*HEADER    BLOOD CLOTTING                          28-AUG-01   1JV9              
*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, MINIMIZED AVERAGE           
*KEYWDS   2 STRUCTURE                                                            
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                                      
*AUTHOR    J.L.BATTISTE, R.LI, C.WOODWARD                                        
*REVDAT   1   12-SEP-01 1JV9    0                                                
assi ( resi   1 and name HA   ) ( resi   2 and name HD1  ) 0 0 2.5
assi ( resi   1 and name HA   ) ( resi   2 and name HD2  ) 0 0 2.5
assi ( resi   1 and name HB*  ) ( resi   2 and name HD1  ) 0 0 3.0
assi ( resi   1 and name HD*  ) ( resi   6 and name HD1* ) 0 0 5.0
assi ( resi   1 and name HD*  ) ( resi   6 and name HD2* ) 0 0 4.0
assi ( resi   1 and name HD*  ) ( resi  23 and name HE*  ) 0 0 4.0
assi ( resi   1 and name HB*  ) ( resi  55 and name HA   ) 0 0 5.0
assi ( resi   1 and name HG*  ) ( resi  55 and name HA   ) 0 0 5.0
assi ( resi   2 and name HB1  ) ( resi   4 and name HD*  ) 0 0 5.0
assi ( resi   2 and name HB1  ) ( resi   4 and name HE*  ) 0 0 5.0
assi ( resi   2 and name HB2  ) ( resi   4 and name HD*  ) 0 0 5.0
assi ( resi   2 and name HB2  ) ( resi   4 and name HE*  ) 0 0 5.0
assi ( resi   2 and name HD1  ) ( resi  55 and name HA   ) 0 0 4.0
assi ( resi   3 and name HA   ) ( resi   6 and name HD1* ) 0 0 4.0
assi ( resi   3 and name HA   ) ( resi   6 and name HD2* ) 0 0 5.0
assi ( resi   3 and name HA   ) ( resi   6 and name HG   ) 0 0 4.0
assi ( resi   3 and name HA   ) ( resi   6 and name HB*  ) 0 0 4.0
assi ( resi   4 and name HD*  ) ( resi   5 and name HA   ) 0 0 5.0
assi ( resi   4 and name HZ   ) ( resi  42 and name HB1  ) 0 0 5.0
assi ( resi   4 and name HB1  ) ( resi  42 and name HB1  ) 0 0 4.0
assi ( resi   4 and name HB1  ) ( resi  42 and name HB2  ) 0 0 5.0
assi ( resi   4 and name HD*  ) ( resi  42 and name HB1  ) 0 0 5.0
assi ( resi   4 and name HD*  ) ( resi  42 and name HB2  ) 0 0 5.0
assi ( resi   4 and name HD*  ) ( resi  42 and name HD*  ) 0 0 5.0
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 5.0
assi ( resi   4 and name HE*  ) ( resi  43 and name HA   ) 0 0 5.0
assi ( resi   4 and name HD*  ) ( resi  45 and name HZ   ) 0 0 3.0
assi ( resi   4 and name HE*  ) ( resi  45 and name HZ   ) 0 0 2.5
assi ( resi   4 and name HE*  ) ( resi  54 and name HG2* ) 0 0 3.0
assi ( resi   4 and name HZ   ) ( resi  54 and name HG2* ) 0 0 3.0
assi ( resi   5 and name HB*  ) ( resi   6 and name HD2* ) 0 0 5.0
assi ( resi   5 and name HB*  ) ( resi   6 and name HD1* ) 0 0 5.0
assi ( resi   5 and name HB*  ) ( resi  55 and name HB*  ) 0 0 3.0
assi ( resi   6 and name HA   ) ( resi   6 and name HD1* ) 0 0 5.0
assi ( resi   6 and name HA   ) ( resi   6 and name HD2* ) 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 5.0
assi ( resi   6 and name HA   ) ( resi  25 and name HB*  ) 0 0 3.0
assi ( resi   6 and name HD2* ) ( resi  25 and name HB*  ) 0 0 3.0
assi ( resi   7 and name HA   ) ( resi   8 and name HD*  ) 0 0 2.5
assi ( resi   8 and name HB1  ) ( resi   9 and name HD1  ) 0 0 4.0
assi ( resi   8 and name HB2  ) ( resi   9 and name HD1  ) 0 0 4.0
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 5.0
assi ( resi   9 and name HB1  ) ( resi  33 and name HD*  ) 0 0 5.0
assi ( resi  10 and name HE*  ) ( resi  12 and name HA1  ) 0 0 5.0
assi ( resi  10 and name HE*  ) ( resi  12 and name HA2  ) 0 0 5.0
assi ( resi  10 and name HE*  ) ( resi  13 and name HD*  ) 0 0 5.0
assi ( resi  10 and name HE*  ) ( resi  39 and name HB*  ) 0 0 3.0
assi ( resi  10 and name HD*  ) ( resi  40 and name HA   ) 0 0 5.0
assi ( resi  10 and name HB*  ) ( resi  41 and name HB1  ) 0 0 4.0
assi ( resi  10 and name HB*  ) ( resi  41 and name HD*  ) 0 0 3.0
assi ( resi  10 and name HD*  ) ( resi  41 and name HD*  ) 0 0 3.0
assi ( resi  11 and name HA   ) ( resi  33 and name HD*  ) 0 0 5.0
assi ( resi  11 and name HA   ) ( resi  33 and name HE*  ) 0 0 3.0
assi ( resi  11 and name HA   ) ( resi  35 and name HA   ) 0 0 2.5
assi ( resi  11 and name HG2* ) ( resi  35 and name HA   ) 0 0 4.0
assi ( resi  11 and name HG2* ) ( resi  36 and name HA*  ) 0 0 5.0
assi ( resi  12 and name HA1  ) ( resi  13 and name HD*  ) 0 0 2.5
assi ( resi  13 and name HB*  ) ( resi  39 and name HD*  ) 0 0 5.0
assi ( resi  13 and name HD*  ) ( resi  39 and name HB*  ) 0 0 4.0
assi ( resi  16 and name HB*  ) ( resi  18 and name HD1* ) 0 0 4.0
assi ( resi  16 and name HB*  ) ( resi  36 and name HA*  ) 0 0 4.0
assi ( resi  17 and name HA   ) ( resi  34 and name HG1* ) 0 0 2.5
assi ( resi  18 and name HG2* ) ( resi  20 and name HD*  ) 0 0 5.0
assi ( resi  18 and name HB   ) ( resi  35 and name HB2  ) 0 0 4.0
assi ( resi  18 and name HD1* ) ( resi  35 and name HE*  ) 0 0 5.0
assi ( resi  18 and name HD1* ) ( resi  37 and name HA   ) 0 0 5.0
assi ( resi  18 and name HD1* ) ( resi  37 and name HB*  ) 0 0 3.0
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 5.0
assi ( resi  19 and name HD1* ) ( resi  32 and name HB   ) 0 0 4.0
assi ( resi  19 and name HG2* ) ( resi  32 and name HA   ) 0 0 4.0
assi ( resi  19 and name HG2* ) ( resi  32 and name HB   ) 0 0 2.5
assi ( resi  19 and name HG2* ) ( resi  33 and name HA   ) 0 0 5.0
assi ( resi  19 and name HA   ) ( resi  34 and name HA   ) 0 0 4.0
assi ( resi  19 and name HD1* ) ( resi  34 and name HA   ) 0 0 5.0
assi ( resi  20 and name HA   ) ( resi  21 and name HD*  ) 0 0 5.0
assi ( resi  20 and name HB1  ) ( resi  33 and name HE*  ) 0 0 5.0
assi ( resi  20 and name HB2  ) ( resi  33 and name HE*  ) 0 0 5.0
assi ( resi  20 and name HG*  ) ( resi  35 and name HB*  ) 0 0 4.0
assi ( resi  20 and name HD*  ) ( resi  46 and name HA   ) 0 0 3.0
assi ( resi  21 and name HD*  ) ( resi  30 and name HB1  ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  31 and name HA   ) 0 0 5.0
assi ( resi  21 and name HA   ) ( resi  32 and name HA   ) 0 0 2.5
assi ( resi  21 and name HA   ) ( resi  32 and name HG2* ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  32 and name HA   ) 0 0 5.0
assi ( resi  21 and name HD*  ) ( resi  32 and name HG2* ) 0 0 4.0
assi ( resi  21 and name HE*  ) ( resi  32 and name HG2* ) 0 0 3.0
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 5.0
assi ( resi  21 and name HD*  ) ( 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 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 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
assi ( resi  22 and name HE*  ) ( resi  31 and name HB1  ) 0 0 4.0
assi ( resi  22 and name HB2  ) ( resi  33 and name HD*  ) 0 0 3.0
assi ( resi  22 and name HD*  ) ( resi  33 and name HB2  ) 0 0 5.0
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
assi ( resi  23 and name HE*  ) ( resi  25 and name HB*  ) 0 0 3.0
assi ( resi  23 and name HE*  ) ( resi  28 and name HA1  ) 0 0 5.0
assi ( resi  23 and name HE*  ) ( resi  29 and name HA   ) 0 0 4.0
assi ( resi  23 and name HA   ) ( resi  30 and name HA   ) 0 0 2.5
assi ( resi  23 and name HE*  ) ( resi  52 and name HE*  ) 0 0 5.0
assi ( resi  23 and name HB1  ) ( resi  55 and name HB*  ) 0 0 3.0
assi ( resi  23 and name HE*  ) ( resi  56 and name HA*  ) 0 0 4.0
assi ( resi  24 and name HA   ) ( resi  25 and name HB*  ) 0 0 5.0
assi ( resi  24 and name HB1  ) ( resi  27 and name HB*  ) 0 0 5.0
assi ( resi  24 and name HB2  ) ( resi  27 and name HB*  ) 0 0 3.0
assi ( resi  27 and name HB*  ) ( resi  29 and name HD1* ) 0 0 5.0
assi ( resi  29 and name HA   ) ( resi  29 and name HD1* ) 0 0 4.0
assi ( resi  29 and name HA   ) ( resi  29 and name HD2* ) 0 0 5.0
assi ( resi  29 and name HD1* ) ( resi  31 and name HG*  ) 0 0 5.0
assi ( resi  30 and name HB1  ) ( resi  48 and name HA   ) 0 0 5.0
assi ( resi  31 and name HA   ) ( resi  32 and name HG2* ) 0 0 5.0
assi ( resi  32 and name HA   ) ( resi  33 and name HD*  ) 0 0 5.0
assi ( resi  32 and name HB   ) ( resi  33 and name HA   ) 0 0 5.0
assi ( resi  33 and name HA   ) ( resi  34 and name HA   ) 0 0 5.0
assi ( resi  33 and name HA   ) ( resi  34 and name HG2* ) 0 0 4.0
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 5.0
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 5.0
assi ( resi  33 and name HZ   ) ( resi  44 and name HB1  ) 0 0 4.0
assi ( resi  34 and name HG1* ) ( resi  35 and name HA   ) 0 0 5.0
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 5.0
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 4.0
assi ( resi  43 and name HA   ) ( resi  45 and name HZ   ) 0 0 5.0
assi ( resi  45 and name HB2  ) ( resi  50 and name HB*  ) 0 0 3.0
assi ( resi  45 and name HB2  ) ( resi  51 and name HB1  ) 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  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
assi ( resi  49 and name HA   ) ( resi  52 and name HB2  ) 0 0 5.0
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
assi ( resi  11 and name HA   ) ( resi  35 and name HD1  ) 0 0 4.0
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
assi ( resi  35 and name HE2  ) ( resi  37 and name HA   ) 0 0 3.0
assi ( resi  35 and name HD1  ) ( resi  40 and name HA   ) 0 0 5.0
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
assi ( resi  35 and name HE2  ) ( resi  40 and name HB*  ) 0 0 5.0
assi ( resi  43 and name HA   ) ( resi  45 and name HE*  ) 0 0 4.0
assi ( resi  45 and name HE*  ) ( resi  54 and name HB   ) 0 0 4.0
assi ( resi  45 and name HE*  ) ( resi  54 and name HG2* ) 0 0 3.0
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
assi ( resi   1 and name HD*  ) ( resi  23 and name HE*  ) 0 0 3.0
assi ( resi   1 and name HE   ) ( resi  23 and name HE*  ) 0 0 4.0
assi ( resi   2 and name HA   ) ( resi   3 and name HN   ) 0 0 2.5
assi ( resi   2 and name HB1  ) ( resi   3 and name HN   ) 0 0 4.0
assi ( resi   2 and name HB2  ) ( resi   3 and name HN   ) 0 0 4.0
assi ( resi   2 and name HA   ) ( resi   4 and name HN   ) 0 0 4.0
assi ( resi   2 and name HB1  ) ( resi   4 and name HD*  ) 0 0 4.0
assi ( resi   2 and name HB1  ) ( resi   4 and name HE*  ) 0 0 4.0
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
assi ( resi   2 and name HB2  ) ( resi   4 and name HD*  ) 0 0 4.0
assi ( resi   2 and name HB2  ) ( resi   4 and name HE*  ) 0 0 4.0
assi ( resi   2 and name HB2  ) ( resi   4 and name HN   ) 0 0 4.0
assi ( resi   2 and name HB1  ) ( resi   5 and name HN   ) 0 0 4.0
assi ( resi   3 and name HA   ) ( resi   4 and name HN   ) 0 0 4.0
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
assi ( resi   3 and name HN   ) ( resi   4 and name HN   ) 0 0 4.0
assi ( resi   3 and name HA   ) ( resi   5 and name HN   ) 0 0 4.0
assi ( resi   3 and name HN   ) ( resi   5 and name HN   ) 0 0 5.0
assi ( resi   3 and name HA   ) ( resi   6 and name HN   ) 0 0 4.0
assi ( resi   3 and name HN   ) ( resi   6 and name HD1* ) 0 0 5.0
assi ( resi   4 and name HA   ) ( resi   5 and name HN   ) 0 0 4.0
assi ( resi   4 and name HD*  ) ( resi   5 and name HA   ) 0 0 4.0
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
assi ( resi   4 and name HN   ) ( resi   6 and name HN   ) 0 0 5.0
assi ( resi   4 and name HB1  ) ( resi  42 and name HE   ) 0 0 4.0
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
assi ( resi   4 and name HD*  ) ( resi  42 and name HB2  ) 0 0 4.0
assi ( resi   4 and name HD*  ) ( resi  42 and name HD*  ) 0 0 3.0
assi ( resi   4 and name HE*  ) ( resi  42 and name HB2  ) 0 0 5.0
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
assi ( resi  10 and name HA   ) ( resi  11 and name HN   ) 0 0 2.5
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
assi ( resi  10 and name HD*  ) ( resi  12 and name HA1  ) 0 0 4.0
assi ( resi  10 and name HD*  ) ( resi  12 and name HA2  ) 0 0 5.0
assi ( resi  10 and name HE*  ) ( resi  12 and name HA1  ) 0 0 4.0
assi ( resi  10 and name HE*  ) ( resi  12 and name HA2  ) 0 0 4.0
assi ( resi  10 and name HE*  ) ( resi  13 and name HD*  ) 0 0 4.0
assi ( resi  10 and name HN   ) ( resi  33 and name HD*  ) 0 0 4.0
assi ( resi  10 and name HD*  ) ( resi  39 and name HB*  ) 0 0 4.0
assi ( resi  10 and name HE*  ) ( resi  39 and name HB*  ) 0 0 3.0
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
    1   1H    ARG   1          1H        ARG   1  14.175  -5.210   6.609
    2   2H    ARG   1          2H        ARG   1  14.969  -3.981   5.745
    3   3H    ARG   1          3H        ARG   1  14.684  -5.489   5.016
    4    HA   ARG   1           HA       ARG   1  12.664  -3.437   5.747
    5   1HB   ARG   1          1HB       ARG   1  13.504  -2.796   3.703
    6   2HB   ARG   1          2HB       ARG   1  14.113  -4.406   3.335
    7   1HG   ARG   1          1HG       ARG   1  12.119  -5.092   2.389
    8   2HG   ARG   1          2HG       ARG   1  11.146  -4.027   3.404
    9   1HD   ARG   1          1HD       ARG   1  11.044  -3.046   1.228
   10   2HD   ARG   1          2HD       ARG   1  12.271  -2.087   2.079
   11    HE   ARG   1           HE       ARG   1  12.769  -4.018  -0.085
   12   1HH1  ARG   1          1HH1      ARG   1  14.039  -1.281   0.993
   13   2HH1  ARG   1          2HH1      ARG   1  15.667  -1.829   1.208
   14   1HH2  ARG   1          1HH2      ARG   1  14.860  -5.186   0.897
   15   2HH2  ARG   1          2HH2      ARG   1  16.133  -4.041   1.154
   16    HA   PRO   2           HA       PRO   2   9.819  -6.777   6.284
   17   1HB   PRO   2          1HB       PRO   2   7.522  -5.512   5.501
   18   2HB   PRO   2          2HB       PRO   2   8.295  -5.236   7.072
   19   1HG   PRO   2          1HG       PRO   2   8.449  -3.635   4.550
   20   2HG   PRO   2          2HG       PRO   2   8.255  -3.074   6.220
   21   1HD   PRO   2          1HD       PRO   2  10.631  -2.999   4.930
   22   2HD   PRO   2          2HD       PRO   2  10.514  -3.306   6.679
   23    H    ASP   3           H        ASP   3   8.245  -8.074   5.001
   24    HA   ASP   3           HA       ASP   3   9.019  -8.097   2.127
   25   1HB   ASP   3          1HB       ASP   3   8.807 -10.027   4.117
   26   2HB   ASP   3          2HB       ASP   3   7.337 -10.264   3.171
   27    H    PHE   4           H        PHE   4   6.317  -7.417   4.252
   28    HA   PHE   4           HA       PHE   4   4.212  -7.902   2.333
   29   1HB   PHE   4          1HB       PHE   4   2.836  -6.610   3.877
   30   2HB   PHE   4          2HB       PHE   4   3.893  -7.685   4.782
   31    HD1  PHE   4           1HD      PHE   4   3.620  -4.126   3.574
   32    HD2  PHE   4           2HD      PHE   4   5.319  -6.861   6.434
   33    HE1  PHE   4           1HE      PHE   4   4.483  -2.228   4.887
   34    HE2  PHE   4           2HE      PHE   4   6.186  -4.941   7.739
   35    HZ   PHE   4           HZ       PHE   4   5.762  -2.627   6.967
   36    H    CYS   5           H        CYS   5   6.573  -5.407   2.583
   37    HA   CYS   5           HA       CYS   5   5.019  -3.428   1.056
   38   1HB   CYS   5          1HB       CYS   5   7.549  -3.646   2.530
   39   2HB   CYS   5          2HB       CYS   5   7.679  -2.668   1.066
   40    H    LEU   6           H        LEU   6   7.267  -6.028   0.455
   41    HA   LEU   6           HA       LEU   6   8.073  -5.176  -2.214
   42   1HB   LEU   6          1HB       LEU   6   8.061  -7.939  -0.956
   43   2HB   LEU   6          2HB       LEU   6   9.086  -7.387  -2.277
   44    HG   LEU   6           HG       LEU   6   9.130  -6.356   0.576
   45   1HD1  LEU   6          1HD1      LEU   6  10.254  -8.419   0.597
   46   2HD1  LEU   6          2HD1      LEU   6  11.556  -7.266   0.302
   47   3HD1  LEU   6          3HD1      LEU   6  10.883  -8.198  -1.036
   48   1HD2  LEU   6          1HD2      LEU   6   9.613  -4.572  -1.061
   49   2HD2  LEU   6          2HD2      LEU   6  10.819  -5.603  -1.832
   50   3HD2  LEU   6          3HD2      LEU   6  11.075  -5.026  -0.186
   51    H    GLU   7           H        GLU   7   5.405  -6.972  -0.832
   52    HA   GLU   7           HA       GLU   7   4.521  -8.222  -3.310
   53   1HB   GLU   7          1HB       GLU   7   3.499  -7.784  -0.522
   54   2HB   GLU   7          2HB       GLU   7   2.368  -8.334  -1.759
   55   1HG   GLU   7          1HG       GLU   7   4.563  -9.962  -2.184
   56   2HG   GLU   7          2HG       GLU   7   4.550  -9.789  -0.429
   57    HA   PRO   8           HA       PRO   8   2.205  -4.916  -5.052
   58   1HB   PRO   8          1HB       PRO   8  -0.060  -6.179  -5.942
   59   2HB   PRO   8          2HB       PRO   8   1.522  -6.354  -6.729
   60   1HG   PRO   8          1HG       PRO   8   0.121  -8.174  -4.822
   61   2HG   PRO   8          2HG       PRO   8   1.066  -8.569  -6.267
   62   1HD   PRO   8          1HD       PRO   8   2.028  -8.777  -3.717
   63   2HD   PRO   8          2HD       PRO   8   3.059  -8.458  -5.131
   64    HA   PRO   9           HA       PRO   9  -0.747  -3.437  -2.145
   65   1HB   PRO   9          1HB       PRO   9  -2.489  -2.015  -3.715
   66   2HB   PRO   9          2HB       PRO   9  -0.857  -1.449  -3.310
   67   1HG   PRO   9          1HG       PRO   9  -1.873  -2.741  -5.798
   68   2HG   PRO   9          2HG       PRO   9  -0.700  -1.427  -5.605
   69   1HD   PRO   9          1HD       PRO   9  -0.016  -4.028  -6.121
   70   2HD   PRO   9          2HD       PRO   9   1.041  -2.878  -5.272
   71    H    TYR  10           H        TYR  10  -3.216  -3.418  -1.681
   72    HA   TYR  10           HA       TYR  10  -4.546  -5.790  -2.975
   73   1HB   TYR  10          1HB       TYR  10  -3.508  -6.171  -0.700
   74   2HB   TYR  10          2HB       TYR  10  -4.622  -4.965  -0.058
   75    HD1  TYR  10           1HD      TYR  10  -6.715  -5.661   0.718
   76    HD2  TYR  10           2HD      TYR  10  -4.621  -8.082  -2.147
   77    HE1  TYR  10           1HE      TYR  10  -8.487  -7.388   0.882
   78    HE2  TYR  10           2HE      TYR  10  -6.393  -9.809  -1.982
   79    HH   TYR  10           HH       TYR  10  -8.113 -10.530  -0.394
   80    H    THR  11           H        THR  11  -5.889  -4.471  -4.272
   81    HA   THR  11           HA       THR  11  -7.413  -2.230  -3.342
   82    HB   THR  11           HB       THR  11  -7.541  -4.225  -5.598
   83    HG1  THR  11           1HG      THR  11  -6.246  -2.627  -6.129
   84   1HG2  THR  11          1HG2      THR  11  -9.446  -2.699  -6.490
   85   2HG2  THR  11          2HG2      THR  11  -9.689  -2.269  -4.798
   86   3HG2  THR  11          3HG2      THR  11  -9.863  -3.946  -5.315
   87    H    GLY  12           H        GLY  12  -7.725  -5.673  -2.942
   88   1HA   GLY  12          1HA       GLY  12  -9.309  -6.972  -1.790
   89   2HA   GLY  12          2HA       GLY  12  -9.690  -5.500  -0.895
   90    HA   PRO  13           HA       PRO  13 -13.179  -6.669  -3.792
   91   1HB   PRO  13          1HB       PRO  13 -15.040  -7.366  -1.900
   92   2HB   PRO  13          2HB       PRO  13 -13.910  -8.521  -2.621
   93   1HG   PRO  13          1HG       PRO  13 -13.813  -7.158   0.024
   94   2HG   PRO  13          2HG       PRO  13 -13.354  -8.811  -0.413
   95   1HD   PRO  13          1HD       PRO  13 -11.580  -6.734  -0.040
   96   2HD   PRO  13          2HD       PRO  13 -11.246  -8.179  -1.021
   97    H    CYS  14           H        CYS  14 -15.437  -5.868  -1.448
   98    HA   CYS  14           HA       CYS  14 -16.656  -3.891  -1.053
   99   1HB   CYS  14          1HB       CYS  14 -13.738  -3.209  -0.876
  100   2HB   CYS  14          2HB       CYS  14 -14.924  -1.910  -0.739
  101    H    LYS  15           H        LYS  15 -16.778  -1.445  -1.924
  102    HA   LYS  15           HA       LYS  15 -16.258  -1.483  -4.879
  103   1HB   LYS  15          1HB       LYS  15 -18.728  -0.789  -3.280
  104   2HB   LYS  15          2HB       LYS  15 -18.519  -0.240  -4.941
  105   1HG   LYS  15          1HG       LYS  15 -18.516  -2.445  -5.790
  106   2HG   LYS  15          2HG       LYS  15 -18.175  -3.146  -4.208
  107   1HD   LYS  15          1HD       LYS  15 -20.370  -3.016  -3.531
  108   2HD   LYS  15          2HD       LYS  15 -20.680  -1.552  -4.464
  109   1HE   LYS  15          1HE       LYS  15 -20.457  -3.057  -6.560
  110   2HE   LYS  15          2HE       LYS  15 -20.621  -4.420  -5.435
  111   1HZ   LYS  15          1HZ       LYS  15 -22.493  -2.129  -5.774
  112   2HZ   LYS  15          2HZ       LYS  15 -22.623  -3.288  -4.539
  113   3HZ   LYS  15          3HZ       LYS  15 -22.798  -3.750  -6.164
  114    H    ALA  16           H        ALA  16 -15.449   0.027  -2.066
  115    HA   ALA  16           HA       ALA  16 -15.807   2.824  -2.726
  116   1HB   ALA  16          1HB       ALA  16 -13.659   2.597  -0.971
  117   2HB   ALA  16          2HB       ALA  16 -14.583   1.126  -0.670
  118   3HB   ALA  16          3HB       ALA  16 -15.355   2.702  -0.502
  119    H    ARG  17           H        ARG  17 -13.868   4.288  -3.091
  120    HA   ARG  17           HA       ARG  17 -11.677   2.967  -4.638
  121   1HB   ARG  17          1HB       ARG  17 -13.737   4.961  -5.500
  122   2HB   ARG  17          2HB       ARG  17 -12.116   5.102  -6.181
  123   1HG   ARG  17          1HG       ARG  17 -12.258   3.062  -7.279
  124   2HG   ARG  17          2HG       ARG  17 -13.412   2.402  -6.120
  125   1HD   ARG  17          1HD       ARG  17 -15.160   3.077  -7.404
  126   2HD   ARG  17          2HD       ARG  17 -14.517   4.730  -7.494
  127    HE   ARG  17           HE       ARG  17 -13.174   2.659  -9.148
  128   1HH1  ARG  17          1HH1      ARG  17 -16.070   4.306  -9.327
  129   2HH1  ARG  17          2HH1      ARG  17 -15.724   5.131 -10.810
  130   1HH2  ARG  17          1HH2      ARG  17 -12.395   4.164 -10.884
  131   2HH2  ARG  17          2HH2      ARG  17 -13.645   5.050 -11.693
  132    H    ILE  18           H        ILE  18 -10.685   3.575  -2.428
  133    HA   ILE  18           HA       ILE  18 -10.110   6.468  -2.101
  134    HB   ILE  18           HB       ILE  18  -9.375   4.003  -0.486
  135   1HG1  ILE  18          1HG1      ILE  18 -11.501   6.092   0.064
  136   2HG1  ILE  18          2HG1      ILE  18 -11.841   4.545  -0.713
  137   1HG2  ILE  18          1HG2      ILE  18  -8.572   6.795  -0.313
  138   2HG2  ILE  18          2HG2      ILE  18  -7.981   5.406   0.600
  139   3HG2  ILE  18          3HG2      ILE  18  -9.412   6.278   1.149
  140   1HD1  ILE  18          1HD1      ILE  18 -11.958   3.571   1.313
  141   2HD1  ILE  18          2HD1      ILE  18 -11.576   5.109   2.086
  142   3HD1  ILE  18          3HD1      ILE  18 -10.277   4.013   1.615
  143    H    ILE  19           H        ILE  19  -7.946   7.279  -2.155
  144    HA   ILE  19           HA       ILE  19  -6.087   5.696  -3.849
  145    HB   ILE  19           HB       ILE  19  -6.103   8.580  -2.894
  146   1HG1  ILE  19          1HG1      ILE  19  -8.010   8.019  -4.361
  147   2HG1  ILE  19          2HG1      ILE  19  -6.869   9.075  -5.192
  148   1HG2  ILE  19          1HG2      ILE  19  -4.381   8.975  -4.543
  149   2HG2  ILE  19          2HG2      ILE  19  -4.491   7.314  -5.125
  150   3HG2  ILE  19          3HG2      ILE  19  -3.849   7.644  -3.516
  151   1HD1  ILE  19          1HD1      ILE  19  -7.472   7.318  -6.732
  152   2HD1  ILE  19          2HD1      ILE  19  -7.172   6.075  -5.518
  153   3HD1  ILE  19          3HD1      ILE  19  -5.825   6.992  -6.191
  154    H    ARG  20           H        ARG  20  -5.436   4.219  -2.075
  155    HA   ARG  20           HA       ARG  20  -4.071   5.364   0.271
  156   1HB   ARG  20          1HB       ARG  20  -4.828   2.662  -0.792
  157   2HB   ARG  20          2HB       ARG  20  -3.624   2.766   0.491
  158   1HG   ARG  20          1HG       ARG  20  -6.318   4.138   0.650
  159   2HG   ARG  20          2HG       ARG  20  -6.038   2.511   1.270
  160   1HD   ARG  20          1HD       ARG  20  -4.998   3.320   3.126
  161   2HD   ARG  20          2HD       ARG  20  -3.990   4.418   2.162
  162    HE   ARG  20           HE       ARG  20  -5.863   6.020   2.177
  163   1HH1  ARG  20          1HH2      ARG  20  -5.443   4.134   4.882
  164   2HH1  ARG  20          2HH2      ARG  20  -7.024   4.391   5.542
  165   1HH2  ARG  20          1HH1      ARG  20  -8.244   5.967   2.705
  166   2HH2  ARG  20          2HH1      ARG  20  -8.609   5.428   4.310
  167    H    TYR  21           H        TYR  21  -1.808   4.364   0.760
  168    HA   TYR  21           HA       TYR  21  -0.140   4.572  -1.721
  169   1HB   TYR  21          1HB       TYR  21   0.278   5.275   1.189
  170   2HB   TYR  21          2HB       TYR  21   1.624   5.189   0.055
  171    HD1  TYR  21           1HD      TYR  21  -1.469   6.978   0.953
  172    HD2  TYR  21           2HD      TYR  21   1.879   6.818  -1.735
  173    HE1  TYR  21           1HE      TYR  21  -1.998   9.266   0.162
  174    HE2  TYR  21           2HE      TYR  21   1.346   9.108  -2.531
  175    HH   TYR  21           HH       TYR  21   0.120  11.158  -1.538
  176    H    PHE  22           H        PHE  22   1.618   3.096  -1.961
  177    HA   PHE  22           HA       PHE  22   1.919   0.911   0.020
  178   1HB   PHE  22          1HB       PHE  22   1.245  -0.793  -1.460
  179   2HB   PHE  22          2HB       PHE  22   0.066   0.470  -1.746
  180    HD1  PHE  22           1HD      PHE  22   0.110   1.811  -3.805
  181    HD2  PHE  22           2HD      PHE  22   2.965  -1.321  -3.106
  182    HE1  PHE  22           1HE      PHE  22   0.754   1.864  -6.200
  183    HE2  PHE  22           2HE      PHE  22   3.612  -1.267  -5.501
  184    HZ   PHE  22           HZ       PHE  22   2.507   0.326  -7.048
  185    H    TYR  23           H        TYR  23   3.889  -0.324  -0.388
  186    HA   TYR  23           HA       TYR  23   6.010   1.345  -1.568
  187   1HB   TYR  23          1HB       TYR  23   6.257   0.138   0.580
  188   2HB   TYR  23          2HB       TYR  23   6.051  -1.401  -0.267
  189    HD1  TYR  23           1HD      TYR  23   7.967  -2.507  -1.047
  190    HD2  TYR  23           2HD      TYR  23   8.107   1.741  -0.431
  191    HE1  TYR  23           1HE      TYR  23  10.369  -2.501  -1.650
  192    HE2  TYR  23           2HE      TYR  23  10.512   1.748  -1.032
  193    HH   TYR  23           HH       TYR  23  12.432  -0.091  -0.936
  194    H    ASN  24           H        ASN  24   6.377   1.210  -3.758
  195    HA   ASN  24           HA       ASN  24   5.716  -1.262  -5.248
  196   1HB   ASN  24          1HB       ASN  24   5.188   1.074  -6.035
  197   2HB   ASN  24          2HB       ASN  24   6.919   1.369  -6.167
  198   1HD2  ASN  24          1HD2      ASN  24   4.914   1.288  -8.387
  199   2HD2  ASN  24          2HD2      ASN  24   5.439   0.064  -9.439
  200    H    ALA  25           H        ALA  25   7.363  -2.754  -4.593
  201    HA   ALA  25           HA       ALA  25  10.104  -2.246  -4.218
  202   1HB   ALA  25          1HB       ALA  25  10.280  -4.570  -4.268
  203   2HB   ALA  25          2HB       ALA  25   9.182  -4.722  -5.640
  204   3HB   ALA  25          3HB       ALA  25   8.542  -4.387  -4.031
  205    H    LYS  26           H        LYS  26   8.263  -2.402  -7.186
  206    HA   LYS  26           HA       LYS  26  10.567  -2.683  -8.959
  207   1HB   LYS  26          1HB       LYS  26   7.718  -2.758  -9.063
  208   2HB   LYS  26          2HB       LYS  26   8.240  -1.503 -10.187
  209   1HG   LYS  26          1HG       LYS  26   9.940  -3.223 -11.058
  210   2HG   LYS  26          2HG       LYS  26   9.022  -4.425 -10.152
  211   1HD   LYS  26          1HD       LYS  26   7.015  -3.113 -11.469
  212   2HD   LYS  26          2HD       LYS  26   8.323  -2.997 -12.645
  213   1HE   LYS  26          1HE       LYS  26   8.665  -5.485 -12.409
  214   2HE   LYS  26          2HE       LYS  26   7.217  -5.533 -11.384
  215   1HZ   LYS  26          1HZ       LYS  26   6.645  -5.923 -13.705
  216   2HZ   LYS  26          2HZ       LYS  26   7.381  -4.461 -14.159
  217   3HZ   LYS  26          3HZ       LYS  26   5.989  -4.448 -13.185
  218    H    ALA  27           H        ALA  27   8.873  -0.043  -7.383
  219    HA   ALA  27           HA       ALA  27  10.181   1.985  -9.124
  220   1HB   ALA  27          1HB       ALA  27   8.493   3.365  -8.376
  221   2HB   ALA  27          2HB       ALA  27   8.521   2.685  -6.748
  222   3HB   ALA  27          3HB       ALA  27   7.714   1.816  -8.054
  223    H    GLY  28           H        GLY  28  10.451   0.563  -5.928
  224   1HA   GLY  28          1HA       GLY  28  12.435   0.710  -4.575
  225   2HA   GLY  28          2HA       GLY  28  12.912   2.149  -5.477
  226    H    LEU  29           H        LEU  29   9.796   2.780  -4.936
  227    HA   LEU  29           HA       LEU  29  10.138   3.761  -2.142
  228   1HB   LEU  29          1HB       LEU  29   9.348   5.975  -2.929
  229   2HB   LEU  29          2HB       LEU  29  10.829   5.503  -3.758
  230    HG   LEU  29           HG       LEU  29   8.428   4.541  -5.133
  231   1HD1  LEU  29          1HD1      LEU  29   7.550   6.655  -5.851
  232   2HD1  LEU  29          2HD1      LEU  29   8.852   7.538  -5.053
  233   3HD1  LEU  29          3HD1      LEU  29   7.622   6.721  -4.090
  234   1HD2  LEU  29          1HD2      LEU  29  10.798   4.661  -6.005
  235   2HD2  LEU  29          2HD2      LEU  29  10.632   6.417  -6.038
  236   3HD2  LEU  29          3HD2      LEU  29   9.600   5.414  -7.058
  237    H    CYS  30           H        CYS  30   7.583   5.326  -2.651
  238    HA   CYS  30           HA       CYS  30   5.702   2.995  -2.625
  239   1HB   CYS  30          1HB       CYS  30   5.693   5.622  -1.110
  240   2HB   CYS  30          2HB       CYS  30   4.387   4.441  -1.047
  241    H    GLN  31           H        GLN  31   3.558   3.418  -3.467
  242    HA   GLN  31           HA       GLN  31   3.251   5.876  -5.133
  243   1HB   GLN  31          1HB       GLN  31   3.042   2.975  -5.992
  244   2HB   GLN  31          2HB       GLN  31   2.433   4.314  -6.965
  245   1HG   GLN  31          1HG       GLN  31   4.943   5.209  -6.416
  246   2HG   GLN  31          2HG       GLN  31   5.228   3.469  -6.436
  247   1HE2  GLN  31          1HE2      GLN  31   6.399   3.627  -8.497
  248   2HE2  GLN  31          2HE2      GLN  31   5.576   3.915  -9.953
  249    H    THR  32           H        THR  32   0.841   5.778  -6.058
  250    HA   THR  32           HA       THR  32  -0.895   5.133  -3.729
  251    HB   THR  32           HB       THR  32  -2.487   6.580  -5.213
  252    HG1  THR  32           1HG      THR  32  -1.564   7.600  -6.857
  253   1HG2  THR  32          1HG2      THR  32  -1.272   7.308  -3.132
  254   2HG2  THR  32          2HG2      THR  32  -1.536   8.603  -4.299
  255   3HG2  THR  32          3HG2      THR  32   0.052   7.850  -4.162
  256    H    PHE  33           H        PHE  33  -2.687   3.760  -3.930
  257    HA   PHE  33           HA       PHE  33  -3.201   2.513  -6.591
  258   1HB   PHE  33          1HB       PHE  33  -2.852   0.323  -5.750
  259   2HB   PHE  33          2HB       PHE  33  -1.510   1.254  -5.102
  260    HD1  PHE  33           1HD      PHE  33  -4.569  -0.580  -4.318
  261    HD2  PHE  33           2HD      PHE  33  -1.504   1.961  -2.697
  262    HE1  PHE  33           1HE      PHE  33  -5.241  -1.226  -2.022
  263    HE2  PHE  33           2HE      PHE  33  -2.182   1.325  -0.413
  264    HZ   PHE  33           HZ       PHE  33  -4.047  -0.276  -0.068
  265    H    VAL  34           H        VAL  34  -5.285   1.273  -6.566
  266    HA   VAL  34           HA       VAL  34  -7.372   2.790  -5.215
  267    HB   VAL  34           HB       VAL  34  -7.433   0.212  -6.824
  268   1HG1  VAL  34          1HG1      VAL  34  -9.563   0.264  -5.948
  269   2HG1  VAL  34          2HG1      VAL  34  -9.806   1.373  -7.298
  270   3HG1  VAL  34          3HG1      VAL  34  -9.523   2.006  -5.677
  271   1HG2  VAL  34          1HG2      VAL  34  -6.408   2.262  -7.932
  272   2HG2  VAL  34          2HG2      VAL  34  -7.976   3.048  -7.747
  273   3HG2  VAL  34          3HG2      VAL  34  -7.826   1.604  -8.748
  274    H    TYR  35           H        TYR  35  -8.051   2.396  -3.156
  275    HA   TYR  35           HA       TYR  35  -7.466  -0.262  -1.920
  276   1HB   TYR  35          1HB       TYR  35  -6.558   1.719  -0.828
  277   2HB   TYR  35          2HB       TYR  35  -8.143   2.488  -0.824
  278    HD1  TYR  35           1HD      TYR  35  -7.470  -1.101  -0.093
  279    HD2  TYR  35           2HD      TYR  35  -8.462   2.754   1.527
  280    HE1  TYR  35           1HE      TYR  35  -7.998  -2.153   2.090
  281    HE2  TYR  35           2HE      TYR  35  -8.988   1.701   3.708
  282    HH   TYR  35           HH       TYR  35  -8.825  -0.198   4.928
  283    H    GLY  36           H        GLY  36  -9.173  -1.490  -1.001
  284   1HA   GLY  36          1HA       GLY  36 -11.864  -0.873  -2.011
  285   2HA   GLY  36          2HA       GLY  36 -11.377  -2.360  -1.202
  286    H    ALA  37           H        ALA  37 -10.226   0.130   0.681
  287    HA   ALA  37           HA       ALA  37 -11.001   1.180   2.652
  288   1HB   ALA  37          1HB       ALA  37 -13.193   1.976   2.602
  289   2HB   ALA  37          2HB       ALA  37 -13.814   0.506   1.854
  290   3HB   ALA  37          3HB       ALA  37 -12.898   1.665   0.892
  291    H    CYS  38           H        CYS  38 -11.188  -2.050   2.040
  292    HA   CYS  38           HA       CYS  38 -11.870  -2.630   4.870
  293   1HB   CYS  38          1HB       CYS  38 -13.499  -4.367   4.145
  294   2HB   CYS  38          2HB       CYS  38 -13.994  -2.751   3.643
  295    H    ARG  39           H        ARG  39 -11.149  -4.793   5.517
  296    HA   ARG  39           HA       ARG  39  -9.497  -6.482   5.572
  297   1HB   ARG  39          1HB       ARG  39 -10.868  -6.477   2.948
  298   2HB   ARG  39          2HB       ARG  39  -9.347  -7.371   2.986
  299   1HG   ARG  39          1HG       ARG  39 -10.129  -8.704   4.869
  300   2HG   ARG  39          2HG       ARG  39 -11.600  -7.737   4.987
  301   1HD   ARG  39          1HD       ARG  39 -12.033  -8.463   2.529
  302   2HD   ARG  39          2HD       ARG  39 -10.811  -9.714   2.838
  303    HE   ARG  39           HE       ARG  39 -12.972  -9.419   4.852
  304   1HH1  ARG  39          1HH2      ARG  39 -14.259 -10.477   2.416
  305   2HH1  ARG  39          2HH2      ARG  39 -14.012 -12.186   2.556
  306   1HH2  ARG  39          1HH1      ARG  39 -11.510 -11.897   4.941
  307   2HH2  ARG  39          2HH1      ARG  39 -12.455 -12.990   3.986
  308    H    ALA  40           H        ALA  40  -8.458  -3.817   5.289
  309    HA   ALA  40           HA       ALA  40  -6.520  -3.588   3.172
  310   1HB   ALA  40          1HB       ALA  40  -5.611  -2.132   5.380
  311   2HB   ALA  40          2HB       ALA  40  -7.357  -2.216   5.608
  312   3HB   ALA  40          3HB       ALA  40  -6.694  -1.540   4.122
  313    H    LYS  41           H        LYS  41  -4.217  -3.909   3.307
  314    HA   LYS  41           HA       LYS  41  -3.371  -5.886   5.403
  315   1HB   LYS  41          1HB       LYS  41  -2.360  -5.485   2.567
  316   2HB   LYS  41          2HB       LYS  41  -1.912  -6.795   3.660
  317   1HG   LYS  41          1HG       LYS  41  -4.384  -7.411   3.732
  318   2HG   LYS  41          2HG       LYS  41  -4.617  -6.274   2.404
  319   1HD   LYS  41          1HD       LYS  41  -4.083  -7.979   1.019
  320   2HD   LYS  41          2HD       LYS  41  -2.426  -7.803   1.599
  321   1HE   LYS  41          1HE       LYS  41  -2.877  -9.436   3.399
  322   2HE   LYS  41          2HE       LYS  41  -4.552  -9.600   2.833
  323   1HZ   LYS  41          1HZ       LYS  41  -3.811 -10.423   0.763
  324   2HZ   LYS  41          2HZ       LYS  41  -2.893 -11.263   1.920
  325   3HZ   LYS  41          3HZ       LYS  41  -2.202  -9.974   1.055
  326    H    ARG  42           H        ARG  42  -0.633  -5.779   4.974
  327    HA   ARG  42           HA       ARG  42   0.082  -3.256   6.251
  328   1HB   ARG  42          1HB       ARG  42   1.927  -5.357   5.076
  329   2HB   ARG  42          2HB       ARG  42   2.257  -4.263   6.416
  330   1HG   ARG  42          1HG       ARG  42   0.364  -5.387   7.672
  331   2HG   ARG  42          2HG       ARG  42   0.310  -6.587   6.383
  332   1HD   ARG  42          1HD       ARG  42   3.035  -6.157   7.364
  333   2HD   ARG  42          2HD       ARG  42   1.935  -6.720   8.636
  334    HE   ARG  42           HE       ARG  42   2.458  -8.129   6.051
  335   1HH1  ARG  42          1HH2      ARG  42  -0.298  -8.235   7.592
  336   2HH1  ARG  42          2HH2      ARG  42  -0.130  -9.782   8.351
  337   1HH2  ARG  42          1HH1      ARG  42   3.272 -10.020   7.716
  338   2HH2  ARG  42          2HH1      ARG  42   1.892 -10.793   8.421
  339    H    ASN  43           H        ASN  43  -0.179  -4.358   2.991
  340    HA   ASN  43           HA       ASN  43   1.695  -2.320   1.924
  341   1HB   ASN  43          1HB       ASN  43   1.188  -4.807   1.146
  342   2HB   ASN  43          2HB       ASN  43  -0.152  -4.043   0.290
  343   1HD2  ASN  43          1HD2      ASN  43   3.405  -3.956   0.643
  344   2HD2  ASN  43          2HD2      ASN  43   3.707  -3.256  -0.874
  345    H    ASN  44           H        ASN  44  -0.235  -0.997   3.285
  346    HA   ASN  44           HA       ASN  44  -1.727   0.432   1.177
  347   1HB   ASN  44          1HB       ASN  44  -3.168  -1.486   1.704
  348   2HB   ASN  44          2HB       ASN  44  -3.043  -1.139   3.427
  349   1HD2  ASN  44          1HD2      ASN  44  -5.595  -1.226   2.444
  350   2HD2  ASN  44          2HD2      ASN  44  -6.261   0.342   2.301
  351    H    PHE  45           H        PHE  45  -0.187   2.052   2.085
  352    HA   PHE  45           HA       PHE  45  -0.631   2.922   4.877
  353   1HB   PHE  45          1HB       PHE  45   1.169   4.057   2.716
  354   2HB   PHE  45          2HB       PHE  45   1.340   4.257   4.459
  355    HD1  PHE  45           1HD      PHE  45   1.889   2.252   5.891
  356    HD2  PHE  45           2HD      PHE  45   1.985   2.108   1.599
  357    HE1  PHE  45           1HE      PHE  45   3.219   0.159   5.992
  358    HE2  PHE  45           2HE      PHE  45   3.317   0.016   1.696
  359    HZ   PHE  45           HZ       PHE  45   3.930  -0.965   3.892
  360    H    LYS  46           H        LYS  46  -1.658   4.832   5.440
  361    HA   LYS  46           HA       LYS  46  -3.584   6.006   3.668
  362   1HB   LYS  46          1HB       LYS  46  -3.571   5.869   6.206
  363   2HB   LYS  46          2HB       LYS  46  -2.382   7.171   6.197
  364   1HG   LYS  46          1HG       LYS  46  -4.009   8.570   4.900
  365   2HG   LYS  46          2HG       LYS  46  -5.199   7.280   5.074
  366   1HD   LYS  46          1HD       LYS  46  -3.959   8.005   7.625
  367   2HD   LYS  46          2HD       LYS  46  -4.782   9.368   6.867
  368   1HE   LYS  46          1HE       LYS  46  -6.874   8.283   6.910
  369   2HE   LYS  46          2HE       LYS  46  -6.138   6.673   7.038
  370   1HZ   LYS  46          1HZ       LYS  46  -5.974   8.827   9.090
  371   2HZ   LYS  46          2HZ       LYS  46  -5.300   7.272   9.222
  372   3HZ   LYS  46          3HZ       LYS  46  -6.987   7.470   9.186
  373    H    SER  47           H        SER  47  -0.243   6.813   4.419
  374    HA   SER  47           HA       SER  47  -0.362   8.978   2.361
  375   1HB   SER  47          1HB       SER  47   0.856  10.454   3.876
  376   2HB   SER  47          2HB       SER  47  -0.606   9.891   4.677
  377    HG   SER  47           HG       SER  47   0.635   9.132   6.162
  378    H    ALA  48           H        ALA  48   1.748   9.442   1.431
  379    HA   ALA  48           HA       ALA  48   3.383   7.143   0.940
  380   1HB   ALA  48          1HB       ALA  48   4.910   8.966  -0.025
  381   2HB   ALA  48          2HB       ALA  48   3.723  10.129   0.562
  382   3HB   ALA  48          3HB       ALA  48   3.262   8.934  -0.650
  383    H    GLU  49           H        GLU  49   3.485   9.633   3.404
  384    HA   GLU  49           HA       GLU  49   6.237   9.226   4.228
  385   1HB   GLU  49          1HB       GLU  49   3.974  10.873   4.848
  386   2HB   GLU  49          2HB       GLU  49   4.560  10.169   6.354
  387   1HG   GLU  49          1HG       GLU  49   6.678  11.148   6.131
  388   2HG   GLU  49          2HG       GLU  49   6.506  11.353   4.387
  389    H    ASP  50           H        ASP  50   3.141   7.760   5.065
  390    HA   ASP  50           HA       ASP  50   4.135   6.301   7.387
  391   1HB   ASP  50          1HB       ASP  50   1.746   7.025   6.848
  392   2HB   ASP  50          2HB       ASP  50   1.718   5.739   5.643
  393    H    CYS  51           H        CYS  51   3.821   5.727   3.931
  394    HA   CYS  51           HA       CYS  51   4.398   2.870   4.026
  395   1HB   CYS  51          1HB       CYS  51   3.151   3.962   2.205
  396   2HB   CYS  51          2HB       CYS  51   4.544   4.976   1.836
  397    H    MET  52           H        MET  52   6.259   5.834   3.312
  398    HA   MET  52           HA       MET  52   8.775   4.454   2.851
  399   1HB   MET  52          1HB       MET  52   7.717   6.940   2.385
  400   2HB   MET  52          2HB       MET  52   8.787   7.274   3.747
  401   1HG   MET  52          1HG       MET  52  10.681   6.835   2.534
  402   2HG   MET  52          2HG       MET  52   9.910   5.549   1.605
  403   1HE   MET  52          1HE       MET  52  10.594   7.397  -1.514
  404   2HE   MET  52          2HE       MET  52  10.013   5.869  -0.857
  405   3HE   MET  52          3HE       MET  52  11.488   6.589  -0.219
  406    H    ARG  53           H        ARG  53   7.352   6.183   5.638
  407    HA   ARG  53           HA       ARG  53   9.628   5.935   7.372
  408   1HB   ARG  53          1HB       ARG  53   7.661   7.465   7.632
  409   2HB   ARG  53          2HB       ARG  53   6.666   6.065   8.032
  410   1HG   ARG  53          1HG       ARG  53   9.103   6.107   9.621
  411   2HG   ARG  53          2HG       ARG  53   8.194   7.605   9.817
  412   1HD   ARG  53          1HD       ARG  53   6.846   4.898   9.990
  413   2HD   ARG  53          2HD       ARG  53   7.561   5.687  11.411
  414    HE   ARG  53           HE       ARG  53   5.379   6.871   9.725
  415   1HH1  ARG  53          1HH1      ARG  53   5.035   5.755  12.578
  416   2HH1  ARG  53          2HH1      ARG  53   5.005   7.227  13.493
  417   1HH2  ARG  53          1HH2      ARG  53   6.292   9.163  10.921
  418   2HH2  ARG  53          2HH2      ARG  53   5.717   9.155  12.554
  419    H    THR  54           H        THR  54   7.389   3.596   6.209
  420    HA   THR  54           HA       THR  54   7.825   1.757   8.508
  421    HB   THR  54           HB       THR  54   6.080   1.700   6.019
  422    HG1  THR  54           1HG      THR  54   4.458   1.872   7.693
  423   1HG2  THR  54          1HG2      THR  54   5.250  -0.173   8.012
  424   2HG2  THR  54          2HG2      THR  54   6.949  -0.475   7.647
  425   3HG2  THR  54          3HG2      THR  54   5.752  -0.491   6.351
  426    H    CYS  55           H        CYS  55   8.019   1.604   4.926
  427    HA   CYS  55           HA       CYS  55  10.037  -0.588   5.195
  428   1HB   CYS  55          1HB       CYS  55   8.395   0.356   2.825
  429   2HB   CYS  55          2HB       CYS  55   9.348  -1.125   2.911
  430    H    GLY  56           H        GLY  56   9.771   2.744   4.360
  431   1HA   GLY  56          1HA       GLY  56  11.654   3.089   2.310
  432   2HA   GLY  56          2HA       GLY  56  11.399   4.261   3.603
  433    H    GLY  57           H        GLY  57  13.897   3.156   2.221
  434   1HA   GLY  57          1HA       GLY  57  15.888   3.473   3.977
  435   2HA   GLY  57          2HA       GLY  57  15.300   1.895   4.504
  436    H    ALA  58           H        ALA  58  15.824   3.396   1.290
  437    HA   ALA  58           HA       ALA  58  17.339   0.925   0.516
  438   1HB   ALA  58          1HB       ALA  58  16.242   1.039  -1.505
  439   2HB   ALA  58          2HB       ALA  58  16.228   2.803  -1.510
  440   3HB   ALA  58          3HB       ALA  58  15.054   1.914  -0.539