576
  299   1HG   ARG  39          1HG       ARG  39 -11.647  -7.746   3.868
  300   2HG   ARG  39          2HG       ARG  39 -12.482  -7.814   2.314
  301   1HD   ARG  39          1HD       ARG  39 -11.544  -9.857   1.991
  302   2HD   ARG  39          2HD       ARG  39  -9.958  -9.063   1.926
  303    HE   ARG  39           HE       ARG  39  -9.872  -9.320   4.420
  304   1HH1  ARG  39          1HH1      ARG  39 -12.964 -10.141   4.002
  305   2HH1  ARG  39          2HH1      ARG  39 -12.866 -11.763   4.602
  306   1HH2  ARG  39          1HH2      ARG  39  -9.398 -11.834   4.600
  307   2HH2  ARG  39          2HH2      ARG  39 -10.847 -12.723   4.937
  308    H    ALA  40           H        ALA  40  -8.399  -4.303   4.505
  309    HA   ALA  40           HA       ALA  40  -6.517  -4.050   2.256
  310   1HB   ALA  40          1HB       ALA  40  -6.653  -2.810   5.022
  311   2HB   ALA  40          2HB       ALA  40  -7.342  -2.127   3.553
  312   3HB   ALA  40          3HB       ALA  40  -5.594  -2.271   3.719
  313    H    LYS  41           H        LYS  41  -4.149  -4.170   2.671
  314    HA   LYS  41           HA       LYS  41  -3.454  -6.354   4.610
  315   1HB   LYS  41          1HB       LYS  41  -2.095  -5.558   2.013
  316   2HB   LYS  41          2HB       LYS  41  -1.772  -7.002   2.972
  317   1HG   LYS  41          1HG       LYS  41  -4.265  -7.570   2.608
  318   2HG   LYS  41          2HG       LYS  41  -4.229  -6.337   1.346
  319   1HD   LYS  41          1HD       LYS  41  -3.137  -7.713  -0.073
  320   2HD   LYS  41          2HD       LYS  41  -1.947  -8.140   1.155
  321   1HE   LYS  41          1HE       LYS  41  -3.571  -9.767   2.127
  322   2HE   LYS  41          2HE       LYS  41  -4.716  -9.362   0.833
  323   1HZ   LYS  41          1HZ       LYS  41  -2.828  -9.863  -0.738
  324   2HZ   LYS  41          2HZ       LYS  41  -3.470 -11.212   0.072
  325   3HZ   LYS  41          3HZ       LYS  41  -1.997 -10.532   0.580
  326    H    ARG  42           H        ARG  42  -0.685  -6.044   4.571
  327    HA   ARG  42           HA       ARG  42  -0.353  -3.638   6.186
  328   1HB   ARG  42          1HB       ARG  42   1.618  -4.664   6.807
  329   2HB   ARG  42          2HB       ARG  42   0.774  -6.065   6.223
  330   1HG   ARG  42          1HG       ARG  42   2.640  -4.410   4.577
  331   2HG   ARG  42          2HG       ARG  42   3.084  -5.888   5.427
  332   1HD   ARG  42          1HD       ARG  42   0.810  -5.883   3.475
  333   2HD   ARG  42          2HD       ARG  42   2.486  -6.101   2.947
  334    HE   ARG  42           HE       ARG  42   2.279  -7.837   5.074
  335   1HH1  ARG  42          1HH1      ARG  42  -0.613  -8.090   4.769
  336   2HH1  ARG  42          2HH1      ARG  42  -0.788  -9.338   3.581
  337   1HH2  ARG  42          1HH2      ARG  42   2.487  -9.096   2.462
  338   2HH2  ARG  42          2HH2      ARG  42   0.969  -9.912   2.277
  339    H    ASN  43           H        ASN  43   0.061  -4.452   2.874
  340    HA   ASN  43           HA       ASN  43   1.894  -2.196   2.318
  341   1HB   ASN  43          1HB       ASN  43   1.650  -4.678   1.281
  342   2HB   ASN  43          2HB       ASN  43   0.600  -3.802   0.167
  343   1HD2  ASN  43          1HD2      ASN  43   3.534  -4.940   0.008
  344   2HD2  ASN  43          2HD2      ASN  43   4.397  -3.648  -0.675
  345    H    ASN  44           H        ASN  44  -0.338  -1.177   3.379
  346    HA   ASN  44           HA       ASN  44  -1.635   0.248   1.114
  347   1HB   ASN  44          1HB       ASN  44  -3.098  -1.649   1.521
  348   2HB   ASN  44          2HB       ASN  44  -2.991  -1.424   3.265
  349   1HD2  ASN  44          1HD2      ASN  44  -5.524  -1.470   2.019
  350   2HD2  ASN  44          2HD2      ASN  44  -6.214   0.091   2.078
  351    H    PHE  45           H        PHE  45   0.026   1.709   2.294
  352    HA   PHE  45           HA       PHE  45  -0.723   2.646   4.970
  353   1HB   PHE  45          1HB       PHE  45   1.305   3.766   3.016
  354   2HB   PHE  45          2HB       PHE  45   1.329   3.885   4.775
  355    HD1  PHE  45           1HD      PHE  45   2.044   1.767   1.872
  356    HD2  PHE  45           2HD      PHE  45   1.800   1.849   6.162
  357    HE1  PHE  45           1HE      PHE  45   3.294  -0.374   1.983
  358    HE2  PHE  45           2HE      PHE  45   3.052  -0.293   6.272
  359    HZ   PHE  45           HZ       PHE  45   3.799  -1.423   4.180
  360    H    LYS  46           H        LYS  46  -1.742   4.589   5.439
  361    HA   LYS  46           HA       LYS  46  -3.483   5.779   3.498
  362   1HB   LYS  46          1HB       LYS  46  -3.845   5.681   5.948
  363   2HB   LYS  46          2HB       LYS  46  -2.494   6.790   6.185
  364   1HG   LYS  46          1HG       LYS  46  -3.869   8.269   4.450
  365   2HG   LYS  46          2HG       LYS  46  -5.221   7.320   5.068
  366   1HD   LYS  46          1HD       LYS  46  -5.177   8.367   7.082
  367   2HD   LYS  46          2HD       LYS  46  -3.415   8.326   7.164
  368   1HE   LYS  46          1HE       LYS  46  -3.562  10.172   5.288
  369   2HE   LYS  46          2HE       LYS  46  -5.209  10.395   5.911
  370   1HZ   LYS  46          1HZ       LYS  46  -2.856  10.199   7.703
  371   2HZ   LYS  46          2HZ       LYS  46  -4.401  10.815   8.055
  372   3HZ   LYS  46          3HZ       LYS  46  -3.343  11.687   7.052
  373    H    SER  47           H        SER  47  -0.183   6.481   4.416
  374    HA   SER  47           HA       SER  47  -0.169   8.714   2.436
  375   1HB   SER  47          1HB       SER  47   0.983  10.142   4.056
  376   2HB   SER  47          2HB       SER  47  -0.552   9.606   4.729
  377    HG   SER  47           HG       SER  47   0.442   8.404   6.151
  378    H    ALA  48           H        ALA  48   1.935   9.118   1.562
  379    HA   ALA  48           HA       ALA  48   3.591   6.865   1.118
  380   1HB   ALA  48          1HB       ALA  48   3.827   9.849   0.846
  381   2HB   ALA  48          2HB       ALA  48   3.776   8.620  -0.418
  382   3HB   ALA  48          3HB       ALA  48   5.244   8.849   0.531
  383    H    GLU  49           H        GLU  49   3.636   9.301   3.661
  384    HA   GLU  49           HA       GLU  49   6.270   8.819   4.686
  385   1HB   GLU  49          1HB       GLU  49   4.360  10.622   5.125
  386   2HB   GLU  49          2HB       GLU  49   3.953   9.529   6.449
  387   1HG   GLU  49          1HG       GLU  49   6.297   9.658   7.250
  388   2HG   GLU  49          2HG       GLU  49   6.671  10.784   5.944
  389    H    ASP  50           H        ASP  50   3.157   7.226   5.253
  390    HA   ASP  50           HA       ASP  50   4.150   5.573   7.453
  391   1HB   ASP  50          1HB       ASP  50   1.813   6.218   7.324
  392   2HB   ASP  50          2HB       ASP  50   1.675   5.557   5.695
  393    H    CYS  51           H        CYS  51   3.845   5.317   3.967
  394    HA   CYS  51           HA       CYS  51   4.406   2.430   3.899
  395   1HB   CYS  51          1HB       CYS  51   2.979   3.486   2.221
  396   2HB   CYS  51          2HB       CYS  51   4.257   4.628   1.803
  397    H    MET  52           H        MET  52   6.130   5.472   3.129
  398    HA   MET  52           HA       MET  52   8.598   4.207   2.333
  399   1HB   MET  52          1HB       MET  52   7.483   6.736   2.324
  400   2HB   MET  52          2HB       MET  52   8.760   6.890   3.530
  401   1HG   MET  52          1HG       MET  52   9.094   5.847   0.700
  402   2HG   MET  52          2HG       MET  52   9.628   7.420   1.290
  403   1HE   MET  52          1HE       MET  52  11.615   5.385  -0.170
  404   2HE   MET  52          2HE       MET  52  10.510   4.118   0.356
  405   3HE   MET  52          3HE       MET  52  12.208   4.045   0.820
  406    H    ARG  53           H        ARG  53   7.611   5.787   5.411
  407    HA   ARG  53           HA       ARG  53  10.011   5.236   6.852
  408   1HB   ARG  53          1HB       ARG  53   7.857   6.678   7.345
  409   2HB   ARG  53          2HB       ARG  53   7.279   5.201   8.115
  410   1HG   ARG  53          1HG       ARG  53  10.048   5.956   8.813
  411   2HG   ARG  53          2HG       ARG  53   8.815   7.088   9.368
  412   1HD   ARG  53          1HD       ARG  53   8.654   4.091   9.837
  413   2HD   ARG  53          2HD       ARG  53   9.308   5.240  11.022
  414    HE   ARG  53           HE       ARG  53   6.548   5.559   9.891
  415   1HH1  ARG  53          1HH2      ARG  53   8.199   4.321  12.533
  416   2HH1  ARG  53          2HH2      ARG  53   7.323   5.217  13.728
  417   1HH2  ARG  53          1HH1      ARG  53   5.663   7.194  11.414
  418   2HH2  ARG  53          2HH1      ARG  53   5.886   6.841  13.096
  419    H    THR  54           H        THR  54   7.327   3.217   5.929
  420    HA   THR  54           HA       THR  54   8.092   1.045   7.803
  421    HB   THR  54           HB       THR  54   5.845   1.615   5.862
  422    HG1  THR  54           1HG      THR  54   4.905   2.090   7.659
  423   1HG2  THR  54          1HG2      THR  54   5.695  -0.592   5.434
  424   2HG2  THR  54          2HG2      THR  54   5.187  -0.767   7.115
  425   3HG2  THR  54          3HG2      THR  54   6.881  -0.990   6.677
  426    H    CYS  55           H        CYS  55   7.834   1.662   4.302
  427    HA   CYS  55           HA       CYS  55   9.322  -0.858   3.739
  428   1HB   CYS  55          1HB       CYS  55   7.925   1.127   1.914
  429   2HB   CYS  55          2HB       CYS  55   8.463  -0.494   1.477
  430    H    GLY  56           H        GLY  56  10.447   1.856   4.748
  431   1HA   GLY  56          1HA       GLY  56  11.953   3.009   2.587
  432   2HA   GLY  56          2HA       GLY  56  12.302   3.222   4.302
  433    H    GLY  57           H        GLY  57  13.796   2.297   1.633
  434   1HA   GLY  57          1HA       GLY  57  15.510   0.355   3.091
  435   2HA   GLY  57          2HA       GLY  57  14.916  -0.085   1.488
  436    H    ALA  58           H        ALA  58  15.266   1.927  -0.126
  437    HA   ALA  58           HA       ALA  58  18.027   2.171  -0.634
  438   1HB   ALA  58          1HB       ALA  58  15.609   2.949  -1.770
  439   2HB   ALA  58          2HB       ALA  58  17.206   3.257  -2.452
  440   3HB   ALA  58          3HB       ALA  58  16.422   4.482  -1.457
  Start of MODEL   22
    1   1H    ARG   1          1H        ARG   1  14.345  -6.420   5.642
    2   2H    ARG   1          2H        ARG   1  14.255  -5.321   6.935
    3   3H    ARG   1          3H        ARG   1  15.069  -4.892   5.507
    4    HA   ARG   1           HA       ARG   1  12.706  -3.969   5.869
    5   1HB   ARG   1          1HB       ARG   1  14.351  -4.748   3.683
    6   2HB   ARG   1          2HB       ARG   1  12.690  -5.137   3.236
    7   1HG   ARG   1          1HG       ARG   1  12.337  -2.678   4.344
    8   2HG   ARG   1          2HG       ARG   1  13.962  -2.500   3.678
    9   1HD   ARG   1          1HD       ARG   1  11.596  -3.552   2.084
   10   2HD   ARG   1          2HD       ARG   1  12.151  -1.867   2.042
   11    HE   ARG   1           HE       ARG   1  13.569  -4.200   0.920
   12   1HH1  ARG   1          1HH1      ARG   1  15.576  -2.754   2.571
   13   2HH1  ARG   1          2HH1      ARG   1  16.187  -1.567   1.466
   14   1HH2  ARG   1          1HH2      ARG   1  13.547  -1.889  -0.757
   15   2HH2  ARG   1          2HH2      ARG   1  15.039  -1.078  -0.417
   16    HA   PRO   2           HA       PRO   2   9.647  -7.098   6.425
   17   1HB   PRO   2          1HB       PRO   2   7.456  -5.691   5.583
   18   2HB   PRO   2          2HB       PRO   2   8.228  -5.432   7.156
   19   1HG   PRO   2          1HG       PRO   2   8.501  -3.897   4.608
   20   2HG   PRO   2          2HG       PRO   2   8.372  -3.293   6.267
   21   1HD   PRO   2          1HD       PRO   2  10.725  -3.452   4.914
   22   2HD   PRO   2          2HD       PRO   2  10.616  -3.632   6.680
   23    H    ASP   3           H        ASP   3   8.132  -8.404   5.150
   24    HA   ASP   3           HA       ASP   3   8.914  -8.524   2.296
   25   1HB   ASP   3          1HB       ASP   3   8.969 -10.604   3.442
   26   2HB   ASP   3          2HB       ASP   3   7.440 -10.286   4.262
   27    H    PHE   4           H        PHE   4   6.191  -7.625   4.342
   28    HA   PHE   4           HA       PHE   4   4.163  -7.783   2.289
   29   1HB   PHE   4          1HB       PHE   4   2.817  -6.545   3.863
   30   2HB   PHE   4          2HB       PHE   4   3.810  -7.674   4.776
   31    HD1  PHE   4           1HD      PHE   4   3.511  -4.088   3.745
   32    HD2  PHE   4           2HD      PHE   4   5.397  -6.930   6.369
   33    HE1  PHE   4           1HE      PHE   4   4.413  -2.242   5.110
   34    HE2  PHE   4           2HE      PHE   4   6.306  -5.063   7.725
   35    HZ   PHE   4           HZ       PHE   4   5.806  -2.719   7.090
   36    H    CYS   5           H        CYS   5   6.749  -5.591   2.807
   37    HA   CYS   5           HA       CYS   5   5.501  -3.327   1.398
   38   1HB   CYS   5          1HB       CYS   5   8.195  -4.032   2.557
   39   2HB   CYS   5          2HB       CYS   5   8.014  -2.604   1.537
   40    H    LEU   6           H        LEU   6   7.486  -6.116   0.675
   41    HA   LEU   6           HA       LEU   6   8.345  -5.161  -1.960
   42   1HB   LEU   6          1HB       LEU   6   8.368  -8.003  -0.940
   43   2HB   LEU   6          2HB       LEU   6   9.519  -7.218  -2.021
   44    HG   LEU   6           HG       LEU   6   9.185  -6.828   0.958
   45   1HD1  LEU   6          1HD1      LEU   6  10.694  -8.614   0.236
   46   2HD1  LEU   6          2HD1      LEU   6  11.627  -7.281   0.916
   47   3HD1  LEU   6          3HD1      LEU   6  11.539  -7.495  -0.832
   48   1HD2  LEU   6          1HD2      LEU   6  11.071  -5.066   0.521
   49   2HD2  LEU   6          2HD2      LEU   6   9.391  -4.590   0.275
   50   3HD2  LEU   6          3HD2      LEU   6  10.402  -5.008  -1.109
   51    H    GLU   7           H        GLU   7   5.571  -6.764  -0.662
   52    HA   GLU   7           HA       GLU   7   4.781  -8.066  -3.172
   53   1HB   GLU   7          1HB       GLU   7   3.486  -7.553  -0.481
   54   2HB   GLU   7          2HB       GLU   7   2.672  -8.429  -1.778
   55   1HG   GLU   7          1HG       GLU   7   5.198  -9.608  -1.643
   56   2HG   GLU   7          2HG       GLU   7   4.762  -9.339   0.045
   57    HA   PRO   8           HA       PRO   8   2.553  -4.709  -4.903
   58   1HB   PRO   8          1HB       PRO   8   0.377  -5.980  -5.980
   59   2HB   PRO   8          2HB       PRO   8   2.007  -6.089  -6.675
   60   1HG   PRO   8          1HG       PRO   8   0.531  -8.020  -4.942
   61   2HG   PRO   8          2HG       PRO   8   1.586  -8.330  -6.329
   62   1HD   PRO   8          1HD       PRO   8   2.364  -8.613  -3.719
   63   2HD   PRO   8          2HD       PRO   8   3.487  -8.240  -5.046
   64    HA   PRO   9           HA       PRO   9  -0.602  -3.374  -2.169
   65   1HB   PRO   9          1HB       PRO   9  -2.324  -2.022  -3.824
   66   2HB   PRO   9          2HB       PRO   9  -0.737  -1.393  -3.339
   67   1HG   PRO   9          1HG       PRO   9  -1.575  -2.723  -5.873
   68   2HG   PRO   9          2HG       PRO   9  -0.468  -1.363  -5.625
   69   1HD   PRO   9          1HD       PRO   9   0.349  -3.931  -6.101
   70   2HD   PRO   9          2HD       PRO   9   1.311  -2.743  -5.196
   71    H    TYR  10           H        TYR  10  -3.125  -3.388  -1.890
   72    HA   TYR  10           HA       TYR  10  -4.332  -5.790  -3.239
   73   1HB   TYR  10          1HB       TYR  10  -3.296  -6.198  -0.946
   74   2HB   TYR  10          2HB       TYR  10  -4.509  -5.097  -0.292
   75    HD1  TYR  10           1HD      TYR  10  -6.571  -5.959   0.379
   76    HD2  TYR  10           2HD      TYR  10  -4.232  -8.114  -2.506
   77    HE1  TYR  10           1HE      TYR  10  -8.232  -7.800   0.409
   78    HE2  TYR  10           2HE      TYR  10  -5.892  -9.957  -2.477
   79    HH   TYR  10           HH       TYR  10  -8.644  -9.936  -1.801
   80    H    THR  11           H        THR  11  -5.688  -4.449  -4.496
   81    HA   THR  11           HA       THR  11  -7.280  -2.298  -3.447
   82    HB   THR  11           HB       THR  11  -7.265  -4.088  -5.870
   83    HG1  THR  11           1HG      THR  11  -6.926  -2.068  -6.855
   84   1HG2  THR  11          1HG2      THR  11  -9.162  -2.370  -6.618
   85   2HG2  THR  11          2HG2      THR  11  -9.523  -2.393  -4.892
   86   3HG2  THR  11          3HG2      THR  11  -9.566  -3.892  -5.823
   87    H    GLY  12           H        GLY  12  -7.522  -5.761  -3.367
   88   1HA   GLY  12          1HA       GLY  12  -9.147  -7.185  -2.426
   89   2HA   GLY  12          2HA       GLY  12  -9.595  -5.805  -1.419
   90    HA   PRO  13           HA       PRO  13 -12.863  -6.733  -4.664
   91   1HB   PRO  13          1HB       PRO  13 -14.768  -7.833  -3.035
   92   2HB   PRO  13          2HB       PRO  13 -13.526  -8.791  -3.859
   93   1HG   PRO  13          1HG       PRO  13 -13.663  -7.880  -1.027
   94   2HG   PRO  13          2HG       PRO  13 -13.068  -9.407  -1.693
   95   1HD   PRO  13          1HD       PRO  13 -11.467  -7.314  -0.878
   96   2HD   PRO  13          2HD       PRO  13 -10.978  -8.560  -2.048
   97    H    CYS  14           H        CYS  14 -14.870  -6.472  -1.835
   98    HA   CYS  14           HA       CYS  14 -16.361  -4.731  -1.230
   99   1HB   CYS  14          1HB       CYS  14 -13.530  -3.840  -1.163
  100   2HB   CYS  14          2HB       CYS  14 -14.737  -2.560  -1.029
  101    H    LYS  15           H        LYS  15 -16.565  -2.093  -1.824
  102    HA   LYS  15           HA       LYS  15 -16.570  -1.921  -4.818
  103   1HB   LYS  15          1HB       LYS  15 -18.775  -2.582  -3.674
  104   2HB   LYS  15          2HB       LYS  15 -18.789  -0.952  -3.000
  105   1HG   LYS  15          1HG       LYS  15 -19.225   0.025  -5.031
  106   2HG   LYS  15          2HG       LYS  15 -18.294  -1.177  -5.926
  107   1HD   LYS  15          1HD       LYS  15 -20.067  -2.748  -5.874
  108   2HD   LYS  15          2HD       LYS  15 -20.900  -1.890  -4.576
  109   1HE   LYS  15          1HE       LYS  15 -21.846  -0.367  -6.028
  110   2HE   LYS  15          2HE       LYS  15 -20.432  -0.364  -7.101
  111   1HZ   LYS  15          1HZ       LYS  15 -22.706  -1.680  -7.633
  112   2HZ   LYS  15          2HZ       LYS  15 -21.833  -2.900  -6.838
  113   3HZ   LYS  15          3HZ       LYS  15 -21.191  -2.157  -8.226
  114    H    ALA  16           H        ALA  16 -15.087  -0.684  -2.308
  115    HA   ALA  16           HA       ALA  16 -15.692   2.185  -2.649
  116   1HB   ALA  16          1HB       ALA  16 -14.056   0.419  -0.879
  117   2HB   ALA  16          2HB       ALA  16 -15.178   1.707  -0.443
  118   3HB   ALA  16          3HB       ALA  16 -13.560   2.105  -1.023
  119    H    ARG  17           H        ARG  17 -13.667   3.642  -2.949
  120    HA   ARG  17           HA       ARG  17 -11.580   2.449  -4.689
  121   1HB   ARG  17          1HB       ARG  17 -13.948   3.646  -5.666
  122   2HB   ARG  17          2HB       ARG  17 -12.670   4.833  -5.921
  123   1HG   ARG  17          1HG       ARG  17 -11.953   3.643  -7.692
  124   2HG   ARG  17          2HG       ARG  17 -11.604   2.287  -6.619
  125   1HD   ARG  17          1HD       ARG  17 -13.204   1.197  -7.848
  126   2HD   ARG  17          2HD       ARG  17 -14.359   2.143  -6.886
  127    HE   ARG  17           HE       ARG  17 -13.639   2.631  -9.679
  128   1HH1  ARG  17          1HH2      ARG  17 -16.227   3.181  -7.995
  129   2HH1  ARG  17          2HH2      ARG  17 -16.315   4.903  -8.157
  130   1HH2  ARG  17          1HH1      ARG  17 -13.071   5.222  -9.342
  131   2HH2  ARG  17          2HH1      ARG  17 -14.528   6.059  -8.921
  132    H    ILE  18           H        ILE  18 -10.566   3.232  -2.518
  133    HA   ILE  18           HA       ILE  18 -10.121   6.176  -2.459
  134    HB   ILE  18           HB       ILE  18  -9.384   3.920  -0.566
  135   1HG1  ILE  18          1HG1      ILE  18 -11.592   6.004  -0.477
  136   2HG1  ILE  18          2HG1      ILE  18 -11.814   4.280  -0.776
  137   1HG2  ILE  18          1HG2      ILE  18  -8.062   5.436   0.448
  138   2HG2  ILE  18          2HG2      ILE  18  -9.491   6.427   0.744
  139   3HG2  ILE  18          3HG2      ILE  18  -8.533   6.674  -0.716
  140   1HD1  ILE  18          1HD1      ILE  18 -10.884   3.774   1.452
  141   2HD1  ILE  18          2HD1      ILE  18 -12.279   4.843   1.586
  142   3HD1  ILE  18          3HD1      ILE  18 -10.649   5.496   1.748
  143    H    ILE  19           H        ILE  19  -7.943   7.015  -2.455
  144    HA   ILE  19           HA       ILE  19  -6.040   5.345  -4.012
  145    HB   ILE  19           HB       ILE  19  -6.269   8.284  -3.308
  146   1HG1  ILE  19          1HG1      ILE  19  -7.865   7.620  -4.981
  147   2HG1  ILE  19          2HG1      ILE  19  -6.543   8.419  -5.833
  148   1HG2  ILE  19          1HG2      ILE  19  -4.050   8.417  -3.705
  149   2HG2  ILE  19          2HG2      ILE  19  -4.420   8.003  -5.378
  150   3HG2  ILE  19          3HG2      ILE  19  -3.976   6.737  -4.235
  151   1HD1  ILE  19          1HD1      ILE  19  -6.974   6.437  -7.080
  152   2HD1  ILE  19          2HD1      ILE  19  -7.111   5.458  -5.619
  153   3HD1  ILE  19          3HD1      ILE  19  -5.537   6.072  -6.126
  154    H    ARG  20           H        ARG  20  -5.305   4.001  -2.207
  155    HA   ARG  20           HA       ARG  20  -4.024   5.331   0.098
  156   1HB   ARG  20          1HB       ARG  20  -4.752   2.561  -0.779
  157   2HB   ARG  20          2HB       ARG  20  -3.509   2.744   0.460
  158   1HG   ARG  20          1HG       ARG  20  -6.217   4.095   0.619
  159   2HG   ARG  20          2HG       ARG  20  -5.883   2.521   1.343
  160   1HD   ARG  20          1HD       ARG  20  -4.398   3.429   2.922
  161   2HD   ARG  20          2HD       ARG  20  -4.081   4.869   1.935
  162    HE   ARG  20           HE       ARG  20  -6.265   5.727   2.588
  163   1HH1  ARG  20          1HH2      ARG  20  -4.879   3.527   4.708
  164   2HH1  ARG  20          2HH2      ARG  20  -6.325   3.215   5.608
  165   1HH2  ARG  20          1HH1      ARG  20  -8.379   4.966   3.432
  166   2HH2  ARG  20          2HH1      ARG  20  -8.305   4.030   4.886
  167    H    TYR  21           H        TYR  21  -1.747   4.271   0.664
  168    HA   TYR  21           HA       TYR  21  -0.064   4.489  -1.807
  169   1HB   TYR  21          1HB       TYR  21   0.276   5.256   1.088
  170   2HB   TYR  21          2HB       TYR  21   1.679   5.081   0.034
  171    HD1  TYR  21           1HD      TYR  21  -1.332   7.042   0.763
  172    HD2  TYR  21           2HD      TYR  21   2.025   6.582  -1.875
  173    HE1  TYR  21           1HE      TYR  21  -1.738   9.314  -0.144
  174    HE2  TYR  21           2HE      TYR  21   1.618   8.855  -2.788
  175    HH   TYR  21           HH       TYR  21  -0.816  10.990  -1.382
  176    H    PHE  22           H        PHE  22   1.733   3.065  -2.007
  177    HA   PHE  22           HA       PHE  22   2.061   0.883  -0.036
  178   1HB   PHE  22          1HB       PHE  22   1.435  -0.839  -1.519
  179   2HB   PHE  22          2HB       PHE  22   0.228   0.398  -1.816
  180    HD1  PHE  22           1HD      PHE  22   0.263   1.741  -3.874
  181    HD2  PHE  22           2HD      PHE  22   3.182  -1.327  -3.145
  182    HE1  PHE  22           1HE      PHE  22   0.932   1.809  -6.263
  183    HE2  PHE  22           2HE      PHE  22   3.853  -1.258  -5.532
  184    HZ   PHE  22           HZ       PHE  22   2.728   0.310  -7.091
  185    H    TYR  23           H        TYR  23   4.059  -0.316  -0.461
  186    HA   TYR  23           HA       TYR  23   6.135   1.416  -1.657
  187   1HB   TYR  23          1HB       TYR  23   6.371   0.307   0.542
  188   2HB   TYR  23          2HB       TYR  23   6.249  -1.270  -0.241
  189    HD1  TYR  23           1HD      TYR  23   8.292  -2.347  -0.529
  190    HD2  TYR  23           2HD      TYR  23   8.134   1.932  -0.845
  191    HE1  TYR  23           1HE      TYR  23  10.723  -2.294  -1.013
  192    HE2  TYR  23           2HE      TYR  23  10.564   1.987  -1.328
  193    HH   TYR  23           HH       TYR  23  12.378  -0.917  -1.957
  194    H    ASN  24           H        ASN  24   6.470   1.206  -3.862
  195    HA   ASN  24           HA       ASN  24   5.890  -1.331  -5.251
  196   1HB   ASN  24          1HB       ASN  24   5.357   0.948  -6.150
  197   2HB   ASN  24          2HB       ASN  24   7.085   1.287  -6.222
  198   1HD2  ASN  24          1HD2      ASN  24   5.045   0.984  -8.470
  199   2HD2  ASN  24          2HD2      ASN  24   5.699  -0.211  -9.485
  200    H    ALA  25           H        ALA  25   7.608  -2.620  -4.132
  201    HA   ALA  25           HA       ALA  25  10.328  -2.083  -3.956
  202   1HB   ALA  25          1HB       ALA  25   9.319  -4.135  -3.149
  203   2HB   ALA  25          2HB       ALA  25  10.562  -4.581  -4.317
  204   3HB   ALA  25          3HB       ALA  25   8.862  -4.608  -4.784
  205    H    LYS  26           H        LYS  26   8.440  -2.752  -6.835
  206    HA   LYS  26           HA       LYS  26  10.675  -3.212  -8.622
  207   1HB   LYS  26          1HB       LYS  26   8.007  -3.594  -8.698
  208   2HB   LYS  26          2HB       LYS  26   8.090  -2.060  -9.565
  209   1HG   LYS  26          1HG       LYS  26   9.962  -3.167 -10.956
  210   2HG   LYS  26          2HG       LYS  26   9.395  -4.692 -10.271
  211   1HD   LYS  26          1HD       LYS  26   7.227  -2.991 -11.291
  212   2HD   LYS  26          2HD       LYS  26   8.373  -3.485 -12.538
  213   1HE   LYS  26          1HE       LYS  26   7.712  -5.701 -10.752
  214   2HE   LYS  26          2HE       LYS  26   6.272  -5.039 -11.549
  215   1HZ   LYS  26          1HZ       LYS  26   7.202  -5.358 -13.642
  216   2HZ   LYS  26          2HZ       LYS  26   7.708  -6.752 -12.813
  217   3HZ   LYS  26          3HZ       LYS  26   8.787  -5.461 -13.046
  218    H    ALA  27           H        ALA  27   9.015  -0.369  -7.382
  219    HA   ALA  27           HA       ALA  27  10.381   1.409  -9.336
  220   1HB   ALA  27          1HB       ALA  27   7.913   1.495  -8.490
  221   2HB   ALA  27          2HB       ALA  27   8.807   3.011  -8.612
  222   3HB   ALA  27          3HB       ALA  27   8.603   2.232  -7.043
  223    H    GLY  28           H        GLY  28  10.560   0.403  -5.976
  224   1HA   GLY  28          1HA       GLY  28  12.585   0.652  -4.674
  225   2HA   GLY  28          2HA       GLY  28  13.037   2.019  -5.691
  226    H    LEU  29           H        LEU  29   9.944   2.699  -5.237
  227    HA   LEU  29           HA       LEU  29  10.288   3.904  -2.523
  228   1HB   LEU  29          1HB       LEU  29   9.340   6.000  -3.526
  229   2HB   LEU  29          2HB       LEU  29  10.888   5.546  -4.234
  230    HG   LEU  29           HG       LEU  29   8.576   4.332  -5.586
  231   1HD1  LEU  29          1HD1      LEU  29   7.911   6.437  -6.715
  232   2HD1  LEU  29          2HD1      LEU  29   8.969   7.341  -5.632
  233   3HD1  LEU  29          3HD1      LEU  29   7.563   6.494  -4.988
  234   1HD2  LEU  29          1HD2      LEU  29  11.126   5.769  -6.280
  235   2HD2  LEU  29          2HD2      LEU  29   9.901   5.515  -7.521
  236   3HD2  LEU  29          3HD2      LEU  29  10.627   4.132  -6.701
  237    H    CYS  30           H        CYS  30   7.689   5.347  -3.104
  238    HA   CYS  30           HA       CYS  30   5.861   2.981  -2.852
  239   1HB   CYS  30          1HB       CYS  30   5.935   5.667  -1.452
  240   2HB   CYS  30          2HB       CYS  30   4.566   4.563  -1.339
  241    H    GLN  31           H        GLN  31   3.727   3.263  -3.722
  242    HA   GLN  31           HA       GLN  31   3.273   5.672  -5.425
  243   1HB   GLN  31          1HB       GLN  31   3.108   2.758  -6.272
  244   2HB   GLN  31          2HB       GLN  31   2.623   4.126  -7.275
  245   1HG   GLN  31          1HG       GLN  31   5.105   4.939  -6.608
  246   2HG   GLN  31          2HG       GLN  31   5.349   3.195  -6.515
  247   1HE2  GLN  31          1HE2      GLN  31   6.773   3.572  -8.496
  248   2HE2  GLN  31          2HE2      GLN  31   6.029   3.647 -10.020
  249    H    THR  32           H        THR  32   0.939   5.877  -6.000
  250    HA   THR  32           HA       THR  32  -0.771   4.988  -3.781
  251    HB   THR  32           HB       THR  32  -2.423   6.384  -5.276
  252    HG1  THR  32           1HG      THR  32  -0.882   7.890  -6.472
  253   1HG2  THR  32          1HG2      THR  32  -1.901   7.732  -3.545
  254   2HG2  THR  32          2HG2      THR  32  -0.651   8.420  -4.583
  255   3HG2  THR  32          3HG2      THR  32  -0.252   7.108  -3.473
  256    H    PHE  33           H        PHE  33  -2.511   3.569  -3.956
  257    HA   PHE  33           HA       PHE  33  -3.016   2.291  -6.609
  258   1HB   PHE  33          1HB       PHE  33  -2.669   0.119  -5.721
  259   2HB   PHE  33          2HB       PHE  33  -1.337   1.066  -5.072
  260    HD1  PHE  33           1HD      PHE  33  -1.400   1.868  -2.696
  261    HD2  PHE  33           2HD      PHE  33  -4.378  -0.786  -4.298
  262    HE1  PHE  33           1HE      PHE  33  -2.118   1.292  -0.400
  263    HE2  PHE  33           2HE      PHE  33  -5.093  -1.368  -1.994
  264    HZ   PHE  33           HZ       PHE  33  -3.964  -0.330  -0.045
  265    H    VAL  34           H        VAL  34  -5.102   1.099  -6.606
  266    HA   VAL  34           HA       VAL  34  -7.185   2.614  -5.254
  267    HB   VAL  34           HB       VAL  34  -7.379  -0.009  -6.763
  268   1HG1  VAL  34          1HG1      VAL  34  -9.254   2.153  -5.925
  269   2HG1  VAL  34          2HG1      VAL  34  -9.534   0.419  -6.075
  270   3HG1  VAL  34          3HG1      VAL  34  -9.513   1.437  -7.515
  271   1HG2  VAL  34          1HG2      VAL  34  -7.870   2.338  -8.372
  272   2HG2  VAL  34          2HG2      VAL  34  -6.715   1.035  -8.648
  273   3HG2  VAL  34          3HG2      VAL  34  -6.256   2.428  -7.669
  274    H    TYR  35           H        TYR  35  -7.877   2.210  -3.190
  275    HA   TYR  35           HA       TYR  35  -7.206  -0.410  -1.932
  276   1HB   TYR  35          1HB       TYR  35  -6.490   1.665  -0.847
  277   2HB   TYR  35          2HB       TYR  35  -8.141   2.280  -0.874
  278    HD1  TYR  35           1HD      TYR  35  -7.256  -1.247  -0.176
  279    HD2  TYR  35           2HD      TYR  35  -8.413   2.532   1.510
  280    HE1  TYR  35           1HE      TYR  35  -7.689  -2.351   2.002
  281    HE2  TYR  35           2HE      TYR  35  -8.847   1.427   3.688
  282    HH   TYR  35           HH       TYR  35  -9.355  -1.643   4.121
  283    H    GLY  36           H        GLY  36  -8.859  -1.716  -0.994
  284   1HA   GLY  36          1HA       GLY  36 -11.569  -1.245  -2.079
  285   2HA   GLY  36          2HA       GLY  36 -10.996  -2.741  -1.340
  286    H    ALA  37           H        ALA  37  -9.939  -0.447   0.735
  287    HA   ALA  37           HA       ALA  37 -10.795   0.510   2.735
  288   1HB   ALA  37          1HB       ALA  37 -12.938   1.319   2.591
  289   2HB   ALA  37          2HB       ALA  37 -13.591  -0.227   2.048
  290   3HB   ALA  37          3HB       ALA  37 -12.767   0.833   0.904
  291    H    CYS  38           H        CYS  38 -11.068  -2.696   1.794
  292    HA   CYS  38           HA       CYS  38 -11.573  -3.524   4.610
  293   1HB   CYS  38          1HB       CYS  38 -13.233  -5.179   3.817
  294   2HB   CYS  38          2HB       CYS  38 -13.737  -3.541   3.408
  295    H    ARG  39           H        ARG  39 -11.124  -5.992   4.779
  296    HA   ARG  39           HA       ARG  39  -9.395  -7.618   4.629
  297   1HB   ARG  39          1HB       ARG  39 -10.595  -7.096   1.934
  298   2HB   ARG  39          2HB       ARG  39  -9.220  -8.198   2.029
  299   1HG   ARG  39          1HG       ARG  39 -10.397  -9.580   3.662
  300   2HG   ARG  39          2HG       ARG  39 -11.742  -8.440   3.700
  301   1HD   ARG  39          1HD       ARG  39 -12.546  -9.127   1.633
  302   2HD   ARG  39          2HD       ARG  39 -10.932  -9.571   1.041
  303    HE   ARG  39           HE       ARG  39 -12.603 -11.197   2.911
  304   1HH1  ARG  39          1HH1      ARG  39 -11.844 -12.278   0.245
  305   2HH1  ARG  39          2HH1      ARG  39 -10.463 -13.254   0.617
  306   1HH2  ARG  39          1HH2      ARG  39  -9.920 -11.784   3.710
  307   2HH2  ARG  39          2HH2      ARG  39  -9.374 -12.975   2.576
  308    H    ALA  40           H        ALA  40  -8.541  -4.723   4.498
  309    HA   ALA  40           HA       ALA  40  -6.481  -4.348   2.551
  310   1HB   ALA  40          1HB       ALA  40  -6.510  -2.339   3.587
  311   2HB   ALA  40          2HB       ALA  40  -5.951  -3.066   5.094
  312   3HB   ALA  40          3HB       ALA  40  -7.676  -3.007   4.730
  313    H    LYS  41           H        LYS  41  -4.120  -4.301   3.033
  314    HA   LYS  41           HA       LYS  41  -3.292  -6.394   5.017
  315   1HB   LYS  41          1HB       LYS  41  -2.027  -5.868   2.316
  316   2HB   LYS  41          2HB       LYS  41  -1.813  -7.280   3.351
  317   1HG   LYS  41          1HG       LYS  41  -4.330  -7.681   3.059
  318   2HG   LYS  41          2HG       LYS  41  -4.266  -6.482   1.767
  319   1HD   LYS  41          1HD       LYS  41  -2.981  -7.840   0.390
  320   2HD   LYS  41          2HD       LYS  41  -2.261  -8.710   1.748
  321   1HE   LYS  41          1HE       LYS  41  -5.188  -9.046   1.537
  322   2HE   LYS  41          2HE       LYS  41  -4.277  -9.714   0.168
  323   1HZ   LYS  41          1HZ       LYS  41  -4.311 -11.356   1.882
  324   2HZ   LYS  41          2HZ       LYS  41  -3.847 -10.230   3.067
  325   3HZ   LYS  41          3HZ       LYS  41  -2.747 -10.702   1.861
  326    H    ARG  42           H        ARG  42  -0.581  -6.127   4.908
  327    HA   ARG  42           HA       ARG  42  -0.097  -3.607   6.245
  328   1HB   ARG  42          1HB       ARG  42   2.038  -5.390   5.075
  329   2HB   ARG  42          2HB       ARG  42   2.065  -4.488   6.587
  330   1HG   ARG  42          1HG       ARG  42  -0.069  -6.105   7.039
  331   2HG   ARG  42          2HG       ARG  42   0.896  -7.148   5.993
  332   1HD   ARG  42          1HD       ARG  42   2.769  -6.056   7.760
  333   2HD   ARG  42          2HD       ARG  42   1.357  -6.403   8.779
  334    HE   ARG  42           HE       ARG  42   1.662  -8.618   7.063
  335   1HH1  ARG  42          1HH2      ARG  42   4.418  -7.237   8.174
  336   2HH1  ARG  42          2HH2      ARG  42   4.874  -8.509   9.256
  337   1HH2  ARG  42          1HH1      ARG  42   1.832 -10.156   9.024
  338   2HH2  ARG  42          2HH1      ARG  42   3.410 -10.163   9.737
  339    H    ASN  43           H        ASN  43  -0.010  -4.607   2.931
  340    HA   ASN  43           HA       ASN  43   1.756  -2.400   2.067
  341   1HB   ASN  43          1HB       ASN  43   1.463  -4.847   1.139
  342   2HB   ASN  43          2HB       ASN  43   0.080  -4.158   0.285
  343   1HD2  ASN  43          1HD2      ASN  43   3.610  -3.639   0.787
  344   2HD2  ASN  43          2HD2      ASN  43   3.872  -2.924  -0.731
  345    H    ASN  44           H        ASN  44  -0.007  -0.940   3.216
  346    HA   ASN  44           HA       ASN  44  -1.585   0.351   1.124
  347   1HB   ASN  44          1HB       ASN  44  -3.004  -1.578   1.619
  348   2HB   ASN  44          2HB       ASN  44  -2.888  -1.262   3.348
  349   1HD2  ASN  44          1HD2      ASN  44  -5.440  -1.373   2.301
  350   2HD2  ASN  44          2HD2      ASN  44  -6.124   0.190   2.210
  351    H    PHE  45           H        PHE  45  -0.125   2.050   2.048
  352    HA   PHE  45           HA       PHE  45  -0.744   2.920   4.821
  353   1HB   PHE  45          1HB       PHE  45   1.214   4.086   2.825
  354   2HB   PHE  45          2HB       PHE  45   1.267   4.203   4.584
  355    HD1  PHE  45           1HD      PHE  45   1.927   2.071   1.667
  356    HD2  PHE  45           2HD      PHE  45   1.905   2.251   5.961
  357    HE1  PHE  45           1HE      PHE  45   3.275  -0.010   1.762
  358    HE2  PHE  45           2HE      PHE  45   3.252   0.168   6.055
  359    HZ   PHE  45           HZ       PHE  45   3.939  -0.967   3.955
  360    H    LYS  46           H        LYS  46  -1.589   5.006   5.265
  361    HA   LYS  46           HA       LYS  46  -3.451   6.099   3.347
  362   1HB   LYS  46          1HB       LYS  46  -2.334   7.414   5.838
  363   2HB   LYS  46          2HB       LYS  46  -3.936   7.631   5.131
  364   1HG   LYS  46          1HG       LYS  46  -4.017   4.975   5.514
  365   2HG   LYS  46          2HG       LYS  46  -2.876   5.391   6.792
  366   1HD   LYS  46          1HD       LYS  46  -4.980   7.312   6.864
  367   2HD   LYS  46          2HD       LYS  46  -5.727   5.716   6.771
  368   1HE   LYS  46          1HE       LYS  46  -5.396   6.043   9.102
  369   2HE   LYS  46          2HE       LYS  46  -3.987   5.072   8.628
  370   1HZ   LYS  46          1HZ       LYS  46  -3.255   7.003   9.856
  371   2HZ   LYS  46          2HZ       LYS  46  -4.131   8.041   8.835
  372   3HZ   LYS  46          3HZ       LYS  46  -2.794   7.184   8.233
  373    H    SER  47           H        SER  47  -0.130   6.825   4.231
  374    HA   SER  47           HA       SER  47  -0.073   8.906   2.081
  375   1HB   SER  47          1HB       SER  47   1.237  10.331   3.577
  376   2HB   SER  47          2HB       SER  47  -0.277   9.901   4.365
  377    HG   SER  47           HG       SER  47   2.079   9.541   5.338
  378    H    ALA  48           H        ALA  48   2.105   9.210   1.189
  379    HA   ALA  48           HA       ALA  48   3.568   6.748   0.842
  380   1HB   ALA  48          1HB       ALA  48   4.007   8.050  -0.961
  381   2HB   ALA  48          2HB       ALA  48   5.191   8.879   0.050
  382   3HB   ALA  48          3HB       ALA  48   3.554   9.517  -0.094
  383    H    GLU  49           H        GLU  49   3.752   9.317   3.172
  384    HA   GLU  49           HA       GLU  49   6.507   9.092   3.947
  385   1HB   GLU  49          1HB       GLU  49   4.587  10.816   4.475
  386   2HB   GLU  49          2HB       GLU  49   4.259   9.747   5.839
  387   1HG   GLU  49          1HG       GLU  49   6.228  10.283   6.899
  388   2HG   GLU  49          2HG       GLU  49   7.103  10.506   5.385
  389    H    ASP  50           H        ASP  50   3.546   7.475   5.100
  390    HA   ASP  50           HA       ASP  50   4.867   5.939   7.170
  391   1HB   ASP  50          1HB       ASP  50   2.237   5.841   5.685
  392   2HB   ASP  50          2HB       ASP  50   2.650   4.610   6.878
  393    H    CYS  51           H        CYS  51   3.938   5.340   3.797
  394    HA   CYS  51           HA       CYS  51   4.715   2.575   3.665
  395   1HB   CYS  51          1HB       CYS  51   3.280   3.652   2.015
  396   2HB   CYS  51          2HB       CYS  51   4.547   4.813   1.617
  397    H    MET  52           H        MET  52   6.416   5.618   2.916
  398    HA   MET  52           HA       MET  52   8.875   4.417   2.030
  399   1HB   MET  52          1HB       MET  52   7.795   6.845   1.897
  400   2HB   MET  52          2HB       MET  52   8.753   7.100   3.356
  401   1HG   MET  52          1HG       MET  52   9.830   6.074   0.712
  402   2HG   MET  52          2HG       MET  52  10.013   7.722   1.312
  403   1HE   MET  52          1HE       MET  52  12.934   5.875   0.761
  404   2HE   MET  52          2HE       MET  52  11.456   4.953   0.492
  405   3HE   MET  52          3HE       MET  52  12.651   4.369   1.647
  406    H    ARG  53           H        ARG  53   8.260   6.183   5.104
  407    HA   ARG  53           HA       ARG  53  10.653   5.439   6.398
  408   1HB   ARG  53          1HB       ARG  53   9.553   6.232   8.363
  409   2HB   ARG  53          2HB       ARG  53   8.840   7.134   7.028
  410   1HG   ARG  53          1HG       ARG  53   6.806   6.363   7.598
  411   2HG   ARG  53          2HG       ARG  53   7.357   4.708   7.345
  412   1HD   ARG  53          1HD       ARG  53   6.915   4.518   9.601
  413   2HD   ARG  53          2HD       ARG  53   8.510   5.277   9.768
  414    HE   ARG  53           HE       ARG  53   6.277   7.157   9.380
  415   1HH1  ARG  53          1HH2      ARG  53   6.611   5.138  11.913
  416   2HH1  ARG  53          2HH2      ARG  53   7.071   6.324  13.089
  417   1HH2  ARG  53          1HH1      ARG  53   7.594   8.828  10.748
  418   2HH2  ARG  53          2HH1      ARG  53   7.629   8.413  12.429
  419    H    THR  54           H        THR  54   7.860   3.494   5.702
  420    HA   THR  54           HA       THR  54   8.601   1.454   7.736
  421    HB   THR  54           HB       THR  54   6.335   1.735   5.734
  422    HG1  THR  54           1HG      THR  54   5.403   1.679   8.113
  423   1HG2  THR  54          1HG2      THR  54   7.016  -0.649   6.254
  424   2HG2  THR  54          2HG2      THR  54   5.360  -0.234   6.697
  425   3HG2  THR  54          3HG2      THR  54   6.611  -0.319   7.938
  426    H    CYS  55           H        CYS  55   7.935   1.524   4.214
  427    HA   CYS  55           HA       CYS  55   9.367  -1.021   3.828
  428   1HB   CYS  55          1HB       CYS  55   8.183   0.951   1.845
  429   2HB   CYS  55          2HB       CYS  55   8.548  -0.748   1.549
  430    H    GLY  56           H        GLY  56  10.367   2.119   4.239
  431   1HA   GLY  56          1HA       GLY  56  12.200   2.568   2.110
  432   2HA   GLY  56          2HA       GLY  56  12.342   3.266   3.723
  433    H    GLY  57           H        GLY  57  14.718   2.805   2.990
  434   1HA   GLY  57          1HA       GLY  57  16.444   1.532   4.246
  435   2HA   GLY  57          2HA       GLY  57  15.453   0.091   4.012
  436    H    ALA  58           H        ALA  58  15.098   1.624   1.181
  437    HA   ALA  58           HA       ALA  58  16.980  -0.114  -0.212
  438   1HB   ALA  58          1HB       ALA  58  15.735   2.058  -1.731
  439   2HB   ALA  58          2HB       ALA  58  14.575   1.195  -0.722
  440   3HB   ALA  58          3HB       ALA  58  15.536   0.316  -1.911
  Start of MODEL   23
    1   1H    ARG   1          1H        ARG   1  14.372  -6.065   6.221
    2   2H    ARG   1          2H        ARG   1  15.112  -4.787   5.380
    3   3H    ARG   1          3H        ARG   1  14.747  -6.238   4.575
    4    HA   ARG   1           HA       ARG   1  12.840  -4.190   5.573
    5   1HB   ARG   1          1HB       ARG   1  14.158  -4.928   3.086
    6   2HB   ARG   1          2HB       ARG   1  12.403  -4.979   2.912
    7   1HG   ARG   1          1HG       ARG   1  12.359  -2.682   4.020
    8   2HG   ARG   1          2HG       ARG   1  14.111  -2.649   3.817
    9   1HD   ARG   1          1HD       ARG   1  12.062  -2.948   1.585
   10   2HD   ARG   1          2HD       ARG   1  13.063  -1.520   1.906
   11    HE   ARG   1           HE       ARG   1  13.945  -3.840   0.489
   12   1HH1  ARG   1          1HH2      ARG   1  14.920  -1.217   2.433
   13   2HH1  ARG   1          2HH2      ARG   1  16.594  -1.661   2.458
   14   1HH2  ARG   1          1HH1      ARG   1  16.098  -4.651   0.773
   15   2HH2  ARG   1          2HH1      ARG   1  17.261  -3.605   1.519
   16    HA   PRO   2           HA       PRO   2   9.886  -7.400   6.134
   17   1HB   PRO   2          1HB       PRO   2   7.608  -6.059   5.467
   18   2HB   PRO   2          2HB       PRO   2   8.479  -5.790   6.987
   19   1HG   PRO   2          1HG       PRO   2   8.471  -4.191   4.470
   20   2HG   PRO   2          2HG       PRO   2   8.510  -3.641   6.151
   21   1HD   PRO   2          1HD       PRO   2  10.701  -3.741   4.505
   22   2HD   PRO   2          2HD       PRO   2  10.788  -3.842   6.277
   23    H    ASP   3           H        ASP   3   8.183  -8.638   4.942
   24    HA   ASP   3           HA       ASP   3   8.854  -8.784   2.055
   25   1HB   ASP   3          1HB       ASP   3   8.585 -10.662   3.987
   26   2HB   ASP   3          2HB       ASP   3   6.935 -10.648   3.363
   27    H    PHE   4           H        PHE   4   6.286  -7.749   4.199
   28    HA   PHE   4           HA       PHE   4   4.105  -7.956   2.312
   29   1HB   PHE   4          1HB       PHE   4   2.935  -6.532   3.883
   30   2HB   PHE   4          2HB       PHE   4   3.930  -7.656   4.801
   31    HD1  PHE   4           1HD      PHE   4   5.445  -6.868   6.383
   32    HD2  PHE   4           2HD      PHE   4   3.976  -4.170   3.371
   33    HE1  PHE   4           1HE      PHE   4   6.566  -4.975   7.523
   34    HE2  PHE   4           2HE      PHE   4   5.106  -2.294   4.510
   35    HZ   PHE   4           HZ       PHE   4   6.394  -2.688   6.583
   36    H    CYS   5           H        CYS   5   6.763  -5.755   2.610
   37    HA   CYS   5           HA       CYS   5   5.506  -3.601   1.050
   38   1HB   CYS   5          1HB       CYS   5   7.977  -4.156   2.551
   39   2HB   CYS   5          2HB       CYS   5   8.233  -3.175   1.107
   40    H    LEU   6           H        LEU   6   7.353  -6.490   0.474
   41    HA   LEU   6           HA       LEU   6   8.273  -5.715  -2.205
   42   1HB   LEU   6          1HB       LEU   6   8.142  -8.463  -0.934
   43   2HB   LEU   6          2HB       LEU   6   9.264  -7.902  -2.173
   44    HG   LEU   6           HG       LEU   6   9.129  -6.950   0.705
   45   1HD1  LEU   6          1HD1      LEU   6  11.635  -8.010  -0.424
   46   2HD1  LEU   6          2HD1      LEU   6  10.335  -9.198  -0.311
   47   3HD1  LEU   6          3HD1      LEU   6  10.874  -8.338   1.132
   48   1HD2  LEU   6          1HD2      LEU   6   9.761  -5.032  -0.506
   49   2HD2  LEU   6          2HD2      LEU   6  10.640  -5.972  -1.713
   50   3HD2  LEU   6          3HD2      LEU   6  11.311  -5.766  -0.095
   51    H    GLU   7           H        GLU   7   5.422  -7.045  -0.799
   52    HA   GLU   7           HA       GLU   7   4.508  -8.440  -3.223
   53   1HB   GLU   7          1HB       GLU   7   3.948  -8.361  -0.435
   54   2HB   GLU   7          2HB       GLU   7   2.463  -7.898  -1.266
   55   1HG   GLU   7          1HG       GLU   7   2.172 -10.157  -1.445
   56   2HG   GLU   7          2HG       GLU   7   3.274  -9.991  -2.812
   57    HA   PRO   8           HA       PRO   8   2.403  -5.028  -5.021
   58   1HB   PRO   8          1HB       PRO   8   0.183  -6.256  -6.063
   59   2HB   PRO   8          2HB       PRO   8   1.805  -6.425  -6.763
   60   1HG   PRO   8          1HG       PRO   8   0.278  -8.285  -5.003
   61   2HG   PRO   8          2HG       PRO   8   1.337  -8.645  -6.376
   62   1HD   PRO   8          1HD       PRO   8   2.078  -8.893  -3.745
   63   2HD   PRO   8          2HD       PRO   8   3.221  -8.603  -5.074
   64    HA   PRO   9           HA       PRO   9  -0.645  -3.571  -2.229
   65   1HB   PRO   9          1HB       PRO   9  -2.241  -2.032  -3.848
   66   2HB   PRO   9          2HB       PRO   9  -0.621  -1.542  -3.315
   67   1HG   PRO   9          1HG       PRO   9  -1.517  -2.686  -5.916
   68   2HG   PRO   9          2HG       PRO   9  -0.300  -1.441  -5.587
   69   1HD   PRO   9          1HD       PRO   9   0.288  -4.056  -6.171
   70   2HD   PRO   9          2HD       PRO   9   1.347  -2.986  -5.226
   71    H    TYR  10           H        TYR  10  -2.935  -3.764  -1.629
   72    HA   TYR  10           HA       TYR  10  -4.368  -5.929  -3.154
   73   1HB   TYR  10          1HB       TYR  10  -3.354  -6.277  -0.797
   74   2HB   TYR  10          2HB       TYR  10  -4.655  -5.230  -0.229
   75    HD1  TYR  10           1HD      TYR  10  -6.589  -6.283   0.496
   76    HD2  TYR  10           2HD      TYR  10  -4.223  -8.146  -2.568
   77    HE1  TYR  10           1HE      TYR  10  -8.155  -8.206   0.455
   78    HE2  TYR  10           2HE      TYR  10  -5.790 -10.069  -2.608
   79    HH   TYR  10           HH       TYR  10  -8.004 -10.682  -0.205
   80    H    THR  11           H        THR  11  -5.644  -4.534  -4.439
   81    HA   THR  11           HA       THR  11  -7.111  -2.270  -3.479
   82    HB   THR  11           HB       THR  11  -7.253  -4.196  -5.795
   83    HG1  THR  11           1HG      THR  11  -5.894  -2.639  -6.269
   84   1HG2  THR  11          1HG2      THR  11  -9.095  -2.663  -6.705
   85   2HG2  THR  11          2HG2      THR  11  -9.320  -2.124  -5.041
   86   3HG2  THR  11          3HG2      THR  11  -9.579  -3.817  -5.462
   87    H    GLY  12           H        GLY  12  -7.541  -5.708  -3.212
   88   1HA   GLY  12          1HA       GLY  12  -9.191  -6.989  -2.122
   89   2HA   GLY  12          2HA       GLY  12  -9.595  -5.518  -1.234
   90    HA   PRO  13           HA       PRO  13 -12.891  -6.639  -4.408
   91   1HB   PRO  13          1HB       PRO  13 -14.820  -7.540  -2.686
   92   2HB   PRO  13          2HB       PRO  13 -13.615  -8.603  -3.442
   93   1HG   PRO  13          1HG       PRO  13 -13.695  -7.455  -0.693
   94   2HG   PRO  13          2HG       PRO  13 -13.171  -9.058  -1.230
   95   1HD   PRO  13          1HD       PRO  13 -11.468  -6.995  -0.598
   96   2HD   PRO  13          2HD       PRO  13 -11.054  -8.327  -1.699
   97    H    CYS  14           H        CYS  14 -14.772  -6.083  -1.515
   98    HA   CYS  14           HA       CYS  14 -16.229  -4.281  -1.012
   99   1HB   CYS  14          1HB       CYS  14 -13.423  -3.350  -1.305
  100   2HB   CYS  14          2HB       CYS  14 -14.648  -2.082  -1.248
  101    H    LYS  15           H        LYS  15 -16.533  -1.752  -1.961
  102    HA   LYS  15           HA       LYS  15 -16.762  -2.008  -4.939
  103   1HB   LYS  15          1HB       LYS  15 -18.808  -2.035  -2.928
  104   2HB   LYS  15          2HB       LYS  15 -18.980  -0.561  -3.882
  105   1HG   LYS  15          1HG       LYS  15 -19.503  -1.710  -5.797
  106   2HG   LYS  15          2HG       LYS  15 -18.434  -3.056  -5.403
  107   1HD   LYS  15          1HD       LYS  15 -20.027  -4.045  -3.962
  108   2HD   LYS  15          2HD       LYS  15 -20.960  -2.553  -3.829
  109   1HE   LYS  15          1HE       LYS  15 -20.893  -3.161  -6.589
  110   2HE   LYS  15          2HE       LYS  15 -21.243  -4.691  -5.760
  111   1HZ   LYS  15          1HZ       LYS  15 -22.912  -3.501  -4.435
  112   2HZ   LYS  15          2HZ       LYS  15 -23.275  -3.427  -6.093
  113   3HZ   LYS  15          3HZ       LYS  15 -22.602  -2.080  -5.306
  114    H    ALA  16           H        ALA  16 -15.328  -0.322  -2.564
  115    HA   ALA  16           HA       ALA  16 -15.907   2.392  -3.649
  116   1HB   ALA  16          1HB       ALA  16 -14.188   1.501  -1.310
  117   2HB   ALA  16          2HB       ALA  16 -15.911   1.857  -1.184
  118   3HB   ALA  16          3HB       ALA  16 -14.777   3.134  -1.625
  119    H    ARG  17           H        ARG  17 -13.636   3.747  -3.548
  120    HA   ARG  17           HA       ARG  17 -11.408   2.147  -4.674
  121   1HB   ARG  17          1HB       ARG  17 -11.428   3.505  -6.749
  122   2HB   ARG  17          2HB       ARG  17 -12.937   2.614  -6.552
  123   1HG   ARG  17          1HG       ARG  17 -13.568   4.898  -5.235
  124   2HG   ARG  17          2HG       ARG  17 -12.427   5.537  -6.419
  125   1HD   ARG  17          1HD       ARG  17 -14.095   3.720  -7.826
  126   2HD   ARG  17          2HD       ARG  17 -15.166   4.726  -6.829
  127    HE   ARG  17           HE       ARG  17 -13.934   6.712  -7.815
  128   1HH1  ARG  17          1HH2      ARG  17 -12.119   4.377  -9.092
  129   2HH1  ARG  17          2HH2      ARG  17 -12.486   4.669 -10.760
  130   1HH2  ARG  17          1HH1      ARG  17 -15.153   6.777 -10.078
  131   2HH2  ARG  17          2HH1      ARG  17 -14.204   6.027 -11.318
  132    H    ILE  18           H        ILE  18 -10.408   3.020  -2.667
  133    HA   ILE  18           HA       ILE  18  -9.904   5.953  -2.645
  134    HB   ILE  18           HB       ILE  18  -9.222   3.715  -0.706
  135   1HG1  ILE  18          1HG1      ILE  18 -11.446   5.781  -0.698
  136   2HG1  ILE  18          2HG1      ILE  18 -11.648   4.051  -0.974
  137   1HG2  ILE  18          1HG2      ILE  18  -7.731   5.444  -0.175
  138   2HG2  ILE  18          2HG2      ILE  18  -9.117   5.824   0.847
  139   3HG2  ILE  18          3HG2      ILE  18  -8.867   6.703  -0.661
  140   1HD1  ILE  18          1HD1      ILE  18 -10.635   3.653   1.299
  141   2HD1  ILE  18          2HD1      ILE  18 -12.176   4.509   1.347
  142   3HD1  ILE  18          3HD1      ILE  18 -10.667   5.397   1.560
  143    H    ILE  19           H        ILE  19  -7.651   6.715  -2.478
  144    HA   ILE  19           HA       ILE  19  -5.760   4.936  -3.959
  145    HB   ILE  19           HB       ILE  19  -6.133   7.908  -3.597
  146   1HG1  ILE  19          1HG1      ILE  19  -7.338   6.748  -5.416
  147   2HG1  ILE  19          2HG1      ILE  19  -6.114   7.839  -6.069
  148   1HG2  ILE  19          1HG2      ILE  19  -3.875   8.134  -3.563
  149   2HG2  ILE  19          2HG2      ILE  19  -3.939   7.647  -5.257
  150   3HG2  ILE  19          3HG2      ILE  19  -3.617   6.446  -4.006
  151   1HD1  ILE  19          1HD1      ILE  19  -5.135   6.108  -7.126
  152   2HD1  ILE  19          2HD1      ILE  19  -6.369   5.023  -6.484
  153   3HD1  ILE  19          3HD1      ILE  19  -4.882   5.302  -5.578
  154    H    ARG  20           H        ARG  20  -5.040   3.738  -2.064
  155    HA   ARG  20           HA       ARG  20  -3.830   5.239   0.174
  156   1HB   ARG  20          1HB       ARG  20  -4.256   2.325  -0.526
  157   2HB   ARG  20          2HB       ARG  20  -3.384   2.828   0.922
  158   1HG   ARG  20          1HG       ARG  20  -6.171   3.803   0.244
  159   2HG   ARG  20          2HG       ARG  20  -5.867   2.390   1.255
  160   1HD   ARG  20          1HD       ARG  20  -4.937   3.679   2.986
  161   2HD   ARG  20          2HD       ARG  20  -4.518   5.014   1.895
  162    HE   ARG  20           HE       ARG  20  -6.988   5.459   1.719
  163   1HH1  ARG  20          1HH1      ARG  20  -5.543   4.752   4.633
  164   2HH1  ARG  20          2HH1      ARG  20  -7.007   4.419   5.496
  165   1HH2  ARG  20          1HH2      ARG  20  -9.002   4.470   2.660
  166   2HH2  ARG  20          2HH2      ARG  20  -8.967   4.262   4.379
  167    H    TYR  21           H        TYR  21  -1.557   4.156   0.848
  168    HA   TYR  21           HA       TYR  21   0.187   4.346  -1.581
  169   1HB   TYR  21          1HB       TYR  21   0.500   5.038   1.343
  170   2HB   TYR  21          2HB       TYR  21   1.899   4.917   0.277
  171    HD1  TYR  21           1HD      TYR  21  -1.185   6.782   1.029
  172    HD2  TYR  21           2HD      TYR  21   2.260   6.520  -1.524
  173    HE1  TYR  21           1HE      TYR  21  -1.635   9.071   0.189
  174    HE2  TYR  21           2HE      TYR  21   1.810   8.809  -2.366
  175    HH   TYR  21           HH       TYR  21  -0.711  10.284  -2.416
  176    H    PHE  22           H        PHE  22   1.984   2.888  -1.734
  177    HA   PHE  22           HA       PHE  22   2.201   0.669   0.208
  178   1HB   PHE  22          1HB       PHE  22   1.522  -1.015  -1.289
  179   2HB   PHE  22          2HB       PHE  22   0.376   0.273  -1.615
  180    HD1  PHE  22           1HD      PHE  22   3.327  -1.536  -2.854
  181    HD2  PHE  22           2HD      PHE  22   0.484   1.578  -3.683
  182    HE1  PHE  22           1HE      PHE  22   4.069  -1.491  -5.220
  183    HE2  PHE  22           2HE      PHE  22   1.223   1.626  -6.050
  184    HZ   PHE  22           HZ       PHE  22   3.022   0.090  -6.817
  185    H    TYR  23           H        TYR  23   4.147  -0.661  -0.292
  186    HA   TYR  23           HA       TYR  23   6.281   1.040  -1.471
  187   1HB   TYR  23          1HB       TYR  23   6.501  -0.016   0.763
  188   2HB   TYR  23          2HB       TYR  23   6.357  -1.609   0.012
  189    HD1  TYR  23           1HD      TYR  23   8.294  -2.703  -0.712
  190    HD2  TYR  23           2HD      TYR  23   8.347   1.569  -0.254
  191    HE1  TYR  23           1HE      TYR  23  10.709  -2.674  -1.271
  192    HE2  TYR  23           2HE      TYR  23  10.764   1.599  -0.815
  193    HH   TYR  23           HH       TYR  23  12.333  -0.140  -2.266
  194    H    ASN  24           H        ASN  24   6.677   0.750  -3.650
  195    HA   ASN  24           HA       ASN  24   6.068  -1.837  -4.966
  196   1HB   ASN  24          1HB       ASN  24   5.558   0.528  -5.835
  197   2HB   ASN  24          2HB       ASN  24   7.289   0.671  -6.140
  198   1HD2  ASN  24          1HD2      ASN  24   6.072   0.836  -8.459
  199   2HD2  ASN  24          2HD2      ASN  24   5.995  -0.630  -9.311
  200    H    ALA  25           H        ALA  25   7.749  -3.282  -4.299
  201    HA   ALA  25           HA       ALA  25  10.471  -2.705  -3.898
  202   1HB   ALA  25          1HB       ALA  25  10.646  -5.189  -4.776
  203   2HB   ALA  25          2HB       ALA  25   8.885  -5.089  -4.814
  204   3HB   ALA  25          3HB       ALA  25   9.751  -4.846  -3.297
  205    H    LYS  26           H        LYS  26   8.680  -2.772  -6.870
  206    HA   LYS  26           HA       LYS  26  11.076  -3.069  -8.566
  207   1HB   LYS  26          1HB       LYS  26   8.165  -2.430  -9.146
  208   2HB   LYS  26          2HB       LYS  26   9.381  -2.802 -10.368
  209   1HG   LYS  26          1HG       LYS  26   9.551  -4.862  -8.438
  210   2HG   LYS  26          2HG       LYS  26   7.831  -4.618  -8.741
  211   1HD   LYS  26          1HD       LYS  26   9.094  -4.488 -11.265
  212   2HD   LYS  26          2HD       LYS  26   9.814  -5.867 -10.433
  213   1HE   LYS  26          1HE       LYS  26   7.010  -5.932  -9.899
  214   2HE   LYS  26          2HE       LYS  26   7.217  -5.692 -11.645
  215   1HZ   LYS  26          1HZ       LYS  26   8.687  -7.697 -10.004
  216   2HZ   LYS  26          2HZ       LYS  26   8.781  -7.512 -11.691
  217   3HZ   LYS  26          3HZ       LYS  26   7.341  -8.058 -10.972
  218    H    ALA  27           H        ALA  27   9.257  -0.522  -7.061
  219    HA   ALA  27           HA       ALA  27  10.338   1.542  -8.915
  220   1HB   ALA  27          1HB       ALA  27   8.699   2.145  -6.486
  221   2HB   ALA  27          2HB       ALA  27   7.928   1.253  -7.797
  222   3HB   ALA  27          3HB       ALA  27   8.607   2.851  -8.101
  223    H    GLY  28           H        GLY  28  10.717   0.331  -5.619
  224   1HA   GLY  28          1HA       GLY  28  12.735   0.617  -4.337
  225   2HA   GLY  28          2HA       GLY  28  13.154   1.994  -5.356
  226    H    LEU  29           H        LEU  29  10.010   2.523  -4.742
  227    HA   LEU  29           HA       LEU  29  10.389   3.703  -2.038
  228   1HB   LEU  29          1HB       LEU  29   9.571   5.874  -2.914
  229   2HB   LEU  29          2HB       LEU  29  11.059   5.384  -3.722
  230    HG   LEU  29           HG       LEU  29   8.656   4.352  -5.047
  231   1HD1  LEU  29          1HD1      LEU  29   8.850   7.222  -4.318
  232   2HD1  LEU  29          2HD1      LEU  29   7.434   6.261  -4.739
  233   3HD1  LEU  29          3HD1      LEU  29   8.482   6.888  -6.011
  234   1HD2  LEU  29          1HD2      LEU  29  11.074   4.470  -5.882
  235   2HD2  LEU  29          2HD2      LEU  29  10.814   6.201  -6.091
  236   3HD2  LEU  29          3HD2      LEU  29   9.846   5.047  -7.005
  237    H    CYS  30           H        CYS  30   7.855   5.248  -2.567
  238    HA   CYS  30           HA       CYS  30   5.943   2.936  -2.457
  239   1HB   CYS  30          1HB       CYS  30   6.121   5.535  -0.921
  240   2HB   CYS  30          2HB       CYS  30   4.690   4.507  -0.885
  241    H    GLN  31           H        GLN  31   3.888   3.266  -3.414
  242    HA   GLN  31           HA       GLN  31   3.494   5.797  -4.950
  243   1HB   GLN  31          1HB       GLN  31   3.260   2.955  -5.993
  244   2HB   GLN  31          2HB       GLN  31   2.932   4.419  -6.923
  245   1HG   GLN  31          1HG       GLN  31   5.378   5.072  -6.136
  246   2HG   GLN  31          2HG       GLN  31   5.553   3.329  -5.946
  247   1HE2  GLN  31          1HE2      GLN  31   7.131   4.492  -7.898
  248   2HE2  GLN  31          2HE2      GLN  31   6.532   4.129  -9.444
  249    H    THR  32           H        THR  32   1.103   5.567  -5.986
  250    HA   THR  32           HA       THR  32  -0.645   4.851  -3.688
  251    HB   THR  32           HB       THR  32  -2.255   6.182  -5.333
  252    HG1  THR  32           1HG      THR  32  -1.256   7.207  -6.883
  253   1HG2  THR  32          1HG2      THR  32  -1.236   8.328  -4.386
  254   2HG2  THR  32          2HG2      THR  32   0.004   7.299  -3.670
  255   3HG2  THR  32          3HG2      THR  32  -1.686   7.094  -3.210
  256    H    PHE  33           H        PHE  33  -2.359   3.414  -3.894
  257    HA   PHE  33           HA       PHE  33  -2.782   2.105  -6.543
  258   1HB   PHE  33          1HB       PHE  33  -2.552  -0.061  -5.590
  259   2HB   PHE  33          2HB       PHE  33  -1.199   0.858  -4.953
  260    HD1  PHE  33           1HD      PHE  33  -4.332  -0.842  -4.164
  261    HD2  PHE  33           2HD      PHE  33  -1.232   1.687  -2.594
  262    HE1  PHE  33           1HE      PHE  33  -5.074  -1.362  -1.859
  263    HE2  PHE  33           2HE      PHE  33  -1.978   1.174  -0.291
  264    HZ   PHE  33           HZ       PHE  33  -3.898  -0.357   0.080
  265    H    VAL  34           H        VAL  34  -4.922   1.058  -6.657
  266    HA   VAL  34           HA       VAL  34  -6.977   2.648  -5.350
  267    HB   VAL  34           HB       VAL  34  -7.100   0.148  -7.065
  268   1HG1  VAL  34          1HG1      VAL  34  -9.306   0.207  -6.594
  269   2HG1  VAL  34          2HG1      VAL  34  -9.371   1.747  -7.452
  270   3HG1  VAL  34          3HG1      VAL  34  -9.132   1.720  -5.705
  271   1HG2  VAL  34          1HG2      VAL  34  -6.859   1.493  -8.890
  272   2HG2  VAL  34          2HG2      VAL  34  -6.108   2.613  -7.754
  273   3HG2  VAL  34          3HG2      VAL  34  -7.812   2.792  -8.172
  274    H    TYR  35           H        TYR  35  -7.060   2.243  -3.114
  275    HA   TYR  35           HA       TYR  35  -6.986  -0.471  -2.032
  276   1HB   TYR  35          1HB       TYR  35  -6.113   1.437  -0.797
  277   2HB   TYR  35          2HB       TYR  35  -7.674   2.256  -0.888
  278    HD1  TYR  35           1HD      TYR  35  -7.283  -1.379  -0.366
  279    HD2  TYR  35           2HD      TYR  35  -8.061   2.408   1.502
  280    HE1  TYR  35           1HE      TYR  35  -8.025  -2.546   1.691
  281    HE2  TYR  35           2HE      TYR  35  -8.802   1.241   3.562
  282    HH   TYR  35           HH       TYR  35  -8.618  -0.840   4.657
  283    H    GLY  36           H        GLY  36  -8.789  -1.712  -1.385
  284   1HA   GLY  36          1HA       GLY  36 -11.393  -0.894  -2.476
  285   2HA   GLY  36          2HA       GLY  36 -11.023  -2.455  -1.746
  286    H    ALA  37           H        ALA  37  -9.863  -0.030   0.247
  287    HA   ALA  37           HA       ALA  37 -10.710   1.035   2.190
  288   1HB   ALA  37          1HB       ALA  37 -12.977   1.613   2.182
  289   2HB   ALA  37          2HB       ALA  37 -13.462   0.088   1.442
  290   3HB   ALA  37          3HB       ALA  37 -12.677   1.328   0.467
  291    H    CYS  38           H        CYS  38 -10.781  -2.235   1.520
  292    HA   CYS  38           HA       CYS  38 -11.233  -2.860   4.394
  293   1HB   CYS  38          1HB       CYS  38 -12.781  -4.723   3.664
  294   2HB   CYS  38          2HB       CYS  38 -13.420  -3.102   3.389
  295    H    ARG  39           H        ARG  39 -10.794  -5.344   4.697
  296    HA   ARG  39           HA       ARG  39  -9.040  -6.943   4.698
  297   1HB   ARG  39          1HB       ARG  39 -10.595  -6.873   2.333
  298   2HB   ARG  39          2HB       ARG  39  -8.932  -7.158   1.819
  299   1HG   ARG  39          1HG       ARG  39  -9.043  -9.287   2.546
  300   2HG   ARG  39          2HG       ARG  39  -9.483  -8.735   4.163
  301   1HD   ARG  39          1HD       ARG  39 -11.843  -8.349   2.818
  302   2HD   ARG  39          2HD       ARG  39 -11.207  -9.790   2.001
  303    HE   ARG  39           HE       ARG  39 -11.134 -10.910   4.176
  304   1HH1  ARG  39          1HH1      ARG  39 -13.778  -9.128   3.878
  305   2HH1  ARG  39          2HH1      ARG  39 -13.965  -8.674   5.539
  306   1HH2  ARG  39          1HH2      ARG  39 -10.790  -9.723   6.459
  307   2HH2  ARG  39          2HH2      ARG  39 -12.273  -9.011   7.001
  308    H    ALA  40           H        ALA  40  -7.957  -4.323   4.831
  309    HA   ALA  40           HA       ALA  40  -5.887  -4.039   2.764
  310   1HB   ALA  40          1HB       ALA  40  -6.719  -2.618   5.287
  311   2HB   ALA  40          2HB       ALA  40  -6.729  -2.020   3.628
  312   3HB   ALA  40          3HB       ALA  40  -5.201  -2.205   4.488
  313    H    LYS  41           H        LYS  41  -3.769  -4.698   2.959
  314    HA   LYS  41           HA       LYS  41  -3.023  -6.236   5.413
  315   1HB   LYS  41          1HB       LYS  41  -1.834  -6.110   2.619
  316   2HB   LYS  41          2HB       LYS  41  -1.313  -7.207   3.897
  317   1HG   LYS  41          1HG       LYS  41  -3.187  -8.535   3.704
  318   2HG   LYS  41          2HG       LYS  41  -4.218  -7.190   3.211
  319   1HD   LYS  41          1HD       LYS  41  -3.933  -7.767   1.051
  320   2HD   LYS  41          2HD       LYS  41  -2.192  -7.545   1.220
  321   1HE   LYS  41          1HE       LYS  41  -1.836  -9.793   1.254
  322   2HE   LYS  41          2HE       LYS  41  -3.126 -10.044   2.447
  323   1HZ   LYS  41          1HZ       LYS  41  -3.723 -11.037   0.322
  324   2HZ   LYS  41          2HZ       LYS  41  -3.488  -9.551  -0.470
  325   3HZ   LYS  41          3HZ       LYS  41  -4.748  -9.728   0.655
  326    H    ARG  42           H        ARG  42  -0.237  -6.067   5.181
  327    HA   ARG  42           HA       ARG  42   0.309  -3.475   6.349
  328   1HB   ARG  42          1HB       ARG  42   2.360  -5.373   5.211
  329   2HB   ARG  42          2HB       ARG  42   2.489  -4.353   6.639
  330   1HG   ARG  42          1HG       ARG  42   0.396  -5.839   7.407
  331   2HG   ARG  42          2HG       ARG  42   1.147  -6.998   6.309
  332   1HD   ARG  42          1HD       ARG  42   3.231  -5.826   7.882
  333   2HD   ARG  42          2HD       ARG  42   1.940  -6.348   8.983
  334    HE   ARG  42           HE       ARG  42   3.215  -8.125   6.925
  335   1HH1  ARG  42          1HH2      ARG  42   0.453  -8.527   8.432
  336   2HH1  ARG  42          2HH2      ARG  42   0.937  -9.751   9.558
  337   1HH2  ARG  42          1HH1      ARG  42   4.328  -9.296   9.008
  338   2HH2  ARG  42          2HH1      ARG  42   3.129 -10.186   9.884
  339    H    ASN  43           H        ASN  43   0.107  -4.593   3.116
  340    HA   ASN  43           HA       ASN  43   1.902  -2.482   2.040
  341   1HB   ASN  43          1HB       ASN  43   1.577  -4.994   1.285
  342   2HB   ASN  43          2HB       ASN  43   0.181  -4.349   0.422
  343   1HD2  ASN  43          1HD2      ASN  43   3.731  -4.041   0.730
  344   2HD2  ASN  43          2HD2      ASN  43   3.967  -3.319  -0.789
  345    H    ASN  44           H        ASN  44  -0.089  -1.219   3.333
  346    HA   ASN  44           HA       ASN  44  -1.631   0.078   1.182
  347   1HB   ASN  44          1HB       ASN  44  -3.010  -1.863   1.667
  348   2HB   ASN  44          2HB       ASN  44  -2.860  -1.596   3.401
  349   1HD2  ASN  44          1HD2      ASN  44  -5.392  -1.720   1.969
  350   2HD2  ASN  44          2HD2      ASN  44  -6.143  -0.197   2.136
  351    H    PHE  45           H        PHE  45  -0.165   1.784   2.123
  352    HA   PHE  45           HA       PHE  45  -0.767   2.662   4.885
  353   1HB   PHE  45          1HB       PHE  45   1.062   3.923   2.827
  354   2HB   PHE  45          2HB       PHE  45   1.177   4.028   4.583
  355    HD1  PHE  45           1HD      PHE  45   2.027   2.095   1.627
  356    HD2  PHE  45           2HD      PHE  45   1.736   1.940   5.913
  357    HE1  PHE  45           1HE      PHE  45   3.439   0.057   1.648
  358    HE2  PHE  45           2HE      PHE  45   3.153  -0.098   5.933
  359    HZ   PHE  45           HZ       PHE  45   3.999  -1.049   3.799
  360    H    LYS  46           H        LYS  46  -1.559   4.791   5.354
  361    HA   LYS  46           HA       LYS  46  -3.561   5.789   3.476
  362   1HB   LYS  46          1HB       LYS  46  -4.118   5.812   5.779
  363   2HB   LYS  46          2HB       LYS  46  -2.554   6.483   6.238
  364   1HG   LYS  46          1HG       LYS  46  -3.879   8.268   4.395
  365   2HG   LYS  46          2HG       LYS  46  -4.951   7.902   5.745
  366   1HD   LYS  46          1HD       LYS  46  -2.153   8.412   6.525
  367   2HD   LYS  46          2HD       LYS  46  -2.966   9.801   5.803
  368   1HE   LYS  46          1HE       LYS  46  -3.864  10.145   7.872
  369   2HE   LYS  46          2HE       LYS  46  -4.880   8.728   7.543
  370   1HZ   LYS  46          1HZ       LYS  46  -3.006   7.338   8.337
  371   2HZ   LYS  46          2HZ       LYS  46  -3.625   8.352   9.552
  372   3HZ   LYS  46          3HZ       LYS  46  -2.166   8.746   8.774
  373    H    SER  47           H        SER  47  -0.270   6.589   4.323
  374    HA   SER  47           HA       SER  47  -0.338   8.831   2.350
  375   1HB   SER  47          1HB       SER  47   0.765  10.293   3.938
  376   2HB   SER  47          2HB       SER  47  -0.670   9.636   4.719
  377    HG   SER  47           HG       SER  47   0.688   9.041   6.196
  378    H    ALA  48           H        ALA  48   1.870   9.397   1.607
  379    HA   ALA  48           HA       ALA  48   3.507   7.080   1.103
  380   1HB   ALA  48          1HB       ALA  48   3.632   8.727  -0.537
  381   2HB   ALA  48          2HB       ALA  48   5.086   9.106   0.387
  382   3HB   ALA  48          3HB       ALA  48   3.610  10.039   0.640
  383    H    GLU  49           H        GLU  49   3.421   9.438   3.660
  384    HA   GLU  49           HA       GLU  49   6.167   9.133   4.557
  385   1HB   GLU  49          1HB       GLU  49   3.709  10.537   5.260
  386   2HB   GLU  49          2HB       GLU  49   4.563   9.965   6.694
  387   1HG   GLU  49          1HG       GLU  49   6.391  11.093   4.722
  388   2HG   GLU  49          2HG       GLU  49   5.163  12.260   5.215
  389    H    ASP  50           H        ASP  50   3.156   7.404   5.119
  390    HA   ASP  50           HA       ASP  50   4.164   5.945   7.463
  391   1HB   ASP  50          1HB       ASP  50   1.718   5.900   5.696
  392   2HB   ASP  50          2HB       ASP  50   1.985   4.623   6.882
  393    H    CYS  51           H        CYS  51   3.914   5.487   3.990
  394    HA   CYS  51           HA       CYS  51   4.609   2.641   4.018
  395   1HB   CYS  51          1HB       CYS  51   3.244   3.715   2.268
  396   2HB   CYS  51          2HB       CYS  51   4.586   4.786   1.863
  397    H    MET  52           H        MET  52   6.300   5.707   3.260
  398    HA   MET  52           HA       MET  52   8.837   4.519   2.606
  399   1HB   MET  52          1HB       MET  52   7.796   7.222   3.418
  400   2HB   MET  52          2HB       MET  52   9.536   6.969   3.270
  401   1HG   MET  52          1HG       MET  52   8.574   5.783   0.975
  402   2HG   MET  52          2HG       MET  52   7.476   7.149   1.174
  403   1HE   MET  52          1HE       MET  52   9.787   5.921  -0.566
  404   2HE   MET  52          2HE       MET  52  11.389   6.325   0.047
  405   3HE   MET  52          3HE       MET  52  10.702   7.254  -1.282
  406    H    ARG  53           H        ARG  53   7.606   5.986   5.632
  407    HA   ARG  53           HA       ARG  53   9.975   5.569   7.186
  408   1HB   ARG  53          1HB       ARG  53   8.189   7.097   7.824
  409   2HB   ARG  53          2HB       ARG  53   7.030   5.769   7.894
  410   1HG   ARG  53          1HG       ARG  53   7.886   4.953   9.885
  411   2HG   ARG  53          2HG       ARG  53   9.507   5.571   9.563
  412   1HD   ARG  53          1HD       ARG  53   8.506   6.910  11.350
  413   2HD   ARG  53          2HD       ARG  53   8.576   7.912   9.886
  414    HE   ARG  53           HE       ARG  53   6.132   6.725   9.624
  415   1HH1  ARG  53          1HH2      ARG  53   6.566   6.441  12.719
  416   2HH1  ARG  53          2HH2      ARG  53   5.609   7.777  13.266
  417   1HH2  ARG  53          1HH1      ARG  53   5.378   9.238  10.128
  418   2HH2  ARG  53          2HH1      ARG  53   4.935   9.361  11.799
  419    H    THR  54           H        THR  54   7.277   3.463   6.350
  420    HA   THR  54           HA       THR  54   7.841   1.420   8.337
  421    HB   THR  54           HB       THR  54   6.253   1.605   5.770
  422    HG1  THR  54           1HG      THR  54   4.558   1.619   7.199
  423   1HG2  THR  54          1HG2      THR  54   5.367  -0.659   7.113
  424   2HG2  THR  54          2HG2      THR  54   7.124  -0.782   7.215
  425   3HG2  THR  54          3HG2      THR  54   6.339  -0.648   5.642
  426    H    CYS  55           H        CYS  55   8.456   1.646   4.809
  427    HA   CYS  55           HA       CYS  55  10.568  -0.467   5.153
  428   1HB   CYS  55          1HB       CYS  55   8.751   0.228   2.825
  429   2HB   CYS  55          2HB       CYS  55  10.012  -1.005   2.772
  430    H    GLY  56           H        GLY  56   9.673   2.482   3.338
  431   1HA   GLY  56          1HA       GLY  56  11.084   4.224   2.590
  432   2HA   GLY  56          2HA       GLY  56  12.434   3.414   3.388
  433    H    GLY  57           H        GLY  57  13.268   1.427   2.244
  434   1HA   GLY  57          1HA       GLY  57  13.563   0.142   0.215
  435   2HA   GLY  57          2HA       GLY  57  12.704   1.400  -0.673
  436    H    ALA  58           H        ALA  58  14.574   1.315  -2.169
  437    HA   ALA  58           HA       ALA  58  16.582   2.247  -3.001
  438   1HB   ALA  58          1HB       ALA  58  16.725   4.453  -2.418
  439   2HB   ALA  58          2HB       ALA  58  16.809   4.087  -0.694
  440   3HB   ALA  58          3HB       ALA  58  15.248   4.117  -1.515